| 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 | 38.3 | Very low | 43.8 | Very low | 229 Ų | 229 | 156.3 Ų | 156.3 | 100% | 1.128 | 77% | 0.766 | S | S | * | * | 0 | 94.9 | 0 | -89.2 | 163.8 | 150.6 | 0 | 0 | 106 | |||||
| 2 | D | 39.8 | Very low | 44.1 | Very low | 146 Ų | 146 | 151.9 Ų | 151.9 | 78% | 0.781 | 76% | 0.759 | S | S | * | * | trans | -107.7 | 107.6 | -142 | -38.5 | -61.9 | 0 | 0 | 0 | 107.2 | V4 | D2-V4 HydrophobicContact CB-CG2 4.49Å; D2-V4 PolarHBondContact O-N 3.23Å | ||
| 3 | N | 41.6 | Very low | 43.9 | Very low | 158 Ų | 158 | 153.4 Ų | 153.4 | 85% | 0.845 | 76% | 0.758 | S | S | * | * | trans | -95.5 | 78.5 | 174.9 | -157.7 | -26.6 | 0 | 0 | 0 | 108.8 | Q5 | N3-Q5 PolarHBondContact O-N 3.3Š| ||
| 4 | V | 48.8 | Very low | 44.3 | Very low | 120 Ų | 120 | 151.2 Ų | 151.2 | 73% | 0.727 | 76% | 0.763 | S | S | * | * | trans | -75.5 | 103.5 | 177 | 175.5 | 0 | 0 | 0 | 0 | 108.5 | D2 P6 | D2-V4 HydrophobicContact CB-CG2 4.49Å; D2-V4 PolarHBondContact O-N 3.23Å; V4-P6 WeakPolarHBondContact O-CD 3.04Å | ||
| 5 | Q | 42.8 | Very low | 44.3 | Very low | 149 Ų | 149 | 148.2 Ų | 148.2 | 70% | 0.696 | 74% | 0.744 | S | S | * | * | trans | -56.3 | 126.2 | 164.2 | -74.9 | -127.4 | -78.2 | 0 | 0 | 110.1 | N3 K7 | N3-Q5 PolarHBondContact O-N 3.3Å; Q5-K7 VanDerWaalsContact C-N 3.27Å; Q5-K7 PolarHBondContact O-N 2.83Å | ||
| 6 | P | 45.6 | Very low | 44.5 | Very low | 110 Ų | 110 | 144.8 Ų | 144.8 | 71% | 0.714 | 74% | 0.738 | S | S | * | * | trans | -74.8 | 88.3 | 163.5 | 13.9 | -1.7 | 0 | 0 | 0 | 107.8 | V4 I8 | V4-P6 WeakPolarHBondContact O-CD 3.04Å; P6-I8 PolarHBondContact O-N 2.92Å | ||
| 7 | K | 36.3 | Very low | 44.2 | Very low | 183 Ų | 183 | 143.6 Ų | 143.6 | 80% | 0.796 | 74% | 0.739 | S | S | * | * | trans | -65.4 | 84.7 | 161 | -94.8 | -85 | -176.6 | 174.6 | 0 | 107.1 | Q5 K9 | Q5-K7 VanDerWaalsContact C-N 3.27Å; Q5-K7 PolarHBondContact O-N 2.83Å; K7-K9 PolarHBondContact O-N 3.35Å | ||
| 8 | I | 49.8 | Very low | 44.2 | Very low | 139 Ų | 139 | 142.6 Ų | 142.6 | 71% | 0.713 | 73% | 0.728 | S | S | * | * | trans | -61.2 | 92.1 | 166.1 | -67.5 | 163.4 | 0 | 0 | 0 | 105.9 | P6 H10 | P6-I8 PolarHBondContact O-N 2.92Å; I8-H10 PolarHBondContact O-N 2.78Å | ||
| 9 | K | 40.6 | Very low | 44.4 | Very low | 164 Ų | 164 | 136.7 Ų | 136.7 | 71% | 0.713 | 71% | 0.706 | S | S | * | * | trans | -73 | 81 | 173.6 | -166.8 | 162.9 | -176.5 | 174.8 | 0 | 105.8 | K7 R11 | K7-K9 PolarHBondContact O-N 3.35Å; K9-R11 HydrophobicContact CG-CG 4.31Å; K9-R11 PolarHBondContact O-N 2.87Å | ||
| 10 | H | 43.7 | Very low | 44.5 | Very low | 125 Ų | 125 | 136.7 Ų | 136.7 | 58% | 0.579 | 70% | 0.703 | S | S | * | * | trans | -62.5 | 90.3 | 171 | -141.3 | -110.4 | 0 | 0 | 0 | 106.9 | I8 P12 R92 | I8-H10 PolarHBondContact O-N 2.78Å; H10-P12 WeakPolarHBondContact O-CD 3.5Å; H10-R92 PolarHBondContact CE1-O 2.74Å | ||
| 11 | R | 54.3 | Low | 44.8 | Very low | 196 Ų | 196 | 133.8 Ų | 133.8 | 74% | 0.74 | 69% | 0.691 | S | S | * | * | trans | -89.5 | 89.7 | 159.6 | -72.1 | -92.2 | -152.6 | -161.3 | 4.3 | 104.4 | K9 F13 | K9-R11 HydrophobicContact CG-CG 4.31Å; K9-R11 PolarHBondContact O-N 2.87Å; R11-F13 PolarHBondContact O-N 2.78Å | ||
| 12 | P | 48 | Very low | 45.3 | Very low | 104 Ų | 104 | 129.4 Ų | 129.4 | 68% | 0.675 | 67% | 0.666 | S | S | * | * | trans | -67.9 | 104.3 | 155 | 30.4 | -27 | 0 | 0 | 0 | 104.4 | H10 C14 | H10-P12 WeakPolarHBondContact O-CD 3.5Å; P12-C14 PolarHBondContact O-N 3.48Å | ||
| 13 | F | 40.5 | Very low | 45.9 | Very low | 171 Ų | 171 | 126.1 Ų | 126.1 | 75% | 0.75 | 65% | 0.647 | S | S | * | * | trans | -17.8 | 128.3 | 165.7 | -123.1 | -104.4 | 0 | 0 | 0 | 112.9 | R11 F15 | R11-F13 PolarHBondContact O-N 2.78Å; F13-F15 AromaticContact CD1-CD2 3.89Å; F13-F15 HydrophobicContact CD1-CD2 3.89Å; F13-F15 HydrophobicContact CD1-CE2 4.49Å; F13-F15 HydrophobicContact CE1-CD2 4.4Å; F13-F15 PolarHBondContact O-N 3.18Å | ||
| 14 | C | 49.7 | Very low | 46.4 | Very low | 123 Ų | 123 | 123.8 Ų | 123.8 | 83% | 0.831 | 63% | 0.634 | S | S | * | * | S | Bend | trans | -61.9 | 76.8 | 167.5 | -163.2 | 0 | 0 | 0 | 0 | 109.7 | P12 | P12-C14 PolarHBondContact O-N 3.48Š|
| 15 | F | 44.7 | Very low | 46.9 | Very low | 106 Ų | 106 | 126.8 Ų | 126.8 | 47% | 0.465 | 63% | 0.632 | S | S | . | * | trans | -122.6 | 17.8 | 173.9 | -123.1 | -99.3 | 0 | 0 | 0 | 111.9 | F13 V17 K18 | F13-F15 AromaticContact CD1-CD2 3.89Å; F13-F15 HydrophobicContact CD1-CD2 3.89Å; F13-F15 HydrophobicContact CD1-CE2 4.49Å; F13-F15 HydrophobicContact CE1-CD2 4.4Å; F13-F15 PolarHBondContact O-N 3.18Å; F15-V17 PolarHBondContact O-N 3.47Å; F15-K18 HydrophobicContact CD1-CB 3.76Å; F15-K18 HydrophobicContact CD1-CG 4.41Å; F15-K18 HydrophobicContact CE1-CB 3.64Å; F15-K18 HydrophobicContact CE1-CD 4.11Å; F15-K18 HydrophobicContact CE1-CG 3.78Å; F15-K18 HydrophobicContact CG-CB 4.43Å; F15-K18 HydrophobicContact CZ-CB 4.24Å; F15-K18 HydrophobicContact CZ-CD 3.93Å; F15-K18 HydrophobicContact CZ-CG 4.14Å; F15-K18 PolarHBondContact O-N 3.46Å | ||
| 16 | S | 48.3 | Very low | 47.7 | Very low | 94 Ų | 94 | 125.1 Ų | 125.1 | 66% | 0.657 | 63% | 0.627 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.6 | 3 | -177.4 | -158.9 | 0 | 0 | 0 | 0 | 114.7 | H20 | S16-H20 PolarHBondContact O-CD2 2.73Å; S16-H20 VanDerWaalsContact O-CD2 3.3Å |
