| 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 | 49.5 | Very low | 60.2 | Low | 231 Ų | 231 | 135.8 Ų | 135.8 | 100% | 1.138 | 66% | 0.659 | S | S | * | * | 0 | 146.1 | 0 | -80.3 | 162.7 | 120 | 0 | 0 | 106.5 | D3 | M1-D3 PolarHBondContact O-N 3.19Å; M1-D3 VanDerWaalsContact O-N 3.14Å | |||
| 2 | L | 60.8 | Low | 60.3 | Low | 151 Ų | 151 | 137.2 Ų | 137.2 | 79% | 0.791 | 65% | 0.653 | S | S | * | * | trans | -63.1 | 110.3 | -170 | -75.3 | 115.2 | 0 | 0 | 0 | 111.4 | ||||
| 3 | D | 62.6 | Low | 60.2 | Low | 136 Ų | 136 | 139.7 Ų | 139.7 | 73% | 0.727 | 65% | 0.654 | S | S | * | * | S | Bend | trans | -86 | -3.8 | -178 | -73.9 | -35.1 | 0 | 0 | 0 | 113.8 | M1 | M1-D3 PolarHBondContact O-N 3.19Å; M1-D3 VanDerWaalsContact O-N 3.14Å |
| 4 | H | 61.4 | Low | 60.4 | Low | 101 Ų | 101 | 137.7 Ų | 137.7 | 47% | 0.468 | 65% | 0.645 | S | S | . | * | trans | -135.3 | 79.2 | -174.8 | -57.3 | -32.4 | 0 | 0 | 0 | 112.4 | E6 E7 | H4-E6 PolarHBondContact O-N 3.17Å; H4-E7 HydrophobicContact CB-CB 3.99Å; H4-E7 HydrophobicContact CB-CG 3.87Å; H4-E7 IonicContact CD2-OE1 3.94Å; H4-E7 IonicContact CD2-OE2 3.56Å; H4-E7 IonicContact CG-OE2 3.97Å; H4-E7 PolarHBondContact O-N 3.16Å | ||
| 5 | P | 60.6 | Low | 60.5 | Low | 85 Ų | 85 | 136.7 Ų | 136.7 | 55% | 0.552 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -64 | -24.8 | 176.9 | 25.9 | -33.9 | 0 | 0 | 0 | 113.3 | ||
| 6 | E | 62.3 | Low | 60.3 | Low | 133 Ų | 133 | 137 Ų | 137 | 62% | 0.621 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -70.6 | -33.6 | 175 | 25.3 | -82.8 | 142.4 | 0 | 0 | 113.4 | H4 Y8 Y9 S10 | H4-E6 PolarHBondContact O-N 3.17Å; E6-Y8 VanDerWaalsContact C-N 3.35Å; E6-Y9 PolarHBondContact O-N 3.29Å; E6-S10 PolarHBondContact O-N 3.36Å; E6-S10 VanDerWaalsContact O-N 3.1Å; E6-S10 PolarHBondContact O-OG 2.86Å; E6-S10 VanDerWaalsContact O-OG 3.08Å |
| 7 | E | 60.2 | Low | 60.4 | Low | 117 Ų | 117 | 132.6 Ų | 132.6 | 55% | 0.547 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -70.4 | -34.7 | 179.1 | -71.9 | -174.5 | 171.8 | 0 | 0 | 111.4 | H4 Y9 S10 H11 | H4-E7 HydrophobicContact CB-CB 3.99Å; H4-E7 HydrophobicContact CB-CG 3.87Å; H4-E7 IonicContact CD2-OE1 3.94Å; H4-E7 IonicContact CD2-OE2 3.56Å; H4-E7 IonicContact CG-OE2 3.97Å; H4-E7 PolarHBondContact O-N 3.16Å; E7-Y9 VanDerWaalsContact C-N 3.31Å; E7-Y9 PolarHBondContact O-N 3.09Å; E7-S10 WeakPolarHBondContact CA-OG 3.24Å; E7-S10 PolarHBondContact O-N 3.31Å; E7-S10 PolarHBondContact O-OG 3.28Å; E7-S10 VanDerWaalsContact O-OG 3.09Å; E7-H11 WeakPolarHBondContact O-CB 3.31Å; E7-H11 PolarHBondContact O-N 3.41Å |
