| 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 | 42.2 | Very low | 59.3 | Low | 212 Ų | 212 | 140.3 Ų | 140.3 | 100% | 1.044 | 69% | 0.687 | S | S | * | * | 0 | 89.5 | 0 | -172.2 | 170.8 | 169.7 | 0 | 0 | 108.3 | H3 | M1-H3 PolarHBondContact O-N 2.69Š| |||
| 2 | F | 51.8 | Low | 59.5 | Low | 199 Ų | 199 | 136.6 Ų | 136.6 | 87% | 0.873 | 67% | 0.671 | S | S | * | * | trans | -70.3 | 112.3 | -179.4 | -78.7 | -84.4 | 0 | 0 | 0 | 108.9 | R4 | F2-R4 PolarHBondContact O-N 3.38Š| ||
| 3 | H | 53.8 | Low | 59.9 | Low | 169 Ų | 169 | 132.7 Ų | 132.7 | 78% | 0.782 | 67% | 0.666 | S | S | * | * | trans | -64.7 | 85.1 | 171.1 | -73.4 | 86.8 | 0 | 0 | 0 | 108.4 | M1 S5 | M1-H3 PolarHBondContact O-N 2.69Å; H3-S5 PolarHBondContact O-N 3.28Å | ||
| 4 | R | 59.1 | Low | 60.4 | Low | 193 Ų | 193 | 132.9 Ų | 132.9 | 73% | 0.728 | 67% | 0.668 | S | S | * | * | trans | -68.6 | 97.3 | 175.7 | -78.6 | -158.7 | -171.7 | -172.2 | 9.4 | 108 | F2 K6 | F2-R4 PolarHBondContact O-N 3.38Å; R4-K6 PolarHBondContact O-N 3.3Å; R4-K6 VanDerWaalsContact O-N 3.09Å | ||
| 5 | S | 59.8 | Low | 60.2 | Low | 63 Ų | 63 | 128.5 Ų | 128.5 | 44% | 0.441 | 65% | 0.651 | S | S | . | * | trans | -55.8 | 114.7 | 177.5 | -161.4 | 0 | 0 | 0 | 0 | 110 | H3 T7 I8 K9 | H3-S5 PolarHBondContact O-N 3.28Å; S5-T7 PolarHBondContact O-N 3.43Å; S5-I8 PolarHBondContact O-N 2.94Å; S5-I8 VanDerWaalsContact O-N 3.1Å; S5-K9 PolarHBondContact O-N 3.14Å | ||
| 6 | K | 62.7 | Low | 59.8 | Low | 187 Ų | 187 | 128 Ų | 128 | 81% | 0.813 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -59 | -30.6 | -174.6 | -65.7 | -178.1 | -178 | 179.7 | 0 | 111.6 | R4 I8 K9 G10 | R4-K6 PolarHBondContact O-N 3.3Å; R4-K6 VanDerWaalsContact O-N 3.09Å; K6-I8 PolarHBondContact O-N 3.03Å; K6-K9 WeakPolarHBondContact O-CB 3.47Å; K6-K9 PolarHBondContact O-N 3.39Å; K6-G10 PolarHBondContact O-N 3.47Å |
| 7 | T | 64.8 | Low | 59.5 | Low | 114 Ų | 114 | 122 Ų | 122 | 70% | 0.699 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -60.1 | -43.7 | 176.5 | -38.7 | 0 | 0 | 0 | 0 | 112 | S5 K9 G10 L11 | S5-T7 PolarHBondContact O-N 3.43Å; T7-K9 VanDerWaalsContact C-N 3.31Å; T7-K9 PolarHBondContact O-N 3.3Å; T7-G10 PolarHBondContact O-N 3.05Å; T7-L11 PolarHBondContact O-N 2.93Å |
| 8 | I | 62.6 | Low | 59.4 | Low | 110 Ų | 110 | 124.3 Ų | 124.3 | 56% | 0.564 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -66.8 | -38.3 | 178.2 | -52.8 | 177.9 | 0 | 0 | 0 | 109.7 | S5 K6 L12 | S5-I8 PolarHBondContact O-N 2.94Å; S5-I8 VanDerWaalsContact O-N 3.1Å; K6-I8 PolarHBondContact O-N 3.03Å; I8-L12 WeakPolarHBondContact O-CB 3.19Å; I8-L12 PolarHBondContact O-N 3.48Å |
| 9 | K | 63.6 | Low | 59.2 | Low | 132 Ų | 132 | 128.3 Ų | 128.3 | 57% | 0.574 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -65.4 | -37.5 | 176.4 | -123.9 | -174.4 | -179.2 | -167.2 | 0 | 112.5 | S5 K6 T7 L12 S13 | S5-K9 PolarHBondContact O-N 3.14Å; K6-K9 WeakPolarHBondContact O-CB 3.47Å; K6-K9 PolarHBondContact O-N 3.39Å; T7-K9 VanDerWaalsContact C-N 3.31Å; T7-K9 PolarHBondContact O-N 3.3Å; K9-L12 CarbonylContact O-C 3.47Å; K9-L12 PolarHBondContact O-N 3.29Å; K9-S13 WeakPolarHBondContact O-CB 3.45Å; K9-S13 PolarHBondContact O-N 2.94Å |
| 10 | G | 66.7 | Low | 59.1 | Low | 35 Ų | 35 | 134.1 Ų | 134.1 | 36% | 0.361 | 67% | 0.669 | S | S | . | * | H | α-helix | trans | -66.2 | -47.8 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112 | K6 T7 L12 S13 I14 | K6-G10 PolarHBondContact O-N 3.47Å; T7-G10 PolarHBondContact O-N 3.05Å; G10-L12 VanDerWaalsContact C-N 3.3Å; G10-L12 PolarHBondContact O-N 3.46Å; G10-S13 WeakPolarHBondContact CA-OG 3.49Å; G10-S13 PolarHBondContact O-N 3.19Å; G10-S13 PolarHBondContact O-OG 3.4Å; G10-I14 PolarHBondContact O-N 3.09Å |
| 11 | L | 65.5 | Low | 59.1 | Low | 129 Ų | 129 | 131.9 Ų | 131.9 | 68% | 0.675 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -61.9 | -39 | 174.4 | -152.1 | 75.1 | 0 | 0 | 0 | 111.5 | T7 S13 I14 | T7-L11 PolarHBondContact O-N 2.93Å; L11-S13 PolarHBondContact O-N 3.1Å; L11-I14 WeakPolarHBondContact O-CG2 3.39Å; L11-I14 PolarHBondContact O-N 2.94Å |