| 17 | V | 39.3 | Very low | 48.4 | Very low | 125 Ų | 125 | 123.6 Ų | 123.6 | 76% | 0.758 | 61% | 0.613 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -125.1 | -12.2 | 173.5 | -84.3 | 0 | 0 | 0 | 0 | 113.7 | F15 | F15-V17 PolarHBondContact O-N 3.47Š|
| 18 | K | 43.3 | Very low | 50 | Low | 125 Ų | 125 | 119.5 Ų | 119.5 | 54% | 0.543 | 60% | 0.599 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -98.6 | -9.7 | -177.8 | -161.5 | 154 | -170.4 | 165.5 | 0 | 114 | F15 K22 | F15-K18 HydrophobicContact CD1-CB 3.76Å; F15-K18 HydrophobicContact CD1-CG 4.41Å; F15-K18 HydrophobicContact CE1-CB 3.64Å; F15-K18 HydrophobicContact CE1-CD 4.11Å; F15-K18 HydrophobicContact CE1-CG 3.78Å; F15-K18 HydrophobicContact CG-CB 4.43Å; F15-K18 HydrophobicContact CZ-CB 4.24Å; F15-K18 HydrophobicContact CZ-CD 3.93Å; F15-K18 HydrophobicContact CZ-CG 4.14Å; F15-K18 PolarHBondContact O-N 3.46Å; K18-K22 WeakPolarHBondContact O-CD 3.49Å; K18-K22 WeakPolarHBondContact O-CG 3.44Å |
| 19 | G | 48.6 | Very low | 51 | Low | 30 Ų | 30 | 118 Ų | 118 | 31% | 0.309 | 59% | 0.591 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -90.4 | -32.3 | 174.7 | 0 | 0 | 0 | 0 | 0 | 114.4 | V21 K22 M23 | G19-V21 PolarHBondContact O-N 3.35Å; G19-K22 PolarHBondContact O-N 2.91Å; G19-K22 VanDerWaalsContact O-N 3.13Å; G19-M23 PolarHBondContact O-N 3.45Å |
| 20 | H | 45.8 | Very low | 52.4 | Low | 136 Ų | 136 | 112.3 Ų | 112.3 | 63% | 0.63 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -62.7 | -46.2 | -176 | -78.9 | -88.8 | 0 | 0 | 0 | 112.6 | S16 K22 L24 | S16-H20 PolarHBondContact O-CD2 2.73Å; S16-H20 VanDerWaalsContact O-CD2 3.3Å; H20-K22 VanDerWaalsContact C-N 3.26Å; H20-K22 PolarHBondContact O-N 3.44Å; H20-L24 WeakPolarHBondContact O-CB 3.48Å; H20-L24 PolarHBondContact O-N 2.99Å |
| 21 | V | 50.3 | Low | 53.6 | Low | 77 Ų | 77 | 109.6 Ų | 109.6 | 47% | 0.467 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -67.6 | -24.4 | 176.3 | -70.9 | 0 | 0 | 0 | 0 | 113.5 | G19 R25 | G19-V21 PolarHBondContact O-N 3.35Å; V21-R25 WeakPolarHBondContact O-CB 3.41Å; V21-R25 VanDerWaalsContact O-CG 3.24Å; V21-R25 WeakPolarHBondContact O-CG 3.19Å; V21-R25 PolarHBondContact O-N 3.19Å |
| 22 | K | 49.6 | Very low | 54.5 | Low | 136 Ų | 136 | 105.4 Ų | 105.4 | 59% | 0.591 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -82.7 | -34.4 | -178.7 | -73.4 | -175.8 | 169 | -176.3 | 0 | 112.4 | K18 G19 H20 | K18-K22 WeakPolarHBondContact O-CD 3.49Å; K18-K22 WeakPolarHBondContact O-CG 3.44Å; G19-K22 PolarHBondContact O-N 2.91Å; G19-K22 VanDerWaalsContact O-N 3.13Å; H20-K22 VanDerWaalsContact C-N 3.26Å; H20-K22 PolarHBondContact O-N 3.44Å |
| 23 | M | 51.8 | Low | 55.6 | Low | 78 Ų | 78 | 104.8 Ų | 104.8 | 38% | 0.384 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -73.3 | -43.1 | 168.9 | -92 | 167.5 | 150 | 0 | 0 | 111.7 | G19 R25 L26 D27 R83 | G19-M23 PolarHBondContact O-N 3.45Å; M23-R25 VanDerWaalsContact C-N 3.33Å; M23-R25 PolarHBondContact O-N 3.38Å; M23-L26 PolarHBondContact O-N 3.04Å; M23-D27 PolarHBondContact O-N 2.98Å; M23-R83 VanDerWaalsContact CB-NH1 3.33Å; M23-R83 HydrophobicContact CE-CB 4.17Å; M23-R83 HydrophobicContact CE-CG 3.97Å; M23-R83 PolarHBondContact SD-NH1 3.37Å |
| 24 | L | 53.4 | Low | 57.2 | Low | 108 Ų | 108 | 98.4 Ų | 98.4 | 57% | 0.565 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -62.9 | -38.1 | -177.8 | -167.4 | 77.6 | 0 | 0 | 0 | 112.4 | H20 I28 | H20-L24 WeakPolarHBondContact O-CB 3.48Å; H20-L24 PolarHBondContact O-N 2.99Å; L24-I28 HydrophobicContact CD2-CD1 4.28Å; L24-I28 HydrophobicContact CG-CD1 3.84Å; L24-I28 WeakPolarHBondContact O-CB 3.22Å; L24-I28 WeakPolarHBondContact O-CD1 3.18Å; L24-I28 WeakPolarHBondContact O-CG1 3.43Å; L24-I28 PolarHBondContact O-N 3.05Å |
| 25 | R | 59.4 | Low | 58.3 | Low | 183 Ų | 183 | 96.4 Ų | 96.4 | 69% | 0.691 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -67.2 | -36.3 | 176.1 | -77.1 | 178.3 | -177.9 | -167.6 | 0.3 | 113 | V21 M23 I29 | V21-R25 WeakPolarHBondContact O-CB 3.41Å; V21-R25 VanDerWaalsContact O-CG 3.24Å; V21-R25 WeakPolarHBondContact O-CG 3.19Å; V21-R25 PolarHBondContact O-N 3.19Å; M23-R25 VanDerWaalsContact C-N 3.33Å; M23-R25 PolarHBondContact O-N 3.38Å; R25-I29 WeakPolarHBondContact O-CB 3.22Å; R25-I29 WeakPolarHBondContact O-CD1 3.39Å; R25-I29 WeakPolarHBondContact O-CG1 3.35Å; R25-I29 PolarHBondContact O-N 3.06Å; R25-I29 VanDerWaalsContact O-N 3.1Å |
| 26 | L | 57.9 | Low | 59.8 | Low | 114 Ų | 114 | 94.7 Ų | 94.7 | 60% | 0.597 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -72.6 | -37.7 | -179.9 | -159.5 | 69.6 | 0 | 0 | 0 | 111.1 | M23 N30 | M23-L26 PolarHBondContact O-N 3.04Å; L26-N30 WeakPolarHBondContact O-CB 3.37Å; L26-N30 PolarHBondContact O-N 3.13Å |
| 27 | D | 61.9 | Low | 61 | Low | 78 Ų | 78 | 95 Ų | 95 | 42% | 0.417 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -66.4 | -44.7 | 174.6 | -114.8 | -99.6 | 0 | 0 | 0 | 112.4 | M23 I29 N30 S31 R83 | M23-D27 PolarHBondContact O-N 2.98Å; D27-I29 PolarHBondContact O-N 3.38Å; D27-N30 PolarHBondContact O-N 3.2Å; D27-S31 VanDerWaalsContact O-CB 3.27Å; D27-S31 WeakPolarHBondContact O-CB 3.27Å; D27-S31 PolarHBondContact O-N 3.08Å; D27-R83 IonicContact OD2-NH2 3.84Å |
| 28 | I | 69.3 | Low | 62.2 | Low | 98 Ų | 98 | 93 Ų | 93 | 50% | 0.503 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -63.4 | -42.6 | 178 | -73.4 | 166.9 | 0 | 0 | 0 | 111.1 | L24 L32 | L24-I28 HydrophobicContact CD2-CD1 4.28Å; L24-I28 HydrophobicContact CG-CD1 3.84Å; L24-I28 WeakPolarHBondContact O-CB 3.22Å; L24-I28 WeakPolarHBondContact O-CD1 3.18Å; L24-I28 WeakPolarHBondContact O-CG1 3.43Å; L24-I28 PolarHBondContact O-N 3.05Å; I28-L32 VanDerWaalsContact O-CB 3.26Å; I28-L32 WeakPolarHBondContact O-CB 3.24Å; I28-L32 PolarHBondContact O-N 3.27Å |