| 8 | Y | 60.3 | Low | 60.4 | Low | 170 Ų | 170 | 136.6 Ų | 136.6 | 67% | 0.667 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -61 | -40.3 | 175.9 | -169.1 | -99.9 | 0 | 0 | 0 | 112.2 | E6 Y12 | E6-Y8 VanDerWaalsContact C-N 3.35Å; Y8-Y12 PolarHBondContact O-N 3.38Å |
| 9 | Y | 58.3 | Low | 60.3 | Low | 163 Ų | 163 | 139.2 Ų | 139.2 | 64% | 0.639 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -75.6 | -40.8 | 179.5 | -108.6 | -86.9 | 0 | 0 | 0 | 113.3 | E6 E7 Y12 Y13 | E6-Y9 PolarHBondContact O-N 3.29Å; E7-Y9 VanDerWaalsContact C-N 3.31Å; E7-Y9 PolarHBondContact O-N 3.09Å; Y9-Y12 PolarHBondContact O-N 3.1Å; Y9-Y13 PolarHBondContact O-N 3.43Å |
| 10 | S | 62.4 | Low | 60 | Low | 58 Ų | 58 | 137.1 Ų | 137.1 | 41% | 0.406 | 62% | 0.624 | S | S | . | * | H | α-helix | trans | -68.2 | -37.2 | -179.7 | 56.8 | 0 | 0 | 0 | 0 | 112.2 | E6 E7 Y12 Y13 H14 | E6-S10 PolarHBondContact O-N 3.36Å; E6-S10 VanDerWaalsContact O-N 3.1Å; E6-S10 PolarHBondContact O-OG 2.86Å; E6-S10 VanDerWaalsContact O-OG 3.08Å; E7-S10 WeakPolarHBondContact CA-OG 3.24Å; E7-S10 PolarHBondContact O-N 3.31Å; E7-S10 PolarHBondContact O-OG 3.28Å; E7-S10 VanDerWaalsContact O-OG 3.09Å; S10-Y12 VanDerWaalsContact C-N 3.35Å; S10-Y12 PolarHBondContact O-N 3.27Å; S10-Y13 PolarHBondContact O-N 2.97Å; S10-H14 WeakPolarHBondContact O-CB 3.27Å; S10-H14 PolarHBondContact O-N 2.91Å |
| 11 | H | 63.8 | Low | 60 | Low | 149 Ų | 149 | 133.3 Ų | 133.3 | 69% | 0.69 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -66.6 | -36.5 | 176.2 | -128.1 | -101.8 | 0 | 0 | 0 | 112.4 | E7 H14 Y15 | E7-H11 WeakPolarHBondContact O-CB 3.31Å; E7-H11 PolarHBondContact O-N 3.41Å; H11-H14 PolarHBondContact O-N 2.86Å; H11-Y15 WeakPolarHBondContact O-CB 3.35Å; H11-Y15 PolarHBondContact O-N 3.11Å |
| 12 | Y | 61.6 | Low | 60.7 | Low | 152 Ų | 152 | 126.8 Ų | 126.8 | 60% | 0.596 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -64.6 | -45.3 | 177.5 | -167.2 | -110.5 | 0 | 0 | 0 | 111.9 | Y8 Y9 S10 Y15 Y16 | Y8-Y12 PolarHBondContact O-N 3.38Å; Y9-Y12 PolarHBondContact O-N 3.1Å; S10-Y12 VanDerWaalsContact C-N 3.35Å; S10-Y12 PolarHBondContact O-N 3.27Å; Y12-Y15 PolarHBondContact O-N 2.94Å; Y12-Y16 PolarHBondContact O-N 3.21Å |