| 12 | L | 61.8 | Low | 60.3 | Low | 96 Ų | 96 | 124.5 Ų | 124.5 | 50% | 0.503 | 64% | 0.637 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -73.5 | -3.2 | 172 | -116.3 | 71.8 | 0 | 0 | 0 | 114.6 | I8 K9 G10 R25 | I8-L12 WeakPolarHBondContact O-CB 3.19Å; I8-L12 PolarHBondContact O-N 3.48Å; K9-L12 CarbonylContact O-C 3.47Å; K9-L12 PolarHBondContact O-N 3.29Å; G10-L12 VanDerWaalsContact C-N 3.3Å; G10-L12 PolarHBondContact O-N 3.46Å; L12-R25 VanDerWaalsContact O-CZ 3.32Å; L12-R25 PolarHBondContact O-NH1 3.2Å; L12-R25 VanDerWaalsContact O-NH1 3.14Å; L12-R25 PolarHBondContact O-NH2 3.05Å |
| 13 | S | 64.1 | Low | 60.8 | Low | 86 Ų | 86 | 119.5 Ų | 119.5 | 60% | 0.601 | 63% | 0.633 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.5 | -16.3 | 173.8 | 65.1 | 0 | 0 | 0 | 0 | 113.2 | K9 G10 L11 V15 | K9-S13 WeakPolarHBondContact O-CB 3.45Å; K9-S13 PolarHBondContact O-N 2.94Å; G10-S13 WeakPolarHBondContact CA-OG 3.49Å; G10-S13 PolarHBondContact O-N 3.19Å; G10-S13 PolarHBondContact O-OG 3.4Å; L11-S13 PolarHBondContact O-N 3.1Å; S13-V15 PolarHBondContact O-N 2.77Å |
| 14 | I | 67.1 | Low | 61.5 | Low | 136 Ų | 136 | 119.1 Ų | 119.1 | 70% | 0.697 | 63% | 0.626 | S | S | * | * | S | Bend | trans | -73.2 | -12.7 | -178.3 | -135.5 | 158.2 | 0 | 0 | 0 | 113.2 | G10 L11 P16 | G10-I14 PolarHBondContact O-N 3.09Å; L11-I14 WeakPolarHBondContact O-CG2 3.39Å; L11-I14 PolarHBondContact O-N 2.94Å; I14-P16 WeakPolarHBondContact O-CD 3.34Å |
| 15 | V | 58.3 | Low | 62 | Low | 67 Ų | 67 | 111.9 Ų | 111.9 | 41% | 0.406 | 60% | 0.598 | S | S | . | * | S | Bend | trans | -91 | 105.2 | 177.3 | -153.6 | 0 | 0 | 0 | 0 | 108.7 | S13 G17 R25 | S13-V15 PolarHBondContact O-N 2.77Å; V15-G17 PolarHBondContact O-N 2.86Å; V15-R25 VanDerWaalsContact CG2-NH2 3.25Å |
| 16 | P | 52.8 | Low | 62.5 | Low | 120 Ų | 120 | 115 Ų | 115 | 78% | 0.779 | 60% | 0.604 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68 | 126.5 | 174.3 | 29.9 | -32.8 | 0 | 0 | 0 | 108 | I14 | I14-P16 WeakPolarHBondContact O-CD 3.34Š|
| 17 | G | 55.4 | Low | 63.3 | Low | 26 Ų | 26 | 111 Ų | 111 | 27% | 0.268 | 59% | 0.591 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 142.1 | -3.6 | -175.7 | 0 | 0 | 0 | 0 | 0 | 115.4 | V15 Q19 R20 L21 | V15-G17 PolarHBondContact O-N 2.86Å; G17-Q19 PolarHBondContact O-N 3.21Å; G17-R20 PolarHBondContact O-N 2.64Å; G17-L21 WeakPolarHBondContact O-CB 3.5Å; G17-L21 PolarHBondContact O-N 2.98Å |
| 18 | K | 56.8 | Low | 64 | Low | 164 Ų | 164 | 108.7 Ų | 108.7 | 71% | 0.713 | 58% | 0.578 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.1 | -20.4 | 176.4 | -158.7 | 166.5 | -178.4 | -80.9 | 0 | 114 | ||
| 19 | Q | 55.3 | Low | 64.9 | Low | 200 Ų | 200 | 107.5 Ų | 107.5 | 94% | 0.935 | 57% | 0.572 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.6 | -23.5 | -177.6 | -145.5 | 174.6 | 39.4 | 0 | 0 | 114.5 | G17 | G17-Q19 PolarHBondContact O-N 3.21Š|
| 20 | R | 57.6 | Low | 66 | Low | 243 Ų | 243 | 108 Ų | 108 | 92% | 0.917 | 57% | 0.574 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -112.6 | -26.2 | 178.3 | -74.1 | -157.9 | -165 | 175.5 | 5.8 | 114.9 | G17 | G17-R20 PolarHBondContact O-N 2.64Š|
| 21 | L | 59.3 | Low | 66.9 | Low | 88 Ų | 88 | 114.5 Ų | 114.5 | 46% | 0.461 | 59% | 0.593 | S | S | . | * | trans | -104.1 | 5.7 | -172.9 | -65.8 | 173.7 | 0 | 0 | 0 | 113.9 | G17 A23 Y24 R25 | G17-L21 WeakPolarHBondContact O-CB 3.5Å; G17-L21 PolarHBondContact O-N 2.98Å; L21-A23 PolarHBondContact O-N 3.19Å; L21-A23 VanDerWaalsContact O-N 3.16Å; L21-Y24 CarbonylContact O-C 3.35Å; L21-Y24 WeakPolarHBondContact O-CA 3.18Å; L21-Y24 PolarHBondContact O-N 3.25Å; L21-R25 PolarHBondContact O-N 2.99Å | ||
| 22 | G | 66.8 | Low | 68.1 | Low | 57 Ų | 57 | 112.2 Ų | 112.2 | 59% | 0.588 | 59% | 0.587 | S | S | * | * | G | 310 helix | trans | 20.6 | -104.8 | 167.5 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||
| 23 | A | 64 | Low | 69.5 | Low | 95 Ų | 95 | 112 Ų | 112 | 79% | 0.785 | 59% | 0.585 | S | S | * | * | G | 310 helix | trans | -75.9 | -21.9 | 179.6 | 0 | 0 | 0 | 0 | 0 | 114.7 | L21 R25 | L21-A23 PolarHBondContact O-N 3.19Å; L21-A23 VanDerWaalsContact O-N 3.16Å; A23-R25 VanDerWaalsContact C-N 3.31Å; A23-R25 PolarHBondContact O-N 2.94Å |
| 24 | Y | 66.9 | Low | 70.7 | Confident | 161 Ų | 161 | 109.5 Ų | 109.5 | 63% | 0.631 | 57% | 0.573 | S | S | * | * | G | 310 helix | trans | -89.3 | 10.9 | -178.7 | -88.2 | -83.7 | 0 | 0 | 0 | 114.1 | L21 F26 L27 | L21-Y24 CarbonylContact O-C 3.35Å; L21-Y24 WeakPolarHBondContact O-CA 3.18Å; L21-Y24 PolarHBondContact O-N 3.25Å; Y24-F26 PolarHBondContact O-N 3.31Å; Y24-L27 HydrophobicContact CD1-CB 3.96Å; Y24-L27 HydrophobicContact CD1-CD1 4.09Å; Y24-L27 HydrophobicContact CD1-CD2 3.81Å; Y24-L27 HydrophobicContact CD1-CG 4.16Å; Y24-L27 HydrophobicContact CE1-CD1 4.24Å; Y24-L27 HydrophobicContact CE1-CD2 4.35Å; Y24-L27 WeakPolarHBondContact O-CB 3.46Å; Y24-L27 PolarHBondContact O-N 3.01Å |