| 29 | I | 69.8 | Low | 63.8 | Low | 108 Ų | 108 | 92.3 Ų | 92.3 | 55% | 0.554 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -69.1 | -40.2 | 178.2 | -67.8 | 169.8 | 0 | 0 | 0 | 110.4 | R25 D27 L32 V33 | R25-I29 WeakPolarHBondContact O-CB 3.22Å; R25-I29 WeakPolarHBondContact O-CD1 3.39Å; R25-I29 WeakPolarHBondContact O-CG1 3.35Å; R25-I29 PolarHBondContact O-N 3.06Å; R25-I29 VanDerWaalsContact O-N 3.1Å; D27-I29 PolarHBondContact O-N 3.38Å; I29-L32 PolarHBondContact O-N 3.09Å; I29-V33 WeakPolarHBondContact O-CB 3.43Å; I29-V33 PolarHBondContact O-N 3.34Å |
| 30 | N | 70.8 | Confident | 64.8 | Low | 43 Ų | 43 | 95.5 Ų | 95.5 | 23% | 0.23 | 49% | 0.49 | C | S | . | . | H | α-helix | trans | -66.7 | -39.5 | 176.9 | -173.4 | 76.9 | 0 | 0 | 0 | 112.4 | L26 D27 T34 L76 | L26-N30 WeakPolarHBondContact O-CB 3.37Å; L26-N30 PolarHBondContact O-N 3.13Å; D27-N30 PolarHBondContact O-N 3.2Å; N30-T34 WeakPolarHBondContact O-CB 3.41Å; N30-T34 PolarHBondContact O-N 3.21Å; N30-T34 PolarHBondContact O-OG1 3.41Å; N30-L76 WeakPolarHBondContact ND2-CD1 2.82Å |
| 31 | S | 68 | Low | 66.1 | Low | 68 Ų | 68 | 90.5 Ų | 90.5 | 48% | 0.476 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -64.8 | -46.8 | 173.9 | -177.1 | 0 | 0 | 0 | 0 | 110.9 | D27 V33 T34 T35 | D27-S31 VanDerWaalsContact O-CB 3.27Å; D27-S31 WeakPolarHBondContact O-CB 3.27Å; D27-S31 PolarHBondContact O-N 3.08Å; S31-V33 PolarHBondContact O-N 3.44Å; S31-T34 PolarHBondContact O-N 2.92Å; S31-T35 WeakPolarHBondContact O-CB 3.18Å; S31-T35 PolarHBondContact O-N 3.33Å; S31-T35 PolarHBondContact O-OG1 2.89Å |
| 32 | L | 74.7 | Confident | 66.9 | Low | 108 Ų | 108 | 90.6 Ų | 90.6 | 57% | 0.565 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -61 | -46.5 | 178.2 | -179.4 | 64.6 | 0 | 0 | 0 | 111.3 | I28 I29 T34 T35 V36 | I28-L32 VanDerWaalsContact O-CB 3.26Å; I28-L32 WeakPolarHBondContact O-CB 3.24Å; I28-L32 PolarHBondContact O-N 3.27Å; I29-L32 PolarHBondContact O-N 3.09Å; L32-T34 VanDerWaalsContact C-N 3.29Å; L32-T34 PolarHBondContact O-N 2.6Å; L32-T35 PolarHBondContact O-N 2.89Å; L32-V36 HydrophobicContact CD1-CG2 4.03Å; L32-V36 HydrophobicContact CG-CG2 4.42Å; L32-V36 WeakPolarHBondContact O-CG2 3.26Å; L32-V36 PolarHBondContact O-N 3.3Å |
| 33 | V | 70.9 | Confident | 68 | Low | 91 Ų | 91 | 87.6 Ų | 87.6 | 55% | 0.552 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -61.6 | -40.3 | 179.2 | 113.6 | 0 | 0 | 0 | 0 | 111.1 | I29 S31 F37 | I29-V33 WeakPolarHBondContact O-CB 3.43Å; I29-V33 PolarHBondContact O-N 3.34Å; S31-V33 PolarHBondContact O-N 3.44Å; V33-F37 WeakPolarHBondContact O-CB 3.2Å; V33-F37 PolarHBondContact O-N 3.48Å |
| 34 | T | 74.1 | Confident | 68.6 | Low | 37 Ų | 37 | 89.2 Ų | 89.2 | 23% | 0.227 | 48% | 0.476 | C | S | . | . | H | α-helix | trans | -68.1 | -39 | 177.4 | -54.6 | 0 | 0 | 0 | 0 | 111.2 | N30 S31 L32 M38 V72 | N30-T34 WeakPolarHBondContact O-CB 3.41Å; N30-T34 PolarHBondContact O-N 3.21Å; N30-T34 PolarHBondContact O-OG1 3.41Å; S31-T34 PolarHBondContact O-N 2.92Å; L32-T34 VanDerWaalsContact C-N 3.29Å; L32-T34 PolarHBondContact O-N 2.6Å; T34-M38 WeakPolarHBondContact O-CB 3.41Å; T34-M38 WeakPolarHBondContact O-CG 3.39Å; T34-M38 PolarHBondContact O-N 2.81Å; T34-V72 HydrophobicContact CG2-CG1 4.23Å |
| 35 | T | 71.6 | Confident | 68.9 | Low | 82 Ų | 82 | 85.4 Ų | 85.4 | 50% | 0.503 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -71 | -43.5 | -177.3 | -46.6 | 0 | 0 | 0 | 0 | 111.3 | S31 L32 M38 L39 | S31-T35 WeakPolarHBondContact O-CB 3.18Å; S31-T35 PolarHBondContact O-N 3.33Å; S31-T35 PolarHBondContact O-OG1 2.89Å; L32-T35 PolarHBondContact O-N 2.89Å; T35-M38 PolarHBondContact O-N 3.33Å; T35-L39 WeakPolarHBondContact O-CB 3.49Å; T35-L39 PolarHBondContact O-N 2.93Å |
| 36 | V | 77.4 | Confident | 69.4 | Low | 70 Ų | 70 | 82.7 Ų | 82.7 | 42% | 0.424 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -69 | -38.6 | 176.4 | 176 | 0 | 0 | 0 | 0 | 110.8 | L32 L39 I40 | L32-V36 HydrophobicContact CD1-CG2 4.03Å; L32-V36 HydrophobicContact CG-CG2 4.42Å; L32-V36 WeakPolarHBondContact O-CG2 3.26Å; L32-V36 PolarHBondContact O-N 3.3Å; V36-L39 PolarHBondContact O-N 3.47Å; V36-I40 HydrophobicContact CG1-CD1 3.75Å; V36-I40 HydrophobicContact CG1-CG1 4.35Å; V36-I40 VanDerWaalsContact O-CG1 3.27Å; V36-I40 WeakPolarHBondContact O-CG1 3.36Å; V36-I40 PolarHBondContact O-N 2.89Å |
| 37 | F | 72.2 | Confident | 69.4 | Low | 100 Ų | 100 | 82 Ų | 82 | 44% | 0.439 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -62.9 | -43.5 | 176.4 | -164.8 | -91.6 | 0 | 0 | 0 | 111.6 | V33 I40 V41 V68 | V33-F37 WeakPolarHBondContact O-CB 3.2Å; V33-F37 PolarHBondContact O-N 3.48Å; F37-I40 PolarHBondContact O-N 3.1Å; F37-V41 HydrophobicContact CD1-CG2 4.07Å; F37-V41 HydrophobicContact CE1-CG2 3.81Å; F37-V41 HydrophobicContact CZ-CG2 4.43Å; F37-V41 WeakPolarHBondContact O-CB 3.47Å; F37-V41 VanDerWaalsContact O-CG2 3.23Å; F37-V41 WeakPolarHBondContact O-CG2 3.37Å; F37-V41 PolarHBondContact O-N 3.47Å; F37-V68 HydrophobicContact CE1-CG1 3.38Å; F37-V68 HydrophobicContact CZ-CG1 3.42Å; F37-V68 VanDerWaalsContact CZ-CG1 3.42Å |