| 13 | Y | 59.3 | Low | 61.2 | Low | 170 Ų | 170 | 130.1 Ų | 130.1 | 67% | 0.667 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -65.2 | -40.1 | 175.3 | -103.1 | -85.3 | 0 | 0 | 0 | 112.8 | Y9 S10 S17 | Y9-Y13 PolarHBondContact O-N 3.43Å; S10-Y13 PolarHBondContact O-N 2.97Å; Y13-S17 WeakPolarHBondContact O-CB 3.5Å; Y13-S17 PolarHBondContact O-N 3.44Å; Y13-S17 PolarHBondContact O-OG 2.61Å; Y13-S17 VanDerWaalsContact O-OG 3.11Å |
| 14 | H | 62.4 | Low | 61.7 | Low | 112 Ų | 112 | 127.7 Ų | 127.7 | 52% | 0.519 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -69.4 | -34.9 | 178 | -95.8 | -47.1 | 0 | 0 | 0 | 113.5 | S10 H11 S17 R18 | S10-H14 WeakPolarHBondContact O-CB 3.27Å; S10-H14 PolarHBondContact O-N 2.91Å; H11-H14 PolarHBondContact O-N 2.86Å; H14-S17 PolarHBondContact O-OG 3.35Å; H14-R18 PolarHBondContact O-N 2.88Å |
| 15 | Y | 62.2 | Low | 62.8 | Low | 123 Ų | 123 | 127 Ų | 127 | 48% | 0.482 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -67.6 | -41.3 | 177.1 | -173.8 | -100.7 | 0 | 0 | 0 | 112 | H11 Y12 R19 | H11-Y15 WeakPolarHBondContact O-CB 3.35Å; H11-Y15 PolarHBondContact O-N 3.11Å; Y12-Y15 PolarHBondContact O-N 2.94Å; Y15-R19 PolarHBondContact O-N 3.26Å; Y15-R19 PolarHBondContact OH-NE 3.49Å; Y15-R19 PolarHBondContact OH-NH1 3.25Å |
| 16 | Y | 57.5 | Low | 63.9 | Low | 141 Ų | 141 | 127.1 Ų | 127.1 | 55% | 0.553 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -71.7 | -43.7 | 178.5 | -124.1 | -119.9 | 0 | 0 | 0 | 111.8 | Y12 R18 R19 L20 | Y12-Y16 PolarHBondContact O-N 3.21Å; Y16-R18 VanDerWaalsContact C-N 3.33Å; Y16-R18 PolarHBondContact O-N 3.48Å; Y16-R19 PolarHBondContact O-N 2.87Å; Y16-L20 HydrophobicContact CD1-CD1 2.97Å; Y16-L20 HydrophobicContact CD1-CG 4.42Å; Y16-L20 HydrophobicContact CD2-CD1 3.75Å; Y16-L20 HydrophobicContact CE1-CD1 2.93Å; Y16-L20 HydrophobicContact CE1-CG 4.39Å; Y16-L20 HydrophobicContact CE2-CD1 3.7Å; Y16-L20 HydrophobicContact CG-CD1 3.37Å; Y16-L20 VanDerWaalsContact O-CB 3.31Å; Y16-L20 WeakPolarHBondContact O-CB 3.37Å; Y16-L20 PolarHBondContact O-N 2.93Å |
| 17 | S | 61.5 | Low | 65.1 | Low | 63 Ų | 63 | 129.7 Ų | 129.7 | 44% | 0.441 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -62.9 | -35 | 179.6 | 63 | 0 | 0 | 0 | 0 | 113.7 | Y13 H14 A21 | Y13-S17 WeakPolarHBondContact O-CB 3.5Å; Y13-S17 PolarHBondContact O-N 3.44Å; Y13-S17 PolarHBondContact O-OG 2.61Å; Y13-S17 VanDerWaalsContact O-OG 3.11Å; H14-S17 PolarHBondContact O-OG 3.35Å; S17-A21 VanDerWaalsContact O-CB 3.3Å; S17-A21 WeakPolarHBondContact O-CB 3.42Å; S17-A21 PolarHBondContact O-N 3.5Å |