| 25 | R | 69.9 | Low | 71.9 | Confident | 40 Ų | 40 | 104.8 Ų | 104.8 | 15% | 0.151 | 56% | 0.558 | C | S | . | * | G | 310 helix | trans | -56.7 | -25.3 | 179.4 | -173.7 | 174.7 | 176.1 | 162 | 8.1 | 113.9 | L12 V15 L21 A23 | L12-R25 VanDerWaalsContact O-CZ 3.32Å; L12-R25 PolarHBondContact O-NH1 3.2Å; L12-R25 VanDerWaalsContact O-NH1 3.14Å; L12-R25 PolarHBondContact O-NH2 3.05Å; V15-R25 VanDerWaalsContact CG2-NH2 3.25Å; L21-R25 PolarHBondContact O-N 2.99Å; A23-R25 VanDerWaalsContact C-N 3.31Å; A23-R25 PolarHBondContact O-N 2.94Å |
| 26 | F | 70.7 | Confident | 73.4 | Confident | 129 Ų | 129 | 105.1 Ų | 105.1 | 57% | 0.566 | 56% | 0.561 | S | S | * | * | G | 310 helix | trans | -86.2 | -15.1 | 178.4 | -58.5 | -78 | 0 | 0 | 0 | 113.5 | Y24 I29 F30 | Y24-F26 PolarHBondContact O-N 3.31Å; F26-I29 HydrophobicContact CD1-CD1 4.24Å; F26-I29 CarbonylContact O-C 3.6Å; F26-I29 WeakPolarHBondContact O-CA 3.36Å; F26-I29 WeakPolarHBondContact O-CB 3.45Å; F26-I29 PolarHBondContact O-N 2.79Å; F26-F30 HydrophobicContact CB-CD2 3.73Å; F26-F30 HydrophobicContact CB-CE2 3.56Å; F26-F30 HydrophobicContact CG-CE2 4.47Å; F26-F30 WeakPolarHBondContact O-CD2 3.35Å; F26-F30 PolarHBondContact O-N 2.82Å |
| 27 | L | 80.1 | Confident | 75 | Confident | 102 Ų | 102 | 104.9 Ų | 104.9 | 53% | 0.534 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -55.3 | -49.7 | -178.3 | -168.9 | 71.9 | 0 | 0 | 0 | 113.9 | Y24 I29 F30 F31 | Y24-L27 HydrophobicContact CD1-CB 3.96Å; Y24-L27 HydrophobicContact CD1-CD1 4.09Å; Y24-L27 HydrophobicContact CD1-CD2 3.81Å; Y24-L27 HydrophobicContact CD1-CG 4.16Å; Y24-L27 HydrophobicContact CE1-CD1 4.24Å; Y24-L27 HydrophobicContact CE1-CD2 4.35Å; Y24-L27 WeakPolarHBondContact O-CB 3.46Å; Y24-L27 PolarHBondContact O-N 3.01Å; L27-I29 PolarHBondContact O-N 3.16Å; L27-F30 PolarHBondContact O-N 3.05Å; L27-F31 PolarHBondContact O-N 2.75Å |
| 28 | P | 79 | Confident | 76.3 | Confident | 66 Ų | 66 | 110 Ų | 110 | 43% | 0.429 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -64.6 | -29.6 | 176.5 | 24.9 | -34.4 | 0 | 0 | 0 | 112.3 | C32 | P28-C32 WeakPolarHBondContact O-CB 3.11Å; P28-C32 PolarHBondContact O-N 3.47Å; P28-C32 PolarHBondContact O-SG 3.45Å |
| 29 | I | 82.1 | Confident | 77.7 | Confident | 86 Ų | 86 | 109.6 Ų | 109.6 | 44% | 0.441 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -70.4 | -45.8 | 177.8 | -56 | 173.1 | 0 | 0 | 0 | 110 | F26 L27 F31 C32 I33 | F26-I29 HydrophobicContact CD1-CD1 4.24Å; F26-I29 CarbonylContact O-C 3.6Å; F26-I29 WeakPolarHBondContact O-CA 3.36Å; F26-I29 WeakPolarHBondContact O-CB 3.45Å; F26-I29 PolarHBondContact O-N 2.79Å; L27-I29 PolarHBondContact O-N 3.16Å; I29-F31 VanDerWaalsContact C-N 3.3Å; I29-F31 PolarHBondContact O-N 3.41Å; I29-C32 PolarHBondContact O-N 2.82Å; I29-I33 HydrophobicContact CG2-CD1 3.76Å; I29-I33 HydrophobicContact CG2-CG1 4.4Å; I29-I33 WeakPolarHBondContact O-CB 3.14Å; I29-I33 VanDerWaalsContact O-CG1 3.25Å; I29-I33 WeakPolarHBondContact O-CG1 3.24Å; I29-I33 PolarHBondContact O-N 3.45Å |
| 30 | F | 85.3 | Confident | 79 | Confident | 142 Ų | 142 | 103.1 Ų | 103.1 | 62% | 0.623 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -62.4 | -37.3 | 175.4 | -79.5 | -71.6 | 0 | 0 | 0 | 112.1 | F26 L27 I33 G34 | F26-F30 HydrophobicContact CB-CD2 3.73Å; F26-F30 HydrophobicContact CB-CE2 3.56Å; F26-F30 HydrophobicContact CG-CE2 4.47Å; F26-F30 WeakPolarHBondContact O-CD2 3.35Å; F26-F30 PolarHBondContact O-N 2.82Å; L27-F30 PolarHBondContact O-N 3.05Å; F30-I33 PolarHBondContact O-N 2.86Å; F30-G34 PolarHBondContact O-N 2.84Å |
| 31 | F | 87.1 | Confident | 79.9 | Confident | 171 Ų | 171 | 98.1 Ų | 98.1 | 75% | 0.75 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -66 | -46.1 | 175.4 | -169.2 | -97.3 | 0 | 0 | 0 | 111.9 | L27 I29 G34 G35 | L27-F31 PolarHBondContact O-N 2.75Å; I29-F31 VanDerWaalsContact C-N 3.3Å; I29-F31 PolarHBondContact O-N 3.41Å; F31-G34 PolarHBondContact O-N 2.83Å; F31-G35 PolarHBondContact O-N 2.87Å |