| 38 | M | 65.6 | Low | 69.1 | Low | 83 Ų | 83 | 79.6 Ų | 79.6 | 41% | 0.409 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -63.4 | -39.6 | 172.8 | -86.8 | -66.7 | -166.1 | 0 | 0 | 113 | T34 T35 V41 S42 F69 | T34-M38 WeakPolarHBondContact O-CB 3.41Å; T34-M38 WeakPolarHBondContact O-CG 3.39Å; T34-M38 PolarHBondContact O-N 2.81Å; T35-M38 PolarHBondContact O-N 3.33Å; M38-V41 PolarHBondContact O-N 2.94Å; M38-S42 WeakPolarHBondContact O-CB 3.33Å; M38-S42 PolarHBondContact O-N 2.86Å; M38-F69 HydrophobicContact CE-CD2 3.1Å; M38-F69 HydrophobicContact CE-CE2 3.02Å; M38-F69 HydrophobicContact CE-CG 4.08Å; M38-F69 HydrophobicContact CE-CZ 3.96Å |
| 39 | L | 76.9 | Confident | 68.5 | Low | 110 Ų | 110 | 80.4 Ų | 80.4 | 58% | 0.576 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -66.2 | -43.5 | 179.6 | -160 | 162.6 | 0 | 0 | 0 | 110.7 | T35 V36 S42 V43 | T35-L39 WeakPolarHBondContact O-CB 3.49Å; T35-L39 PolarHBondContact O-N 2.93Å; V36-L39 PolarHBondContact O-N 3.47Å; L39-S42 WeakPolarHBondContact O-CB 3.35Å; L39-S42 PolarHBondContact O-N 3.49Å; L39-V43 HydrophobicContact CD2-CG2 3.93Å; L39-V43 WeakPolarHBondContact O-CG2 3.37Å; L39-V43 PolarHBondContact O-N 3.5Å |
| 40 | I | 70.2 | Confident | 67.7 | Low | 97 Ų | 97 | 80.1 Ų | 80.1 | 50% | 0.497 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -65.2 | -41.3 | 175.9 | -65.3 | 167.9 | 0 | 0 | 0 | 110.7 | V36 F37 S42 V43 L44 | V36-I40 HydrophobicContact CG1-CD1 3.75Å; V36-I40 HydrophobicContact CG1-CG1 4.35Å; V36-I40 VanDerWaalsContact O-CG1 3.27Å; V36-I40 WeakPolarHBondContact O-CG1 3.36Å; V36-I40 PolarHBondContact O-N 2.89Å; F37-I40 PolarHBondContact O-N 3.1Å; I40-S42 VanDerWaalsContact C-N 3.3Å; I40-S42 PolarHBondContact O-N 3.44Å; I40-V43 PolarHBondContact O-N 3.48Å; I40-L44 WeakPolarHBondContact O-CB 3.3Å; I40-L44 PolarHBondContact O-N 3.45Å |
| 41 | V | 71.8 | Confident | 66.8 | Low | 32 Ų | 32 | 82 Ų | 82 | 19% | 0.194 | 46% | 0.462 | C | S | . | . | H | α-helix | trans | -64.2 | -36.1 | 173.4 | 170.4 | 0 | 0 | 0 | 0 | 111.3 | F37 M38 L44 A45 I65 | F37-V41 HydrophobicContact CD1-CG2 4.07Å; F37-V41 HydrophobicContact CE1-CG2 3.81Å; F37-V41 HydrophobicContact CZ-CG2 4.43Å; F37-V41 WeakPolarHBondContact O-CB 3.47Å; F37-V41 VanDerWaalsContact O-CG2 3.23Å; F37-V41 WeakPolarHBondContact O-CG2 3.37Å; F37-V41 PolarHBondContact O-N 3.47Å; M38-V41 PolarHBondContact O-N 2.94Å; V41-L44 CarbonylContact O-C 3.4Å; V41-L44 PolarHBondContact O-N 2.91Å; V41-A45 VanDerWaalsContact O-CB 3.23Å; V41-A45 WeakPolarHBondContact O-CB 3.12Å; V41-A45 PolarHBondContact O-N 3.32Å; V41-I65 HydrophobicContact CG1-CG1 4.44Å; V41-I65 HydrophobicContact CG1-CG2 3.65Å |
| 42 | S | 67.6 | Low | 65.9 | Low | 79 Ų | 79 | 81.2 Ų | 81.2 | 55% | 0.552 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -69.9 | -40.8 | 178.6 | -171.5 | 0 | 0 | 0 | 0 | 111.9 | M38 L39 I40 A45 L46 | M38-S42 WeakPolarHBondContact O-CB 3.33Å; M38-S42 PolarHBondContact O-N 2.86Å; L39-S42 WeakPolarHBondContact O-CB 3.35Å; L39-S42 PolarHBondContact O-N 3.49Å; I40-S42 VanDerWaalsContact C-N 3.3Å; I40-S42 PolarHBondContact O-N 3.44Å; S42-A45 PolarHBondContact O-N 3.05Å; S42-L46 WeakPolarHBondContact O-CB 3.36Å; S42-L46 PolarHBondContact O-N 3.21Å |
| 43 | V | 71.7 | Confident | 64.7 | Low | 73 Ų | 73 | 83.4 Ų | 83.4 | 44% | 0.442 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -69.2 | -40.9 | 173 | 174.3 | 0 | 0 | 0 | 0 | 110.8 | L39 I40 A45 L46 I47 | L39-V43 HydrophobicContact CD2-CG2 3.93Å; L39-V43 WeakPolarHBondContact O-CG2 3.37Å; L39-V43 PolarHBondContact O-N 3.5Å; I40-V43 PolarHBondContact O-N 3.48Å; V43-A45 PolarHBondContact O-N 3.22Å; V43-L46 PolarHBondContact O-N 2.97Å; V43-I47 HydrophobicContact CG1-CD1 4.2Å; V43-I47 WeakPolarHBondContact O-CG1 3.38Å; V43-I47 PolarHBondContact O-N 3.45Å; V43-I47 VanDerWaalsContact O-N 3.14Å |
| 44 | L | 65.1 | Low | 63.9 | Low | 111 Ų | 111 | 84.5 Ų | 84.5 | 58% | 0.581 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -75.7 | -6.1 | 176.5 | -167.2 | 63.2 | 0 | 0 | 0 | 112.8 | I40 V41 P48 | I40-L44 WeakPolarHBondContact O-CB 3.3Å; I40-L44 PolarHBondContact O-N 3.45Å; V41-L44 CarbonylContact O-C 3.4Å; V41-L44 PolarHBondContact O-N 2.91Å; L44-P48 WeakPolarHBondContact O-CD 3.29Å; L44-P48 WeakPolarHBondContact O-CG 3.33Å |
| 45 | A | 60.9 | Low | 62.9 | Low | 29 Ų | 29 | 87.8 Ų | 87.8 | 24% | 0.24 | 49% | 0.492 | C | S | . | . | H | α-helix | trans | -93.5 | -35.4 | 165.9 | 0 | 0 | 0 | 0 | 0 | 110.3 | V41 S42 V43 I47 P48 E49 | V41-A45 VanDerWaalsContact O-CB 3.23Å; V41-A45 WeakPolarHBondContact O-CB 3.12Å; V41-A45 PolarHBondContact O-N 3.32Å; S42-A45 PolarHBondContact O-N 3.05Å; V43-A45 PolarHBondContact O-N 3.22Å; A45-I47 VanDerWaalsContact C-N 3.34Å; A45-I47 PolarHBondContact O-N 2.94Å; A45-P48 VanDerWaalsContact CA-CG 3.47Å; A45-P48 WeakPolarHBondContact O-CD 3.43Å; A45-P48 WeakPolarHBondContact O-CG 3.33Å; A45-E49 VanDerWaalsContact O-CG 3.29Å; A45-E49 WeakPolarHBondContact O-CG 3.2Å; A45-E49 PolarHBondContact O-N 3.48Å |
| 46 | L | 68.3 | Low | 62 | Low | 125 Ų | 125 | 88.5 Ų | 88.5 | 65% | 0.654 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -65.5 | -32.6 | 178.1 | -166.8 | 63.7 | 0 | 0 | 0 | 113.7 | S42 V43 | S42-L46 WeakPolarHBondContact O-CB 3.36Å; S42-L46 PolarHBondContact O-N 3.21Å; V43-L46 PolarHBondContact O-N 2.97Å |