| 18 | R | 60.3 | Low | 66.5 | Low | 204 Ų | 204 | 127.6 Ų | 127.6 | 77% | 0.77 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -79.1 | -27.8 | 179.4 | -73.9 | -177.7 | 178.4 | 177.4 | 1.2 | 114 | H14 Y16 | H14-R18 PolarHBondContact O-N 2.88Å; Y16-R18 VanDerWaalsContact C-N 3.33Å; Y16-R18 PolarHBondContact O-N 3.48Å |
| 19 | R | 58.1 | Low | 67.9 | Low | 186 Ų | 186 | 123 Ų | 123 | 70% | 0.702 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -93.9 | -26.2 | 179.8 | -71.8 | -166.1 | 174.6 | -149.5 | 2.6 | 114 | Y15 Y16 | Y15-R19 PolarHBondContact O-N 3.26Å; Y15-R19 PolarHBondContact OH-NE 3.49Å; Y15-R19 PolarHBondContact OH-NH1 3.25Å; Y16-R19 PolarHBondContact O-N 2.87Å |
| 20 | L | 55.6 | Low | 69.6 | Low | 97 Ų | 97 | 120.1 Ų | 120.1 | 51% | 0.508 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -107.6 | 4 | -179.2 | -68.5 | 150 | 0 | 0 | 0 | 113.8 | Y16 P22 | Y16-L20 HydrophobicContact CD1-CD1 2.97Å; Y16-L20 HydrophobicContact CD1-CG 4.42Å; Y16-L20 HydrophobicContact CD2-CD1 3.75Å; Y16-L20 HydrophobicContact CE1-CD1 2.93Å; Y16-L20 HydrophobicContact CE1-CG 4.39Å; Y16-L20 HydrophobicContact CE2-CD1 3.7Å; Y16-L20 HydrophobicContact CG-CD1 3.37Å; Y16-L20 VanDerWaalsContact O-CB 3.31Å; Y16-L20 WeakPolarHBondContact O-CB 3.37Å; Y16-L20 PolarHBondContact O-N 2.93Å; L20-P22 WeakPolarHBondContact O-CD 3.44Å |
| 21 | A | 58.8 | Low | 71.1 | Confident | 58 Ų | 58 | 122.9 Ų | 122.9 | 48% | 0.479 | 58% | 0.581 | S | S | . | * | S | Bend | trans | -52.5 | 108.9 | 161.3 | 0 | 0 | 0 | 0 | 0 | 107.2 | S17 K23 | S17-A21 VanDerWaalsContact O-CB 3.3Å; S17-A21 WeakPolarHBondContact O-CB 3.42Å; S17-A21 PolarHBondContact O-N 3.5Å; A21-K23 PolarHBondContact O-N 3.04Å |
| 22 | P | 64.8 | Low | 72.6 | Confident | 94 Ų | 94 | 120.1 Ų | 120.1 | 61% | 0.61 | 58% | 0.575 | S | S | * | * | trans | -59.2 | 120 | -179.1 | -17.8 | 30.8 | 0 | 0 | 0 | 106.7 | L20 V24 | L20-P22 WeakPolarHBondContact O-CD 3.44Å; P22-V24 WeakPolarHBondContact CB-O 3.25Å; P22-V24 PolarHBondContact O-N 3.41Å | ||
| 23 | K | 70.5 | Confident | 74.2 | Confident | 221 Ų | 221 | 115.7 Ų | 115.7 | 96% | 0.961 | 57% | 0.566 | S | S | * | * | S | Bend | trans | -61.2 | -14.6 | 176.5 | -70.6 | -178.7 | 178.5 | 176.2 | 0 | 112.2 | A21 | A21-K23 PolarHBondContact O-N 3.04Š|
| 24 | V | 73 | Confident | 76 | Confident | 85 Ų | 85 | 112 Ų | 112 | 52% | 0.515 | 56% | 0.561 | S | S | . | * | S | Bend | trans | -111.2 | 123 | 178.5 | -164.1 | 0 | 0 | 0 | 0 | 108 | P22 V26 V28 V29 | P22-V24 WeakPolarHBondContact CB-O 3.25Å; P22-V24 PolarHBondContact O-N 3.41Å; V24-V26 PolarHBondContact O-N 3.45Å; V24-V28 HydrophobicContact CG1-CB 4.45Å; V24-V28 HydrophobicContact CG1-CG1 4.48Å; V24-V29 HydrophobicContact CG1-CG2 4.14Å |