| 32 | C | 89.9 | Confident | 80.4 | Confident | 82 Ų | 82 | 100.2 Ų | 100.2 | 55% | 0.554 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -62.4 | -43 | 174.9 | -69.8 | 0 | 0 | 0 | 0 | 112 | P28 I29 G35 V36 | P28-C32 WeakPolarHBondContact O-CB 3.11Å; P28-C32 PolarHBondContact O-N 3.47Å; P28-C32 PolarHBondContact O-SG 3.45Å; I29-C32 PolarHBondContact O-N 2.82Å; C32-G35 PolarHBondContact O-N 3.49Å; C32-V36 VanDerWaalsContact O-CB 3.3Å; C32-V36 WeakPolarHBondContact O-CB 3.3Å; C32-V36 WeakPolarHBondContact O-CG2 3.38Å; C32-V36 PolarHBondContact O-N 3.44Å |
| 33 | I | 90.9 | Very high | 80.6 | Confident | 90 Ų | 90 | 101.2 Ų | 101.2 | 46% | 0.462 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -64.3 | -42 | 176.8 | -68.6 | 168.3 | 0 | 0 | 0 | 110.8 | I29 F30 V36 M37 | I29-I33 HydrophobicContact CG2-CD1 3.76Å; I29-I33 HydrophobicContact CG2-CG1 4.4Å; I29-I33 WeakPolarHBondContact O-CB 3.14Å; I29-I33 VanDerWaalsContact O-CG1 3.25Å; I29-I33 WeakPolarHBondContact O-CG1 3.24Å; I29-I33 PolarHBondContact O-N 3.45Å; F30-I33 PolarHBondContact O-N 2.86Å; I33-V36 PolarHBondContact O-N 2.97Å; I33-M37 WeakPolarHBondContact O-CB 3.12Å; I33-M37 WeakPolarHBondContact O-CG 3.17Å; I33-M37 PolarHBondContact O-N 3.34Å |
| 34 | G | 90.3 | Very high | 80.4 | Confident | 34 Ų | 34 | 101.1 Ų | 101.1 | 35% | 0.351 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -61.5 | -48.6 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | F30 F31 V36 M37 E38 | F30-G34 PolarHBondContact O-N 2.84Å; F31-G34 PolarHBondContact O-N 2.83Å; G34-V36 VanDerWaalsContact C-N 3.35Å; G34-V36 PolarHBondContact O-N 3.32Å; G34-M37 WeakPolarHBondContact O-CB 3.25Å; G34-M37 PolarHBondContact O-N 3.47Å; G34-M37 VanDerWaalsContact O-N 3.16Å; G34-E38 PolarHBondContact O-N 3.14Å |
| 35 | G | 91.8 | Very high | 79.8 | Confident | 37 Ų | 37 | 101.7 Ų | 101.7 | 38% | 0.381 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -64.5 | -36.8 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | F31 C32 W39 | F31-G35 PolarHBondContact O-N 2.87Å; C32-G35 PolarHBondContact O-N 3.49Å; G35-W39 WeakPolarHBondContact O-CB 3.18Å; G35-W39 PolarHBondContact O-N 3.33Å |
| 36 | V | 90.2 | Very high | 79 | Confident | 75 Ų | 75 | 106.7 Ų | 106.7 | 46% | 0.455 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -66.9 | -39.4 | 172.5 | 168.5 | 0 | 0 | 0 | 0 | 110.8 | C32 I33 G34 W39 I40 | C32-V36 VanDerWaalsContact O-CB 3.3Å; C32-V36 WeakPolarHBondContact O-CB 3.3Å; C32-V36 WeakPolarHBondContact O-CG2 3.38Å; C32-V36 PolarHBondContact O-N 3.44Å; I33-V36 PolarHBondContact O-N 2.97Å; G34-V36 VanDerWaalsContact C-N 3.35Å; G34-V36 PolarHBondContact O-N 3.32Å; V36-W39 PolarHBondContact O-N 3.25Å; V36-I40 HydrophobicContact CG1-CD1 3.61Å; V36-I40 HydrophobicContact CG1-CG1 4.16Å; V36-I40 VanDerWaalsContact O-CB 3.24Å; V36-I40 WeakPolarHBondContact O-CB 3.42Å; V36-I40 WeakPolarHBondContact O-CG1 3.23Å; V36-I40 PolarHBondContact O-N 2.86Å |
| 37 | M | 85 | Confident | 78.1 | Confident | 115 Ų | 115 | 102.5 Ų | 102.5 | 57% | 0.567 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -62.8 | -46 | 174.7 | -81.6 | -65.1 | -170.3 | 0 | 0 | 111.8 | I33 G34 I40 M41 | I33-M37 WeakPolarHBondContact O-CB 3.12Å; I33-M37 WeakPolarHBondContact O-CG 3.17Å; I33-M37 PolarHBondContact O-N 3.34Å; G34-M37 WeakPolarHBondContact O-CB 3.25Å; G34-M37 PolarHBondContact O-N 3.47Å; G34-M37 VanDerWaalsContact O-N 3.16Å; M37-I40 PolarHBondContact O-N 3.2Å; M37-M41 VanDerWaalsContact O-CG 3.3Å; M37-M41 WeakPolarHBondContact O-CG 3.46Å; M37-M41 PolarHBondContact O-N 2.97Å |
| 38 | E | 83.8 | Confident | 76.6 | Confident | 134 Ų | 134 | 104.3 Ų | 104.3 | 63% | 0.626 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -65.4 | -41.2 | 174.8 | -68.1 | -154.9 | 103 | 0 | 0 | 112.1 | G34 I40 M41 I42 | G34-E38 PolarHBondContact O-N 3.14Å; E38-I40 VanDerWaalsContact C-N 3.34Å; E38-I40 PolarHBondContact O-N 2.73Å; E38-M41 WeakPolarHBondContact O-CB 3.15Å; E38-M41 PolarHBondContact O-N 3.32Å; E38-M41 VanDerWaalsContact O-N 3.12Å; E38-I42 WeakPolarHBondContact O-CG1 3.37Å; E38-I42 PolarHBondContact O-N 3.4Å |
| 39 | W | 86.1 | Confident | 75.4 | Confident | 154 Ų | 154 | 107.7 Ų | 107.7 | 58% | 0.583 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -64 | -38.8 | 175.8 | -179.3 | 76.6 | 0 | 0 | 0 | 111.9 | G35 V36 I42 N43 | G35-W39 WeakPolarHBondContact O-CB 3.18Å; G35-W39 PolarHBondContact O-N 3.33Å; V36-W39 PolarHBondContact O-N 3.25Å; W39-I42 PolarHBondContact O-N 3.47Å; W39-N43 HydrophobicContact CD2-CB 4.28Å; W39-N43 HydrophobicContact CZ2-CB 4.2Å; W39-N43 WeakPolarHBondContact O-CB 3.27Å; W39-N43 PolarHBondContact O-N 3.5Å |