| 47 | I | 59.7 | Low | 61 | Low | 99 Ų | 99 | 87.6 Ų | 87.6 | 51% | 0.508 | 52% | 0.52 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -74.6 | -44.1 | 173.9 | -60.7 | 164.6 | 0 | 0 | 0 | 112.2 | V43 A45 E49 T50 | V43-I47 HydrophobicContact CG1-CD1 4.2Å; V43-I47 WeakPolarHBondContact O-CG1 3.38Å; V43-I47 PolarHBondContact O-N 3.45Å; V43-I47 VanDerWaalsContact O-N 3.14Å; A45-I47 VanDerWaalsContact C-N 3.34Å; A45-I47 PolarHBondContact O-N 2.94Å; I47-E49 VanDerWaalsContact C-N 3.32Å; I47-E49 PolarHBondContact O-N 3.23Å; I47-T50 PolarHBondContact O-N 2.95Å; I47-T50 VanDerWaalsContact O-N 3.15Å; I47-T50 PolarHBondContact O-OG1 2.9Å |
| 48 | P | 55.5 | Low | 60.3 | Low | 28 Ų | 28 | 83.9 Ų | 83.9 | 18% | 0.182 | 51% | 0.511 | C | S | . | . | G | 310 helix | trans | -69.3 | -21.6 | 175.2 | 27.5 | -35.8 | 0 | 0 | 0 | 114.2 | L44 A45 T50 T51 T52 | L44-P48 WeakPolarHBondContact O-CD 3.29Å; L44-P48 WeakPolarHBondContact O-CG 3.33Å; A45-P48 VanDerWaalsContact CA-CG 3.47Å; A45-P48 WeakPolarHBondContact O-CD 3.43Å; A45-P48 WeakPolarHBondContact O-CG 3.33Å; P48-T50 PolarHBondContact O-N 2.99Å; P48-T51 VanDerWaalsContact CA-OG1 3.3Å; P48-T51 WeakPolarHBondContact CA-OG1 3.27Å; P48-T51 CarbonylContact O-C 3.58Å; P48-T51 PolarHBondContact O-N 3.18Å; P48-T52 HydrophobicContact CB-CG2 3.91Å; P48-T52 WeakPolarHBondContact O-CB 3.23Å; P48-T52 VanDerWaalsContact O-CG2 3.28Å; P48-T52 WeakPolarHBondContact O-CG2 3.39Å; P48-T52 PolarHBondContact O-N 2.72Å; P48-T52 PolarHBondContact O-OG1 3.39Å |
| 49 | E | 54.9 | Low | 60.1 | Low | 115 Ų | 115 | 86.8 Ų | 86.8 | 54% | 0.537 | 53% | 0.528 | S | S | . | . | G | 310 helix | trans | -53.9 | -27.3 | 167.9 | -64 | -46.6 | 145.8 | 0 | 0 | 112.5 | A45 I47 L53 | A45-E49 VanDerWaalsContact O-CG 3.29Å; A45-E49 WeakPolarHBondContact O-CG 3.2Å; A45-E49 PolarHBondContact O-N 3.48Å; I47-E49 VanDerWaalsContact C-N 3.32Å; I47-E49 PolarHBondContact O-N 3.23Å; E49-L53 WeakPolarHBondContact O-CG 3.4Å |
| 50 | T | 53.7 | Low | 59.5 | Low | 102 Ų | 102 | 87.5 Ų | 87.5 | 63% | 0.626 | 53% | 0.532 | S | S | * | . | G | 310 helix | trans | -89.6 | -14.7 | 176.6 | 68.8 | 0 | 0 | 0 | 0 | 114.2 | I47 P48 | I47-T50 PolarHBondContact O-N 2.95Å; I47-T50 VanDerWaalsContact O-N 3.15Å; I47-T50 PolarHBondContact O-OG1 2.9Å; P48-T50 PolarHBondContact O-N 2.99Å |
| 51 | T | 51.9 | Low | 59.5 | Low | 83 Ų | 83 | 86.2 Ų | 86.2 | 51% | 0.509 | 53% | 0.529 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -114 | -21.8 | -177.3 | 52.1 | 0 | 0 | 0 | 0 | 114.2 | P48 T54 | P48-T51 VanDerWaalsContact CA-OG1 3.3Å; P48-T51 WeakPolarHBondContact CA-OG1 3.27Å; P48-T51 CarbonylContact O-C 3.58Å; P48-T51 PolarHBondContact O-N 3.18Å; T51-T54 PolarHBondContact O-N 3Å |
| 52 | T | 49.8 | Very low | 59.2 | Low | 52 Ų | 52 | 89.3 Ų | 89.3 | 32% | 0.319 | 54% | 0.544 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -74 | -28 | 174.9 | 54.7 | 0 | 0 | 0 | 0 | 112.6 | P48 T54 | P48-T52 HydrophobicContact CB-CG2 3.91Å; P48-T52 WeakPolarHBondContact O-CB 3.23Å; P48-T52 VanDerWaalsContact O-CG2 3.28Å; P48-T52 WeakPolarHBondContact O-CG2 3.39Å; P48-T52 PolarHBondContact O-N 2.72Å; P48-T52 PolarHBondContact O-OG1 3.39Å; T52-T54 PolarHBondContact O-N 3.35Å |
| 53 | L | 50 | Low | 59.5 | Low | 153 Ų | 153 | 89.1 Ų | 89.1 | 80% | 0.801 | 54% | 0.543 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.2 | -16.3 | 172.4 | -62 | -176.7 | 0 | 0 | 0 | 112.9 | E49 | E49-L53 WeakPolarHBondContact O-CG 3.4Š|
| 54 | T | 52.2 | Low | 59.4 | Low | 115 Ų | 115 | 90.1 Ų | 90.1 | 71% | 0.706 | 55% | 0.545 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -97 | -22.6 | -177.6 | -56.2 | 0 | 0 | 0 | 0 | 113.4 | T51 T52 | T51-T54 PolarHBondContact O-N 3Å; T52-T54 PolarHBondContact O-N 3.35Å |
| 55 | V | 53.4 | Low | 59.8 | Low | 106 Ų | 106 | 87.7 Ų | 87.7 | 64% | 0.642 | 53% | 0.531 | S | S | * | . | S | Bend | trans | -142.6 | 107.3 | -171.2 | 179.6 | 0 | 0 | 0 | 0 | 109.4 | G57 | V55-G57 VanDerWaalsContact C-N 3.29Å; V55-G57 PolarHBondContact O-N 3.49Å |
| 56 | G | 53.4 | Low | 60.3 | Low | 97 Ų | 97 | 90 Ų | 90 | 100% | 1 | 54% | 0.543 | S | S | * | . | S | Bend | trans | -63 | 66.8 | -173.3 | 0 | 0 | 0 | 0 | 0 | 117.1 | ||
| 57 | G | 55.5 | Low | 60.7 | Low | 50 Ų | 50 | 86.8 Ų | 86.8 | 52% | 0.515 | 53% | 0.534 | S | S | . | . | trans | -141.8 | 35.7 | -179 | 0 | 0 | 0 | 0 | 0 | 114.6 | V55 | V55-G57 VanDerWaalsContact C-N 3.29Å; V55-G57 PolarHBondContact O-N 3.49Å | ||
| 58 | G | 57.7 | Low | 61.3 | Low | 23 Ų | 23 | 84.7 Ų | 84.7 | 24% | 0.237 | 53% | 0.526 | C | S | . | . | trans | -73.9 | -20.7 | -173.2 | 0 | 0 | 0 | 0 | 0 | 116.5 | L60 N62 | G58-L60 PolarHBondContact O-N 3.34Å; G58-N62 PolarHBondContact O-N 3.28Å; G58-N62 PolarHBondContact O-ND2 2.98Å | ||
| 59 | D | 63 | Low | 62 | Low | 143 Ų | 143 | 88 Ų | 88 | 77% | 0.765 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -70.3 | -30.8 | -168 | -69.1 | -58 | 0 | 0 | 0 | 114.4 | S63 | D59-S63 WeakPolarHBondContact O-CB 3.42Å; D59-S63 PolarHBondContact O-N 3.07Å |
| 60 | L | 64.3 | Low | 63 | Low | 126 Ų | 126 | 87.4 Ų | 87.4 | 66% | 0.66 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -75.8 | -39.4 | -177.6 | -156.5 | 77.6 | 0 | 0 | 0 | 111.7 | G58 N62 S63 I64 | G58-L60 PolarHBondContact O-N 3.34Å; L60-N62 VanDerWaalsContact C-N 3.33Å; L60-N62 PolarHBondContact O-N 3.23Å; L60-S63 PolarHBondContact O-N 3.38Å; L60-I64 HydrophobicContact CD2-CD1 4.25Å; L60-I64 HydrophobicContact CG-CD1 3.92Å; L60-I64 WeakPolarHBondContact O-CB 3.47Å; L60-I64 WeakPolarHBondContact O-CD1 3.37Å; L60-I64 WeakPolarHBondContact O-CG1 3.04Å; L60-I64 PolarHBondContact O-N 3.15Å |