| 25 | D | 85.3 | Confident | 77.6 | Confident | 86 Ų | 86 | 110 Ų | 110 | 46% | 0.46 | 56% | 0.559 | S | S | . | * | trans | -58.4 | 129.7 | 175.9 | -173.8 | -19.8 | 0 | 0 | 0 | 109.7 | R27 V28 V29 | D25-R27 PolarHBondContact O-N 3.35Å; D25-R27 VanDerWaalsContact O-N 3.1Å; D25-R27 WeakPolarHBondContact OD1-CB 3.5Å; D25-R27 WeakPolarHBondContact OD1-CG 3.5Å; D25-R27 PolarHBondContact OD1-N 3.18Å; D25-V28 HydrophobicContact CB-CG2 4.23Å; D25-V28 WeakPolarHBondContact O-CB 3.39Å; D25-V28 PolarHBondContact O-N 2.9Å; D25-V29 PolarHBondContact O-N 3.48Å | ||
| 26 | V | 83.8 | Confident | 79.2 | Confident | 88 Ų | 88 | 106.5 Ų | 106.5 | 53% | 0.533 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -53.8 | -31.9 | 178.9 | -177.6 | 0 | 0 | 0 | 0 | 111.2 | V24 V28 V29 I30 | V24-V26 PolarHBondContact O-N 3.45Å; V26-V28 VanDerWaalsContact C-N 3.32Å; V26-V28 PolarHBondContact O-N 2.86Å; V26-V29 WeakPolarHBondContact O-CB 3.28Å; V26-V29 PolarHBondContact O-N 2.87Å; V26-I30 HydrophobicContact CG1-CD1 4.11Å; V26-I30 HydrophobicContact CG1-CG1 4.49Å; V26-I30 WeakPolarHBondContact O-CG1 3.29Å; V26-I30 PolarHBondContact O-N 3.23Å |
| 27 | R | 86.4 | Confident | 81.1 | Confident | 187 Ų | 187 | 104.4 Ų | 104.4 | 71% | 0.706 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -60.9 | -40.3 | 176.4 | -64.2 | 171.3 | 179 | 178.5 | -0.2 | 112.5 | D25 V29 I30 L31 | D25-R27 PolarHBondContact O-N 3.35Å; D25-R27 VanDerWaalsContact O-N 3.1Å; D25-R27 WeakPolarHBondContact OD1-CB 3.5Å; D25-R27 WeakPolarHBondContact OD1-CG 3.5Å; D25-R27 PolarHBondContact OD1-N 3.18Å; R27-V29 VanDerWaalsContact C-N 3.35Å; R27-I30 PolarHBondContact O-N 2.9Å; R27-L31 PolarHBondContact O-N 3.34Å |
| 28 | V | 89.9 | Confident | 82.7 | Confident | 73 Ų | 73 | 104.8 Ų | 104.8 | 44% | 0.442 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -66.9 | -41.2 | 177.6 | 176.9 | 0 | 0 | 0 | 0 | 110 | V24 D25 V26 I30 L31 V32 | V24-V28 HydrophobicContact CG1-CB 4.45Å; V24-V28 HydrophobicContact CG1-CG1 4.48Å; D25-V28 HydrophobicContact CB-CG2 4.23Å; D25-V28 WeakPolarHBondContact O-CB 3.39Å; D25-V28 PolarHBondContact O-N 2.9Å; V26-V28 VanDerWaalsContact C-N 3.32Å; V26-V28 PolarHBondContact O-N 2.86Å; V28-I30 VanDerWaalsContact C-N 3.33Å; V28-I30 PolarHBondContact O-N 3.43Å; V28-L31 PolarHBondContact O-N 3.29Å; V28-V32 HydrophobicContact CG1-CG2 4.26Å; V28-V32 WeakPolarHBondContact O-CB 3.32Å; V28-V32 VanDerWaalsContact O-CG2 3.31Å; V28-V32 WeakPolarHBondContact O-CG2 3.26Å; V28-V32 PolarHBondContact O-N 3.32Å |