| 40 | I | 81.2 | Confident | 74.1 | Confident | 64 Ų | 64 | 107.4 Ų | 107.4 | 33% | 0.328 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -62.8 | -44.9 | 170.4 | -74.8 | 169.4 | 0 | 0 | 0 | 109.1 | V36 M37 E38 I42 N43 V44 | V36-I40 HydrophobicContact CG1-CD1 3.61Å; V36-I40 HydrophobicContact CG1-CG1 4.16Å; V36-I40 VanDerWaalsContact O-CB 3.24Å; V36-I40 WeakPolarHBondContact O-CB 3.42Å; V36-I40 WeakPolarHBondContact O-CG1 3.23Å; V36-I40 PolarHBondContact O-N 2.86Å; M37-I40 PolarHBondContact O-N 3.2Å; E38-I40 VanDerWaalsContact C-N 3.34Å; E38-I40 PolarHBondContact O-N 2.73Å; I40-I42 PolarHBondContact O-N 3.12Å; I40-N43 PolarHBondContact O-N 2.82Å; I40-V44 HydrophobicContact CG2-CB 3.69Å; I40-V44 HydrophobicContact CG2-CG1 3.61Å; I40-V44 HydrophobicContact CG2-CG2 4.21Å; I40-V44 WeakPolarHBondContact O-CA 3.16Å; I40-V44 WeakPolarHBondContact O-CB 3.12Å; I40-V44 WeakPolarHBondContact O-CG1 2.94Å; I40-V44 PolarHBondContact O-N 3.37Å |
| 41 | M | 77.1 | Confident | 72.5 | Confident | 139 Ų | 139 | 106 Ų | 106 | 69% | 0.685 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -58.8 | -33.5 | 175.9 | -70.7 | 172.3 | 65.5 | 0 | 0 | 112.9 | M37 E38 | M37-M41 VanDerWaalsContact O-CG 3.3Å; M37-M41 WeakPolarHBondContact O-CG 3.46Å; M37-M41 PolarHBondContact O-N 2.97Å; E38-M41 WeakPolarHBondContact O-CB 3.15Å; E38-M41 PolarHBondContact O-N 3.32Å; E38-M41 VanDerWaalsContact O-N 3.12Å |
| 42 | I | 70.6 | Confident | 70.8 | Confident | 132 Ų | 132 | 107.5 Ų | 107.5 | 68% | 0.677 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -81.9 | -40.3 | 177.6 | -64.2 | 163.3 | 0 | 0 | 0 | 112.3 | E38 W39 I40 R45 | E38-I42 WeakPolarHBondContact O-CG1 3.37Å; E38-I42 PolarHBondContact O-N 3.4Å; W39-I42 PolarHBondContact O-N 3.47Å; I40-I42 PolarHBondContact O-N 3.12Å; I42-R45 VanDerWaalsContact O-CB 3.27Å; I42-R45 WeakPolarHBondContact O-CB 3.45Å |
| 43 | N | 69.5 | Low | 69.2 | Low | 77 Ų | 77 | 106.9 Ų | 106.9 | 41% | 0.412 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -91.5 | -42.5 | -173.7 | -167.5 | -89.2 | 0 | 0 | 0 | 112.5 | W39 I40 R45 I46 | W39-N43 HydrophobicContact CD2-CB 4.28Å; W39-N43 HydrophobicContact CZ2-CB 4.2Å; W39-N43 WeakPolarHBondContact O-CB 3.27Å; W39-N43 PolarHBondContact O-N 3.5Å; I40-N43 PolarHBondContact O-N 2.82Å; N43-R45 PolarHBondContact O-N 2.67Å; N43-R45 VanDerWaalsContact O-N 3.14Å; N43-I46 WeakPolarHBondContact O-CB 3.42Å; N43-I46 WeakPolarHBondContact O-CD1 3.28Å; N43-I46 VanDerWaalsContact O-CG1 3.23Å; N43-I46 WeakPolarHBondContact O-CG1 3.46Å; N43-I46 PolarHBondContact O-N 2.86Å |
| 44 | V | 61.2 | Low | 67.6 | Low | 93 Ų | 93 | 106.6 Ų | 106.6 | 56% | 0.564 | 54% | 0.543 | S | S | * | . | S | Bend | trans | -69.9 | 2.1 | 168.9 | 114.4 | 0 | 0 | 0 | 0 | 112.7 | I40 I46 G47 | I40-V44 HydrophobicContact CG2-CB 3.69Å; I40-V44 HydrophobicContact CG2-CG1 3.61Å; I40-V44 HydrophobicContact CG2-CG2 4.21Å; I40-V44 WeakPolarHBondContact O-CA 3.16Å; I40-V44 WeakPolarHBondContact O-CB 3.12Å; I40-V44 WeakPolarHBondContact O-CG1 2.94Å; I40-V44 PolarHBondContact O-N 3.37Å; V44-I46 PolarHBondContact O-N 3.16Å; V44-G47 PolarHBondContact O-N 2.89Å |
| 45 | R | 54.9 | Low | 65.8 | Low | 174 Ų | 174 | 113.5 Ų | 113.5 | 66% | 0.657 | 56% | 0.559 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.8 | 29.5 | 156.8 | -148.3 | 165.8 | 177 | -172.5 | -4.4 | 113.4 | I42 N43 E49 | I42-R45 VanDerWaalsContact O-CB 3.27Å; I42-R45 WeakPolarHBondContact O-CB 3.45Å; N43-R45 PolarHBondContact O-N 2.67Å; N43-R45 VanDerWaalsContact O-N 3.14Å; R45-E49 VanDerWaalsContact CG-OE2 3.28Å; R45-E49 WeakPolarHBondContact CG-OE2 3.3Å; R45-E49 IonicContact CZ-OE2 3.78Å; R45-E49 IonicContact NE-OE2 2.89Å; R45-E49 PolarHBondContact NE-OE2 2.94Å; R45-E49 IonicContact NH2-OE2 3.78Å |
| 46 | I | 51.5 | Low | 64.1 | Low | 145 Ų | 145 | 120.4 Ų | 120.4 | 74% | 0.744 | 57% | 0.574 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -109.8 | 0.8 | 178.2 | -79.3 | 169.1 | 0 | 0 | 0 | 111.2 | N43 V44 | N43-I46 WeakPolarHBondContact O-CB 3.42Å; N43-I46 WeakPolarHBondContact O-CD1 3.28Å; N43-I46 VanDerWaalsContact O-CG1 3.23Å; N43-I46 WeakPolarHBondContact O-CG1 3.46Å; N43-I46 PolarHBondContact O-N 2.86Å; V44-I46 PolarHBondContact O-N 3.16Å |