| 61 | T | 68.3 | Low | 63.7 | Low | 70 Ų | 70 | 85.6 Ų | 85.6 | 43% | 0.429 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -64.7 | -41 | -179.9 | -44 | 0 | 0 | 0 | 0 | 110.8 | I64 I65 | T61-I64 PolarHBondContact O-N 2.94Å; T61-I65 HydrophobicContact CG2-CD1 4.1Å; T61-I65 WeakPolarHBondContact O-CD1 3.23Å; T61-I65 WeakPolarHBondContact O-CG1 3.34Å; T61-I65 PolarHBondContact O-N 3.35Å |
| 62 | N | 66.9 | Low | 64.7 | Low | 96 Ų | 96 | 83.5 Ų | 83.5 | 51% | 0.513 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -69.6 | -38.4 | 178.2 | -70 | -25.9 | 0 | 0 | 0 | 112.5 | G58 L60 T66 | G58-N62 PolarHBondContact O-N 3.28Å; G58-N62 PolarHBondContact O-ND2 2.98Å; L60-N62 VanDerWaalsContact C-N 3.33Å; L60-N62 PolarHBondContact O-N 3.23Å; N62-T66 WeakPolarHBondContact O-CB 3.44Å; N62-T66 PolarHBondContact O-N 3.43Å; N62-T66 PolarHBondContact O-OG1 3.44Å |
| 63 | S | 73.4 | Confident | 65.5 | Low | 76 Ų | 76 | 84.2 Ų | 84.2 | 53% | 0.531 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -64.7 | -41 | 174.9 | -174.5 | 0 | 0 | 0 | 0 | 111.9 | D59 L60 T66 A67 | D59-S63 WeakPolarHBondContact O-CB 3.42Å; D59-S63 PolarHBondContact O-N 3.07Å; L60-S63 PolarHBondContact O-N 3.38Å; S63-T66 PolarHBondContact O-N 2.99Å; S63-A67 WeakPolarHBondContact O-CB 3.35Å; S63-A67 PolarHBondContact O-N 2.8Å |
| 64 | I | 69.6 | Low | 66.8 | Low | 94 Ų | 94 | 79.3 Ų | 79.3 | 48% | 0.482 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -70.4 | -40.7 | -179.9 | -68.4 | 165.3 | 0 | 0 | 0 | 111.4 | L60 T61 T66 A67 V68 | L60-I64 HydrophobicContact CD2-CD1 4.25Å; L60-I64 HydrophobicContact CG-CD1 3.92Å; L60-I64 WeakPolarHBondContact O-CB 3.47Å; L60-I64 WeakPolarHBondContact O-CD1 3.37Å; L60-I64 WeakPolarHBondContact O-CG1 3.04Å; L60-I64 PolarHBondContact O-N 3.15Å; T61-I64 PolarHBondContact O-N 2.94Å; I64-T66 VanDerWaalsContact C-N 3.27Å; I64-T66 PolarHBondContact O-N 3.14Å; I64-A67 PolarHBondContact O-N 3.44Å; I64-V68 HydrophobicContact CG2-CG2 4.49Å; I64-V68 VanDerWaalsContact O-CG2 3.23Å; I64-V68 WeakPolarHBondContact O-CG2 3.2Å; I64-V68 PolarHBondContact O-N 3.47Å |
| 65 | I | 73.6 | Confident | 67.6 | Low | 59 Ų | 59 | 78.1 Ų | 78.1 | 30% | 0.303 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -60.4 | -41.7 | 173.2 | -68.8 | 162.2 | 0 | 0 | 0 | 110.4 | V41 T61 V68 F69 | V41-I65 HydrophobicContact CG1-CG1 4.44Å; V41-I65 HydrophobicContact CG1-CG2 3.65Å; T61-I65 HydrophobicContact CG2-CD1 4.1Å; T61-I65 WeakPolarHBondContact O-CD1 3.23Å; T61-I65 WeakPolarHBondContact O-CG1 3.34Å; T61-I65 PolarHBondContact O-N 3.35Å; I65-V68 PolarHBondContact O-N 2.85Å; I65-F69 WeakPolarHBondContact O-CB 3.29Å; I65-F69 PolarHBondContact O-N 3.24Å |
| 66 | T | 70.6 | Confident | 68.3 | Low | 78 Ų | 78 | 76.4 Ų | 76.4 | 48% | 0.479 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -66.6 | -41.1 | 178.9 | -58.1 | 0 | 0 | 0 | 0 | 112.4 | N62 S63 I64 F69 L70 | N62-T66 WeakPolarHBondContact O-CB 3.44Å; N62-T66 PolarHBondContact O-N 3.43Å; N62-T66 PolarHBondContact O-OG1 3.44Å; S63-T66 PolarHBondContact O-N 2.99Å; I64-T66 VanDerWaalsContact C-N 3.27Å; I64-T66 PolarHBondContact O-N 3.14Å; T66-F69 PolarHBondContact O-N 3.37Å; T66-L70 HydrophobicContact CG2-CD1 4.24Å; T66-L70 WeakPolarHBondContact O-CG 3.39Å; T66-L70 PolarHBondContact O-N 3.35Å |
| 67 | A | 76.4 | Confident | 68.8 | Low | 58 Ų | 58 | 74.3 Ų | 74.3 | 48% | 0.479 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -66.2 | -41.6 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | S63 I64 F69 L70 S71 | S63-A67 WeakPolarHBondContact O-CB 3.35Å; S63-A67 PolarHBondContact O-N 2.8Å; I64-A67 PolarHBondContact O-N 3.44Å; A67-F69 VanDerWaalsContact C-N 3.33Å; A67-L70 PolarHBondContact O-N 2.94Å; A67-S71 WeakPolarHBondContact O-CB 3.37Å; A67-S71 PolarHBondContact O-N 2.88Å |
| 68 | V | 73.8 | Confident | 69.1 | Low | 55 Ų | 55 | 78.5 Ų | 78.5 | 33% | 0.333 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -67.3 | -38.3 | 179.2 | 176 | 0 | 0 | 0 | 0 | 110.9 | F37 I64 I65 S71 V72 | F37-V68 HydrophobicContact CE1-CG1 3.38Å; F37-V68 HydrophobicContact CZ-CG1 3.42Å; F37-V68 VanDerWaalsContact CZ-CG1 3.42Å; I64-V68 HydrophobicContact CG2-CG2 4.49Å; I64-V68 VanDerWaalsContact O-CG2 3.23Å; I64-V68 WeakPolarHBondContact O-CG2 3.2Å; I64-V68 PolarHBondContact O-N 3.47Å; I65-V68 PolarHBondContact O-N 2.85Å; V68-S71 PolarHBondContact O-N 3.19Å; V68-V72 WeakPolarHBondContact O-CG2 3.46Å; V68-V72 PolarHBondContact O-N 3.06Å; V68-V72 VanDerWaalsContact O-N 3.15Å |
| 69 | F | 69.3 | Low | 69.1 | Low | 96 Ų | 96 | 81.7 Ų | 81.7 | 42% | 0.421 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -60.9 | -48.6 | 173.2 | 178.4 | -118.7 | 0 | 0 | 0 | 112.2 | M38 I65 T66 A67 S71 V72 V73 | M38-F69 HydrophobicContact CE-CD2 3.1Å; M38-F69 HydrophobicContact CE-CE2 3.02Å; M38-F69 HydrophobicContact CE-CG 4.08Å; M38-F69 HydrophobicContact CE-CZ 3.96Å; I65-F69 WeakPolarHBondContact O-CB 3.29Å; I65-F69 PolarHBondContact O-N 3.24Å; T66-F69 PolarHBondContact O-N 3.37Å; A67-F69 VanDerWaalsContact C-N 3.33Å; F69-S71 VanDerWaalsContact C-N 3.27Å; F69-S71 PolarHBondContact O-N 2.79Å; F69-V72 PolarHBondContact O-N 2.77Å; F69-V73 HydrophobicContact CD2-CG2 4.32Å; F69-V73 HydrophobicContact CE1-CG2 4.33Å; F69-V73 HydrophobicContact CE2-CG2 3.94Å; F69-V73 HydrophobicContact CZ-CG2 3.97Å; F69-V73 WeakPolarHBondContact O-CG2 3.48Å; F69-V73 PolarHBondContact O-N 3.37Å |