| 29 | V | 90.8 | Very high | 84.3 | Confident | 74 Ų | 74 | 100.4 Ų | 100.4 | 45% | 0.448 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -61 | -44 | 177.5 | -177.5 | 0 | 0 | 0 | 0 | 111 | V24 D25 V26 R27 S33 | V24-V29 HydrophobicContact CG1-CG2 4.14Å; D25-V29 PolarHBondContact O-N 3.48Å; V26-V29 WeakPolarHBondContact O-CB 3.28Å; V26-V29 PolarHBondContact O-N 2.87Å; R27-V29 VanDerWaalsContact C-N 3.35Å; V29-S33 VanDerWaalsContact O-CB 3.31Å; V29-S33 WeakPolarHBondContact O-CB 3.47Å; V29-S33 PolarHBondContact O-N 3.44Å; V29-S33 PolarHBondContact O-OG 2.93Å |
| 30 | I | 93 | Very high | 86 | Confident | 102 Ų | 102 | 99 Ų | 99 | 52% | 0.523 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -63 | -47.9 | 177 | -66.5 | 168.2 | 0 | 0 | 0 | 110.5 | V26 R27 V28 V32 S33 V34 | V26-I30 HydrophobicContact CG1-CD1 4.11Å; V26-I30 HydrophobicContact CG1-CG1 4.49Å; V26-I30 WeakPolarHBondContact O-CG1 3.29Å; V26-I30 PolarHBondContact O-N 3.23Å; R27-I30 PolarHBondContact O-N 2.9Å; V28-I30 VanDerWaalsContact C-N 3.33Å; V28-I30 PolarHBondContact O-N 3.43Å; I30-V32 PolarHBondContact O-N 3Å; I30-S33 PolarHBondContact O-N 3.01Å; I30-V34 HydrophobicContact CG2-CG2 4.36Å; I30-V34 WeakPolarHBondContact O-CG2 3.4Å; I30-V34 PolarHBondContact O-N 3.19Å |
| 31 | L | 95.1 | Very high | 87.6 | Confident | 115 Ų | 115 | 100.3 Ų | 100.3 | 60% | 0.602 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -57.7 | -49.7 | 178.4 | -85.9 | 170.8 | 0 | 0 | 0 | 111.9 | R27 V28 S33 V34 C35 | R27-L31 PolarHBondContact O-N 3.34Å; V28-L31 PolarHBondContact O-N 3.29Å; L31-S33 VanDerWaalsContact C-N 3.31Å; L31-S33 PolarHBondContact O-N 3.27Å; L31-V34 PolarHBondContact O-N 3.44Å; L31-C35 WeakPolarHBondContact O-CB 3.3Å; L31-C35 PolarHBondContact O-N 2.9Å; L31-C35 PolarHBondContact O-SG 2.9Å |
| 32 | V | 95.3 | Very high | 89.2 | Confident | 92 Ų | 92 | 103.6 Ų | 103.6 | 56% | 0.558 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -61.7 | -41.6 | 179.1 | 172.2 | 0 | 0 | 0 | 0 | 110.9 | V28 I30 C35 A36 | V28-V32 HydrophobicContact CG1-CG2 4.26Å; V28-V32 WeakPolarHBondContact O-CB 3.32Å; V28-V32 VanDerWaalsContact O-CG2 3.31Å; V28-V32 WeakPolarHBondContact O-CG2 3.26Å; V28-V32 PolarHBondContact O-N 3.32Å; I30-V32 PolarHBondContact O-N 3Å; V32-C35 PolarHBondContact O-N 3.24Å; V32-A36 VanDerWaalsContact O-CB 3.3Å; V32-A36 WeakPolarHBondContact O-CB 3.37Å; V32-A36 PolarHBondContact O-N 3.38Å |