| 47 | G | 52.3 | Low | 62.4 | Low | 41 Ų | 41 | 125.3 Ų | 125.3 | 42% | 0.423 | 58% | 0.584 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -164.9 | -2.2 | -178.8 | 0 | 0 | 0 | 0 | 0 | 122.3 | V44 | V44-G47 PolarHBondContact O-N 2.89Š|
| 48 | H | 49.5 | Very low | 61.1 | Low | 140 Ų | 140 | 127.3 Ų | 127.3 | 65% | 0.648 | 59% | 0.589 | S | S | * | * | S | Bend | trans | -121.9 | 12.8 | -176.6 | -131.4 | -82.6 | 0 | 0 | 0 | 116 | F51 | H48-F51 AromaticContact CD2-CD2 3.54Å; H48-F51 AromaticContact CD2-CE2 3.3Å; H48-F51 WeakPolarHBondContact CD2-CE2 3.44Å; H48-F51 AromaticContact CE1-CD2 3.44Å; H48-F51 VanDerWaalsContact CE1-CD2 3.44Å; H48-F51 WeakPolarHBondContact CE1-CD2 3.3Å; H48-F51 AromaticContact CE1-CE2 3.58Å; H48-F51 AromaticContact CG-CD2 3.82Å; H48-F51 AromaticContact ND1-CD2 3.75Å; H48-F51 AromaticContact NE2-CD2 3.32Å; H48-F51 VanDerWaalsContact NE2-CD2 3.32Å; H48-F51 WeakPolarHBondContact NE2-CD2 3.32Å; H48-F51 AromaticContact NE2-CE2 2.96Å; H48-F51 WeakPolarHBondContact NE2-CE2 3.28Å; H48-F51 AromaticContact NE2-CZ 3.73Å |
| 49 | E | 53 | Low | 59.7 | Low | 137 Ų | 137 | 128 Ų | 128 | 64% | 0.64 | 59% | 0.59 | S | S | * | * | S | Bend | trans | -92.4 | -7.2 | 154.1 | -58.2 | -175.2 | 90.4 | 0 | 0 | 111.1 | R45 | R45-E49 VanDerWaalsContact CG-OE2 3.28Å; R45-E49 WeakPolarHBondContact CG-OE2 3.3Å; R45-E49 IonicContact CZ-OE2 3.78Å; R45-E49 IonicContact NE-OE2 2.89Å; R45-E49 PolarHBondContact NE-OE2 2.94Å; R45-E49 IonicContact NH2-OE2 3.78Å |
| 50 | T | 55.7 | Low | 58.1 | Low | 79 Ų | 79 | 123.6 Ų | 123.6 | 49% | 0.485 | 58% | 0.584 | S | S | . | * | trans | -107.1 | 15.6 | -174.8 | -49.5 | 0 | 0 | 0 | 0 | 113.2 | Y52 D53 | T50-Y52 PolarHBondContact O-N 2.98Å; T50-D53 HydrophobicContact CG2-CB 3.35Å; T50-D53 VanDerWaalsContact O-CB 3.28Å; T50-D53 WeakPolarHBondContact O-CB 3.19Å; T50-D53 PolarHBondContact O-N 3.13Å | ||
| 51 | F | 50.5 | Low | 57 | Low | 114 Ų | 114 | 126.7 Ų | 126.7 | 50% | 0.5 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -64 | -14 | 163.4 | -101.5 | -94.1 | 0 | 0 | 0 | 112.8 | H48 D53 Y55 | H48-F51 AromaticContact CD2-CD2 3.54Å; H48-F51 AromaticContact CD2-CE2 3.3Å; H48-F51 WeakPolarHBondContact CD2-CE2 3.44Å; H48-F51 AromaticContact CE1-CD2 3.44Å; H48-F51 VanDerWaalsContact CE1-CD2 3.44Å; H48-F51 WeakPolarHBondContact CE1-CD2 3.3Å; H48-F51 AromaticContact CE1-CE2 3.58Å; H48-F51 AromaticContact CG-CD2 3.82Å; H48-F51 AromaticContact ND1-CD2 3.75Å; H48-F51 AromaticContact NE2-CD2 3.32Å; H48-F51 VanDerWaalsContact NE2-CD2 3.32Å; H48-F51 WeakPolarHBondContact NE2-CD2 3.32Å; H48-F51 AromaticContact NE2-CE2 2.96Å; H48-F51 WeakPolarHBondContact NE2-CE2 3.28Å; H48-F51 AromaticContact NE2-CZ 3.73Å; F51-D53 PolarHBondContact O-N 3.27Å; F51-Y55 WeakPolarHBondContact O-CB 2.96Å; F51-Y55 PolarHBondContact O-N 2.88Å; F51-Y55 VanDerWaalsContact O-N 3.13Å |
| 52 | Y | 52.6 | Low | 56.1 | Low | 202 Ų | 202 | 129.7 Ų | 129.7 | 79% | 0.792 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -63 | -31.4 | 164.5 | -136.5 | -87.5 | 0 | 0 | 0 | 112.2 | T50 R56 | T50-Y52 PolarHBondContact O-N 2.98Å; Y52-R56 WeakPolarHBondContact O-CB 3.46Å; Y52-R56 PolarHBondContact O-N 3.44Å |
| 53 | D | 55.6 | Low | 55.4 | Low | 69 Ų | 69 | 128.7 Ų | 128.7 | 37% | 0.369 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -77.1 | -41.4 | -179.3 | -148.4 | -94.3 | 0 | 0 | 0 | 111.4 | T50 F51 Y55 R56 R57 | T50-D53 HydrophobicContact CG2-CB 3.35Å; T50-D53 VanDerWaalsContact O-CB 3.28Å; T50-D53 WeakPolarHBondContact O-CB 3.19Å; T50-D53 PolarHBondContact O-N 3.13Å; F51-D53 PolarHBondContact O-N 3.27Å; D53-Y55 VanDerWaalsContact C-N 3.33Å; D53-Y55 PolarHBondContact O-N 2.96Å; D53-R56 PolarHBondContact O-N 3.47Å; D53-R57 WeakPolarHBondContact O-CG 3.45Å; D53-R57 PolarHBondContact O-N 3.26Å; D53-R57 IonicContact OD1-NE 3.62Å |
| 54 | V | 57.2 | Low | 54.7 | Low | 84 Ų | 84 | 132.2 Ų | 132.2 | 51% | 0.509 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -65.5 | -37.3 | 175.8 | -176.9 | 0 | 0 | 0 | 0 | 111.1 | ||
| 55 | Y | 53.6 | Low | 54.5 | Low | 178 Ų | 178 | 133.6 Ų | 133.6 | 70% | 0.698 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -72 | -36.3 | 175 | -158 | -93.7 | 0 | 0 | 0 | 112.5 | F51 D53 | F51-Y55 WeakPolarHBondContact O-CB 2.96Å; F51-Y55 PolarHBondContact O-N 2.88Å; F51-Y55 VanDerWaalsContact O-N 3.13Å; D53-Y55 VanDerWaalsContact C-N 3.33Å; D53-Y55 PolarHBondContact O-N 2.96Å |