| 70 | L | 76.6 | Confident | 68.8 | Low | 103 Ų | 103 | 80.2 Ų | 80.2 | 54% | 0.539 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -64.5 | -32.7 | 179.8 | -71.9 | 171.5 | 0 | 0 | 0 | 112.6 | T66 A67 V73 A74 | T66-L70 HydrophobicContact CG2-CD1 4.24Å; T66-L70 WeakPolarHBondContact O-CG 3.39Å; T66-L70 PolarHBondContact O-N 3.35Å; A67-L70 PolarHBondContact O-N 2.94Å; L70-V73 PolarHBondContact O-N 3.47Å; L70-A74 VanDerWaalsContact O-CB 3.29Å; L70-A74 WeakPolarHBondContact O-CB 3.09Å; L70-A74 PolarHBondContact O-N 2.91Å |
| 71 | S | 67.9 | Low | 68.2 | Low | 64 Ų | 64 | 81.8 Ų | 81.8 | 45% | 0.448 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -67.4 | -43.8 | 176.2 | -167.1 | 0 | 0 | 0 | 0 | 112.2 | A67 V68 F69 V73 A74 I75 | A67-S71 WeakPolarHBondContact O-CB 3.37Å; A67-S71 PolarHBondContact O-N 2.88Å; V68-S71 PolarHBondContact O-N 3.19Å; F69-S71 VanDerWaalsContact C-N 3.27Å; F69-S71 PolarHBondContact O-N 2.79Å; S71-V73 VanDerWaalsContact C-N 3.31Å; S71-V73 PolarHBondContact O-N 3.46Å; S71-A74 PolarHBondContact O-N 3.04Å; S71-I75 WeakPolarHBondContact O-CD1 3.22Å; S71-I75 WeakPolarHBondContact O-CG1 3.23Å; S71-I75 PolarHBondContact O-N 2.74Å |
| 72 | V | 72.6 | Confident | 67.4 | Low | 40 Ų | 40 | 85.4 Ų | 85.4 | 24% | 0.242 | 47% | 0.467 | C | S | . | . | H | α-helix | trans | -62.9 | -40.7 | 175.4 | 175 | 0 | 0 | 0 | 0 | 110.8 | T34 V68 F69 I75 L76 | T34-V72 HydrophobicContact CG2-CG1 4.23Å; V68-V72 WeakPolarHBondContact O-CG2 3.46Å; V68-V72 PolarHBondContact O-N 3.06Å; V68-V72 VanDerWaalsContact O-N 3.15Å; F69-V72 PolarHBondContact O-N 2.77Å; V72-I75 PolarHBondContact O-N 3.45Å; V72-L76 PolarHBondContact O-N 2.84Å |
| 73 | V | 68.1 | Low | 66.6 | Low | 66 Ų | 66 | 84.4 Ų | 84.4 | 40% | 0.4 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -64.9 | -41.2 | 175.3 | 172.2 | 0 | 0 | 0 | 0 | 111.7 | F69 L70 S71 I75 L76 A77 | F69-V73 HydrophobicContact CD2-CG2 4.32Å; F69-V73 HydrophobicContact CE1-CG2 4.33Å; F69-V73 HydrophobicContact CE2-CG2 3.94Å; F69-V73 HydrophobicContact CZ-CG2 3.97Å; F69-V73 WeakPolarHBondContact O-CG2 3.48Å; F69-V73 PolarHBondContact O-N 3.37Å; L70-V73 PolarHBondContact O-N 3.47Å; S71-V73 VanDerWaalsContact C-N 3.31Å; S71-V73 PolarHBondContact O-N 3.46Å; V73-I75 VanDerWaalsContact C-N 3.34Å; V73-I75 PolarHBondContact O-N 3.41Å; V73-L76 PolarHBondContact O-N 3.31Å; V73-A77 WeakPolarHBondContact O-CB 3.44Å; V73-A77 PolarHBondContact O-N 3.05Å |
| 74 | A | 75.6 | Confident | 65.4 | Low | 50 Ų | 50 | 90.1 Ų | 90.1 | 41% | 0.413 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -65.4 | -39.2 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | L70 S71 A77 M78 | L70-A74 VanDerWaalsContact O-CB 3.29Å; L70-A74 WeakPolarHBondContact O-CB 3.09Å; L70-A74 PolarHBondContact O-N 2.91Å; S71-A74 PolarHBondContact O-N 3.04Å; A74-A77 PolarHBondContact O-N 3Å; A74-M78 WeakPolarHBondContact O-CB 2.71Å; A74-M78 VanDerWaalsContact O-CG 3.23Å; A74-M78 WeakPolarHBondContact O-CG 3.13Å; A74-M78 PolarHBondContact O-N 2.71Å |
| 75 | I | 69.8 | Low | 64.2 | Low | 91 Ų | 91 | 92 Ų | 92 | 47% | 0.467 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -66.7 | -42.3 | 177.1 | -66.7 | 162.8 | 0 | 0 | 0 | 110.1 | S71 V72 V73 M78 Q79 | S71-I75 WeakPolarHBondContact O-CD1 3.22Å; S71-I75 WeakPolarHBondContact O-CG1 3.23Å; S71-I75 PolarHBondContact O-N 2.74Å; V72-I75 PolarHBondContact O-N 3.45Å; V73-I75 VanDerWaalsContact C-N 3.34Å; V73-I75 PolarHBondContact O-N 3.41Å; I75-M78 PolarHBondContact O-N 3.15Å; I75-Q79 VanDerWaalsContact O-CG 3.3Å; I75-Q79 WeakPolarHBondContact O-CG 3.36Å; I75-Q79 PolarHBondContact O-N 3.04Å |
| 76 | L | 67.4 | Low | 63 | Low | 69 Ų | 69 | 95.7 Ų | 95.7 | 36% | 0.361 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -62.1 | -42.6 | 172.7 | -179.1 | 52.3 | 0 | 0 | 0 | 112.1 | N30 V72 V73 M78 Q79 E80 | N30-L76 WeakPolarHBondContact ND2-CD1 2.82Å; V72-L76 PolarHBondContact O-N 2.84Å; V73-L76 PolarHBondContact O-N 3.31Å; L76-M78 VanDerWaalsContact C-N 3.34Å; L76-M78 PolarHBondContact O-N 3.48Å; L76-Q79 WeakPolarHBondContact O-CB 3.28Å; L76-Q79 PolarHBondContact O-N 3.35Å; L76-E80 PolarHBondContact O-N 3.39Å |
| 77 | A | 63.6 | Low | 61.9 | Low | 54 Ų | 54 | 98 Ų | 98 | 45% | 0.446 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -66.6 | -34.3 | 178 | 0 | 0 | 0 | 0 | 0 | 112.9 | V73 A74 E80 K81 | V73-A77 WeakPolarHBondContact O-CB 3.44Å; V73-A77 PolarHBondContact O-N 3.05Å; A74-A77 PolarHBondContact O-N 3Å; A77-E80 PolarHBondContact O-N 3.34Å; A77-K81 WeakPolarHBondContact O-CB 3.3Å; A77-K81 PolarHBondContact O-N 2.89Å |
| 78 | M | 62.4 | Low | 60.3 | Low | 137 Ų | 137 | 104.6 Ų | 104.6 | 68% | 0.675 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -69.7 | -37.4 | 172.7 | -75 | -77.9 | -135.7 | 0 | 0 | 111.7 | A74 I75 L76 K81 K82 | A74-M78 WeakPolarHBondContact O-CB 2.71Å; A74-M78 VanDerWaalsContact O-CG 3.23Å; A74-M78 WeakPolarHBondContact O-CG 3.13Å; A74-M78 PolarHBondContact O-N 2.71Å; I75-M78 PolarHBondContact O-N 3.15Å; L76-M78 VanDerWaalsContact C-N 3.34Å; L76-M78 PolarHBondContact O-N 3.48Å; M78-K81 PolarHBondContact O-N 3.04Å; M78-K82 WeakPolarHBondContact O-CB 3.41Å; M78-K82 PolarHBondContact O-N 3.05Å |