| 33 | S | 95.4 | Very high | 90.4 | Very high | 58 Ų | 58 | 105.8 Ų | 105.8 | 41% | 0.406 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -63.1 | -47 | 179.1 | -58.1 | 0 | 0 | 0 | 0 | 111.6 | V29 I30 L31 A36 I37 | V29-S33 VanDerWaalsContact O-CB 3.31Å; V29-S33 WeakPolarHBondContact O-CB 3.47Å; V29-S33 PolarHBondContact O-N 3.44Å; V29-S33 PolarHBondContact O-OG 2.93Å; I30-S33 PolarHBondContact O-N 3.01Å; L31-S33 VanDerWaalsContact C-N 3.31Å; L31-S33 PolarHBondContact O-N 3.27Å; S33-A36 PolarHBondContact O-N 3.38Å; S33-I37 VanDerWaalsContact O-CG1 3.28Å; S33-I37 WeakPolarHBondContact O-CG1 3.41Å; S33-I37 PolarHBondContact O-N 3.41Å |
| 34 | V | 96.6 | Very high | 91.1 | Very high | 92 Ų | 92 | 98.3 Ų | 98.3 | 56% | 0.558 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -63.9 | -43.9 | 178 | 173.4 | 0 | 0 | 0 | 0 | 110.9 | I30 L31 A36 I37 S38 | I30-V34 HydrophobicContact CG2-CG2 4.36Å; I30-V34 WeakPolarHBondContact O-CG2 3.4Å; I30-V34 PolarHBondContact O-N 3.19Å; L31-V34 PolarHBondContact O-N 3.44Å; V34-A36 PolarHBondContact O-N 2.83Å; V34-I37 PolarHBondContact O-N 3.02Å; V34-S38 VanDerWaalsContact O-CB 3.31Å; V34-S38 WeakPolarHBondContact O-CB 3.44Å; V34-S38 PolarHBondContact O-N 3.36Å |
| 35 | C | 96.1 | Very high | 91.6 | Very high | 71 Ų | 71 | 102.7 Ų | 102.7 | 48% | 0.48 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -60.5 | -44.6 | 175.7 | -73.6 | 0 | 0 | 0 | 0 | 112.1 | L31 V32 S38 M39 | L31-C35 WeakPolarHBondContact O-CB 3.3Å; L31-C35 PolarHBondContact O-N 2.9Å; L31-C35 PolarHBondContact O-SG 2.9Å; V32-C35 PolarHBondContact O-N 3.24Å; C35-S38 PolarHBondContact O-N 3.3Å; C35-M39 WeakPolarHBondContact O-CG 3.41Å; C35-M39 PolarHBondContact O-N 3.46Å |
| 36 | A | 95.8 | Very high | 91.6 | Very high | 49 Ų | 49 | 105 Ų | 105 | 41% | 0.405 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -62.6 | -45.9 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112 | V32 S33 V34 M39 F40 | V32-A36 VanDerWaalsContact O-CB 3.3Å; V32-A36 WeakPolarHBondContact O-CB 3.37Å; V32-A36 PolarHBondContact O-N 3.38Å; S33-A36 PolarHBondContact O-N 3.38Å; V34-A36 PolarHBondContact O-N 2.83Å; A36-M39 PolarHBondContact O-N 3Å; A36-F40 PolarHBondContact O-N 2.95Å |