| 56 | R | 54.4 | Low | 54.7 | Low | 182 Ų | 182 | 131 Ų | 131 | 69% | 0.687 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -66.5 | -37.7 | 176.5 | -174.5 | 177.8 | 172.2 | -175.5 | -2.1 | 112.4 | Y52 D53 K59 S60 | Y52-R56 WeakPolarHBondContact O-CB 3.46Å; Y52-R56 PolarHBondContact O-N 3.44Å; D53-R56 PolarHBondContact O-N 3.47Å; R56-K59 PolarHBondContact O-N 3.2Å; R56-S60 PolarHBondContact O-N 3.4Å |
| 57 | R | 56.2 | Low | 55 | Low | 179 Ų | 179 | 131.2 Ų | 131.2 | 68% | 0.675 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -62.3 | -44.3 | 178.4 | -74.4 | -165 | -176.8 | -141.9 | 1.8 | 112.9 | D53 K59 S60 | D53-R57 WeakPolarHBondContact O-CG 3.45Å; D53-R57 PolarHBondContact O-N 3.26Å; D53-R57 IonicContact OD1-NE 3.62Å; R57-K59 VanDerWaalsContact C-N 3.27Å; R57-K59 PolarHBondContact O-N 3.28Å; R57-S60 PolarHBondContact O-N 3.31Å |
| 58 | K | 56.6 | Low | 55.3 | Low | 156 Ų | 156 | 134.2 Ų | 134.2 | 68% | 0.678 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -67.5 | -21.5 | 178.4 | -84.2 | -172.4 | 178.2 | -175.8 | 0 | 114.6 | ||
| 59 | K | 55.2 | Low | 55.6 | Low | 148 Ų | 148 | 132 Ų | 132 | 64% | 0.643 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -80.3 | -30.6 | 177.7 | -136.6 | 177 | -172.6 | -177.8 | 0 | 112.3 | R56 R57 | R56-K59 PolarHBondContact O-N 3.2Å; R57-K59 VanDerWaalsContact C-N 3.27Å; R57-K59 PolarHBondContact O-N 3.28Å |
| 60 | S | 52.7 | Low | 55.8 | Low | 63 Ų | 63 | 130.4 Ų | 130.4 | 44% | 0.441 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -71 | -37.7 | 177.3 | -163.6 | 0 | 0 | 0 | 0 | 112.3 | R56 R57 R62 Q63 Y64 | R56-S60 PolarHBondContact O-N 3.4Å; R57-S60 PolarHBondContact O-N 3.31Å; S60-R62 VanDerWaalsContact C-N 3.31Å; S60-R62 PolarHBondContact O-N 3.28Å; S60-Q63 PolarHBondContact O-N 3.05Å; S60-Y64 WeakPolarHBondContact O-CD2 3.28Å; S60-Y64 PolarHBondContact O-N 3.27Å; S60-Y64 VanDerWaalsContact O-N 3.16Å |
| 61 | E | 58 | Low | 55.8 | Low | 128 Ų | 128 | 128.7 Ų | 128.7 | 60% | 0.598 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -63.4 | -35.8 | 179.5 | -71.4 | 177 | 96.2 | 0 | 0 | 112.5 | Q65 | E61-Q65 WeakPolarHBondContact O-CG 3.46Å; E61-Q65 PolarHBondContact O-N 3.16Å |
| 62 | R | 57.4 | Low | 56 | Low | 202 Ų | 202 | 127.5 Ų | 127.5 | 76% | 0.762 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -71.9 | -31.6 | 178.2 | -72 | -178.6 | 174.1 | 166 | -2.6 | 113.5 | S60 | S60-R62 VanDerWaalsContact C-N 3.31Å; S60-R62 PolarHBondContact O-N 3.28Å |
| 63 | Q | 56 | Low | 56.1 | Low | 111 Ų | 111 | 124 Ų | 124 | 52% | 0.519 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -76.3 | -31.7 | 177.5 | -71.1 | -81.7 | 14.5 | 0 | 0 | 112.5 | S60 K67 | S60-Q63 PolarHBondContact O-N 3.05Å; Q63-K67 PolarHBondContact O-N 3.29Å |
| 64 | Y | 54.4 | Low | 56.1 | Low | 151 Ų | 151 | 126.1 Ų | 126.1 | 59% | 0.592 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -72.7 | -38.2 | 175.8 | -93.5 | -94.4 | 0 | 0 | 0 | 112.5 | S60 Q66 K67 I68 | S60-Y64 WeakPolarHBondContact O-CD2 3.28Å; S60-Y64 PolarHBondContact O-N 3.27Å; S60-Y64 VanDerWaalsContact O-N 3.16Å; Y64-Q66 VanDerWaalsContact C-N 3.31Å; Y64-Q66 PolarHBondContact O-N 3.33Å; Y64-K67 PolarHBondContact O-N 3.42Å; Y64-I68 VanDerWaalsContact O-CG1 3.28Å; Y64-I68 WeakPolarHBondContact O-CG1 3.34Å; Y64-I68 PolarHBondContact O-N 3.38Å |
| 65 | Q | 58.2 | Low | 56 | Low | 123 Ų | 123 | 129.4 Ų | 129.4 | 58% | 0.575 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -66.5 | -31.9 | 177.7 | -69.3 | -66.3 | -5.6 | 0 | 0 | 113 | E61 T69 | E61-Q65 WeakPolarHBondContact O-CG 3.46Å; E61-Q65 PolarHBondContact O-N 3.16Å; Q65-T69 WeakPolarHBondContact O-CB 3.4Å; Q65-T69 PolarHBondContact O-N 3.14Å; Q65-T69 VanDerWaalsContact O-N 3.1Å; Q65-T69 PolarHBondContact O-OG1 3.08Å |
| 66 | Q | 57.8 | Low | 56 | Low | 119 Ų | 119 | 127.4 Ų | 127.4 | 56% | 0.556 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -68.7 | -46.8 | 173.1 | -72 | -176.6 | -18.1 | 0 | 0 | 111.5 | Y64 I68 T69 D70 | Y64-Q66 VanDerWaalsContact C-N 3.31Å; Y64-Q66 PolarHBondContact O-N 3.33Å; Q66-I68 VanDerWaalsContact C-N 3.29Å; Q66-I68 PolarHBondContact O-N 2.81Å; Q66-T69 PolarHBondContact O-N 3.1Å; Q66-T69 VanDerWaalsContact O-N 3.14Å; Q66-D70 PolarHBondContact O-N 3.34Å; Q66-D70 VanDerWaalsContact O-OD2 3.11Å |