| 79 | Q | 58.9 | Low | 59 | Low | 91 Ų | 91 | 106.8 Ų | 106.8 | 43% | 0.425 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -63.1 | -44.8 | 172 | -67.1 | -57.7 | -32.4 | 0 | 0 | 110.7 | I75 L76 K81 K82 R83 | I75-Q79 VanDerWaalsContact O-CG 3.3Å; I75-Q79 WeakPolarHBondContact O-CG 3.36Å; I75-Q79 PolarHBondContact O-N 3.04Å; L76-Q79 WeakPolarHBondContact O-CB 3.28Å; L76-Q79 PolarHBondContact O-N 3.35Å; Q79-K81 PolarHBondContact O-N 3.38Å; Q79-K82 PolarHBondContact O-N 2.82Å; Q79-R83 WeakPolarHBondContact O-CG 3.2Å; Q79-R83 PolarHBondContact O-N 3.47Å |
| 80 | E | 55.1 | Low | 57.9 | Low | 111 Ų | 111 | 105.4 Ų | 105.4 | 52% | 0.519 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -59.2 | -45.6 | 174.6 | -83 | -88.6 | 101.8 | 0 | 0 | 112.9 | L76 A77 K82 R83 R84 | L76-E80 PolarHBondContact O-N 3.39Å; A77-E80 PolarHBondContact O-N 3.34Å; E80-K82 PolarHBondContact O-N 3.45Å; E80-R83 PolarHBondContact O-N 3.44Å; E80-R84 PolarHBondContact O-N 2.98Å |
| 81 | K | 51.9 | Low | 56.6 | Low | 160 Ų | 160 | 103.4 Ų | 103.4 | 70% | 0.696 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -68.5 | -36.4 | -178.6 | -162.5 | 172.4 | -175.2 | 180 | 0 | 112.5 | A77 M78 Q79 R83 R84 H85 | A77-K81 WeakPolarHBondContact O-CB 3.3Å; A77-K81 PolarHBondContact O-N 2.89Å; M78-K81 PolarHBondContact O-N 3.04Å; Q79-K81 PolarHBondContact O-N 3.38Å; K81-R83 VanDerWaalsContact C-N 3.29Å; K81-R83 PolarHBondContact O-N 3.27Å; K81-R84 PolarHBondContact O-N 3.41Å; K81-H85 PolarHBondContact O-N 3.36Å |
| 82 | K | 50.9 | Low | 55.3 | Low | 146 Ų | 146 | 113.5 Ų | 113.5 | 64% | 0.635 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -68 | -26.8 | 174.9 | -168 | 170.2 | 178.1 | 173.4 | 0 | 112.4 | M78 Q79 E80 | M78-K82 WeakPolarHBondContact O-CB 3.41Å; M78-K82 PolarHBondContact O-N 3.05Å; Q79-K82 PolarHBondContact O-N 2.82Å; E80-K82 PolarHBondContact O-N 3.45Å |
| 83 | R | 51.3 | Low | 54.4 | Low | 74 Ų | 74 | 117.2 Ų | 117.2 | 28% | 0.279 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -77.6 | -28.4 | 173.1 | -59.7 | -158.3 | -32.1 | 171.2 | -23.9 | 113.8 | M23 D27 Q79 E80 K81 L87 | M23-R83 VanDerWaalsContact CB-NH1 3.33Å; M23-R83 HydrophobicContact CE-CB 4.17Å; M23-R83 HydrophobicContact CE-CG 3.97Å; M23-R83 PolarHBondContact SD-NH1 3.37Å; D27-R83 IonicContact OD2-NH2 3.84Å; Q79-R83 WeakPolarHBondContact O-CG 3.2Å; Q79-R83 PolarHBondContact O-N 3.47Å; E80-R83 PolarHBondContact O-N 3.44Å; K81-R83 VanDerWaalsContact C-N 3.29Å; K81-R83 PolarHBondContact O-N 3.27Å; R83-L87 WeakPolarHBondContact O-CB 3.45Å; R83-L87 PolarHBondContact O-N 2.74Å; R83-L87 VanDerWaalsContact O-N 3.08Å |
| 84 | R | 48.5 | Very low | 53.7 | Low | 197 Ų | 197 | 119.9 Ų | 119.9 | 74% | 0.743 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -70 | -32.4 | 173.7 | -66.5 | -135.1 | -78.9 | -153.6 | -4.1 | 113.3 | E80 K81 Y88 | E80-R84 PolarHBondContact O-N 2.98Å; K81-R84 PolarHBondContact O-N 3.41Å; R84-Y88 WeakPolarHBondContact O-CB 3.38Å; R84-Y88 PolarHBondContact O-N 3Å |
| 85 | H | 44 | Very low | 52.5 | Low | 134 Ų | 134 | 123.8 Ų | 123.8 | 62% | 0.62 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -73.2 | -33.7 | 176.4 | -145.7 | -95.9 | 0 | 0 | 0 | 112.5 | K81 V89 | K81-H85 PolarHBondContact O-N 3.36Å; H85-V89 WeakPolarHBondContact O-CB 3.47Å; H85-V89 WeakPolarHBondContact O-CG2 3.23Å; H85-V89 PolarHBondContact O-N 2.91Å; H85-V89 VanDerWaalsContact O-N 3.09Å |
| 86 | L | 47.9 | Very low | 51.5 | Low | 135 Ų | 135 | 125.7 Ų | 125.7 | 71% | 0.707 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -74.4 | -30.2 | 174.4 | -104.5 | 154.6 | 0 | 0 | 0 | 113.3 | ||
| 87 | L | 47.3 | Very low | 50.5 | Low | 128 Ų | 128 | 129.3 Ų | 129.3 | 67% | 0.67 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -79.1 | -29.9 | 171.9 | -94 | 148.4 | 0 | 0 | 0 | 113.3 | R83 | R83-L87 WeakPolarHBondContact O-CB 3.45Å; R83-L87 PolarHBondContact O-N 2.74Å; R83-L87 VanDerWaalsContact O-N 3.08Å |
| 88 | Y | 43.3 | Very low | 49.6 | Very low | 195 Ų | 195 | 134.3 Ų | 134.3 | 77% | 0.765 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -77 | -35.9 | 176.6 | -174.9 | -102.2 | 0 | 0 | 0 | 112.7 | R84 G90 G91 | R84-Y88 WeakPolarHBondContact O-CB 3.38Å; R84-Y88 PolarHBondContact O-N 3Å; Y88-G90 VanDerWaalsContact C-N 3.27Å; Y88-G90 PolarHBondContact O-N 3.19Å; Y88-G91 PolarHBondContact O-N 3.25Å |
| 89 | V | 46.8 | Very low | 48.7 | Very low | 101 Ų | 101 | 134.1 Ų | 134.1 | 61% | 0.612 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -73.6 | -18.6 | 174.7 | 174.5 | 0 | 0 | 0 | 0 | 112.4 | H85 G91 | H85-V89 WeakPolarHBondContact O-CB 3.47Å; H85-V89 WeakPolarHBondContact O-CG2 3.23Å; H85-V89 PolarHBondContact O-N 2.91Å; H85-V89 VanDerWaalsContact O-N 3.09Å; V89-G91 PolarHBondContact O-N 3.33Å |
| 90 | G | 46.8 | Very low | 47.9 | Very low | 67 Ų | 67 | 137.4 Ų | 137.4 | 69% | 0.691 | 66% | 0.662 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.5 | 2.2 | 174.8 | 0 | 0 | 0 | 0 | 0 | 115.1 | Y88 | Y88-G90 VanDerWaalsContact C-N 3.27Å; Y88-G90 PolarHBondContact O-N 3.19Å |
| 91 | G | 49.2 | Very low | 47.3 | Very low | 61 Ų | 61 | 139.6 Ų | 139.6 | 63% | 0.629 | 67% | 0.674 | S | S | * | * | trans | -107.2 | 55.5 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | Y88 V89 | Y88-G91 PolarHBondContact O-N 3.25Å; V89-G91 PolarHBondContact O-N 3.33Å | ||
| 92 | R | 40 | Very low | 46.9 | Very low | 277 Ų | 277 | 137.7 Ų | 137.7 | 100% | 1.045 | 67% | 0.672 | S | S | * | * | trans | -155.4 | 0 | 156.1 | -104.9 | -175.4 | -172.1 | 152.2 | 2.9 | 110.3 | H10 | H10-R92 PolarHBondContact CE1-O 2.74Š|
Retrieved 92 of 92 residues in 112.7 ms
(Link to these results)