| 67 | K | 57.2 | Low | 56.1 | Low | 149 Ų | 149 | 127.1 Ų | 127.1 | 65% | 0.648 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -63.3 | -30.9 | 178.1 | -73.7 | 172.7 | 177.1 | -75.5 | 0 | 114 | Q63 Y64 G71 | Q63-K67 PolarHBondContact O-N 3.29Å; Y64-K67 PolarHBondContact O-N 3.42Å; K67-G71 PolarHBondContact O-N 2.92Å; K67-G71 VanDerWaalsContact O-N 3.08Å |
| 68 | I | 58.6 | Low | 55.9 | Low | 104 Ų | 104 | 127.7 Ų | 127.7 | 53% | 0.533 | 63% | 0.633 | S | S | . | * | H | α-helix | trans | -81.4 | -26 | 177.1 | -62.6 | 165.6 | 0 | 0 | 0 | 111.6 | Y64 Q66 P72 | Y64-I68 VanDerWaalsContact O-CG1 3.28Å; Y64-I68 WeakPolarHBondContact O-CG1 3.34Å; Y64-I68 PolarHBondContact O-N 3.38Å; Q66-I68 VanDerWaalsContact C-N 3.29Å; Q66-I68 PolarHBondContact O-N 2.81Å; I68-P72 VanDerWaalsContact O-CD 3.23Å; I68-P72 WeakPolarHBondContact O-CD 3.23Å |
| 69 | T | 57 | Low | 55.6 | Low | 94 Ų | 94 | 123.6 Ų | 123.6 | 58% | 0.577 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -81 | -34.5 | 175.7 | -59.8 | 0 | 0 | 0 | 0 | 111.9 | Q65 Q66 P72 | Q65-T69 WeakPolarHBondContact O-CB 3.4Å; Q65-T69 PolarHBondContact O-N 3.14Å; Q65-T69 VanDerWaalsContact O-N 3.1Å; Q65-T69 PolarHBondContact O-OG1 3.08Å; Q66-T69 PolarHBondContact O-N 3.1Å; Q66-T69 VanDerWaalsContact O-N 3.14Å; T69-P72 VanDerWaalsContact O-CD 3.26Å; T69-P72 WeakPolarHBondContact O-CD 3.26Å |
| 70 | D | 57.9 | Low | 55 | Low | 104 Ų | 104 | 121 Ų | 121 | 56% | 0.556 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -82.9 | -19.2 | 174.4 | -76.6 | -79.4 | 0 | 0 | 0 | 113.5 | Q66 | Q66-D70 PolarHBondContact O-N 3.34Å; Q66-D70 VanDerWaalsContact O-OD2 3.11Å |
| 71 | G | 55.7 | Low | 54.4 | Low | 42 Ų | 42 | 131.4 Ų | 131.4 | 43% | 0.433 | 68% | 0.678 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -67.4 | -27.7 | -178.9 | 0 | 0 | 0 | 0 | 0 | 118 | K67 | K67-G71 PolarHBondContact O-N 2.92Å; K67-G71 VanDerWaalsContact O-N 3.08Å |
| 72 | P | 52.7 | Low | 54.2 | Low | 89 Ų | 89 | 131.6 Ų | 131.6 | 58% | 0.578 | 68% | 0.682 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.6 | -13.3 | 177.4 | -7.4 | 26.1 | 0 | 0 | 0 | 112.9 | I68 T69 | I68-P72 VanDerWaalsContact O-CD 3.23Å; I68-P72 WeakPolarHBondContact O-CD 3.23Å; T69-P72 VanDerWaalsContact O-CD 3.26Å; T69-P72 WeakPolarHBondContact O-CD 3.26Å |
| 73 | L | 56.2 | Low | 54 | Low | 129 Ų | 129 | 127.8 Ų | 127.8 | 68% | 0.675 | 68% | 0.678 | S | S | * | * | S | Bend | trans | -87.6 | -12 | -173.3 | -68.1 | 173.7 | 0 | 0 | 0 | 114.2 | ||
| 74 | V | 54.8 | Low | 53.9 | Low | 113 Ų | 113 | 128.8 Ų | 128.8 | 69% | 0.685 | 69% | 0.687 | S | S | * | * | S | Bend | trans | -96.7 | -17.2 | -177.7 | 178.7 | 0 | 0 | 0 | 0 | 113.3 | ||
| 75 | L | 56.2 | Low | 53.9 | Low | 153 Ų | 153 | 127.5 Ų | 127.5 | 80% | 0.801 | 69% | 0.692 | S | S | * | * | S | Bend | trans | -88.5 | -12.3 | 179.4 | -65.2 | 178.5 | 0 | 0 | 0 | 114.3 | ||
| 76 | D | 52.8 | Low | 53.6 | Low | 136 Ų | 136 | 127.8 Ų | 127.8 | 73% | 0.727 | 70% | 0.699 | S | S | * | * | S | Bend | trans | -86.5 | -27.2 | -179.9 | -160.8 | -114.1 | 0 | 0 | 0 | 113 | H78 | D76-H78 PolarHBondContact O-N 3.44Š|
| 77 | Q | 56.1 | Low | 53.3 | Low | 176 Ų | 176 | 128.3 Ų | 128.3 | 82% | 0.822 | 71% | 0.709 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.7 | -1.7 | -176.9 | -94.6 | -159.7 | 7.8 | 0 | 0 | 116.1 | ||
| 78 | H | 51.8 | Low | 53 | Low | 192 Ų | 192 | 126.9 Ų | 126.9 | 89% | 0.889 | 71% | 0.713 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -117.2 | 22.7 | 178.6 | -105.7 | 31.9 | 0 | 0 | 0 | 113.4 | D76 | D76-H78 PolarHBondContact O-N 3.44Š|
| 79 | G | 50.3 | Low | 52.6 | Low | 69 Ų | 69 | 128.6 Ų | 128.6 | 71% | 0.711 | 73% | 0.727 | S | S | * | * | S | Bend | trans | -129.2 | 1.8 | 180 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||
| 80 | A | 42.2 | Very low | 52.2 | Low | 94 Ų | 94 | 131.5 Ų | 131.5 | 78% | 0.777 | 74% | 0.74 | S | S | * | * | trans | -107.4 | 100.6 | 175.5 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 81 | K | 40.3 | Very low | 51.7 | Low | 281 Ų | 281 | 134 Ų | 134 | 100% | 1.222 | 76% | 0.756 | S | S | * | * | trans | -57.8 | 0 | 158 | -99.9 | -177 | 169.2 | -176.1 | 0 | 111.1 |
Retrieved 81 of 81 residues in 60.4 ms
(Link to these results)