| 37 | I | 96.2 | Very high | 91.3 | Very high | 97 Ų | 97 | 104.8 Ų | 104.8 | 50% | 0.497 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -62.2 | -45 | 176.9 | -67.9 | 166.6 | 0 | 0 | 0 | 110.4 | S33 V34 M39 F40 Q41 | S33-I37 VanDerWaalsContact O-CG1 3.28Å; S33-I37 WeakPolarHBondContact O-CG1 3.41Å; S33-I37 PolarHBondContact O-N 3.41Å; V34-I37 PolarHBondContact O-N 3.02Å; I37-M39 PolarHBondContact O-N 3.48Å; I37-F40 PolarHBondContact O-N 3.39Å; I37-Q41 HydrophobicContact CG2-CG 4.36Å; I37-Q41 VanDerWaalsContact O-CG 3.31Å; I37-Q41 WeakPolarHBondContact O-CG 3.31Å; I37-Q41 PolarHBondContact O-N 3.37Å |
| 38 | S | 94.8 | Very high | 91.1 | Very high | 71 Ų | 71 | 99 Ų | 99 | 50% | 0.497 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -61.2 | -45.3 | 179.5 | -179.4 | 0 | 0 | 0 | 0 | 112.2 | V34 C35 F40 Q41 Y42 | V34-S38 VanDerWaalsContact O-CB 3.31Å; V34-S38 WeakPolarHBondContact O-CB 3.44Å; V34-S38 PolarHBondContact O-N 3.36Å; C35-S38 PolarHBondContact O-N 3.3Å; S38-F40 PolarHBondContact O-N 3.31Å; S38-Q41 PolarHBondContact O-N 2.97Å; S38-Y42 PolarHBondContact O-N 3.48Å |
| 39 | M | 95.1 | Very high | 90.6 | Very high | 112 Ų | 112 | 101.5 Ų | 101.5 | 55% | 0.552 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -59.7 | -46.7 | 175.2 | -75.1 | -174 | -70.3 | 0 | 0 | 111.4 | C35 A36 I37 Q41 Y42 F43 | C35-M39 WeakPolarHBondContact O-CG 3.41Å; C35-M39 PolarHBondContact O-N 3.46Å; A36-M39 PolarHBondContact O-N 3Å; I37-M39 PolarHBondContact O-N 3.48Å; M39-Q41 VanDerWaalsContact C-N 3.33Å; M39-Q41 PolarHBondContact O-N 3.42Å; M39-Y42 PolarHBondContact O-N 3.19Å; M39-F43 WeakPolarHBondContact O-CD2 3.37Å; M39-F43 PolarHBondContact O-N 3.17Å |
| 40 | F | 93.2 | Very high | 90.1 | Very high | 158 Ų | 158 | 101.2 Ų | 101.2 | 69% | 0.693 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -60.7 | -43.2 | 179.3 | -172.5 | -96.3 | 0 | 0 | 0 | 112.2 | A36 I37 S38 S44 | A36-F40 PolarHBondContact O-N 2.95Å; I37-F40 PolarHBondContact O-N 3.39Å; S38-F40 PolarHBondContact O-N 3.31Å; F40-S44 WeakPolarHBondContact O-CB 3.18Å; F40-S44 PolarHBondContact O-N 3.06Å |
| 41 | Q | 89.5 | Confident | 89.4 | Confident | 123 Ų | 123 | 102.6 Ų | 102.6 | 58% | 0.575 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -61.4 | -44.6 | 175.4 | -71.7 | 176.9 | 14.1 | 0 | 0 | 111.9 | I37 S38 M39 S44 W45 | I37-Q41 HydrophobicContact CG2-CG 4.36Å; I37-Q41 VanDerWaalsContact O-CG 3.31Å; I37-Q41 WeakPolarHBondContact O-CG 3.31Å; I37-Q41 PolarHBondContact O-N 3.37Å; S38-Q41 PolarHBondContact O-N 2.97Å; M39-Q41 VanDerWaalsContact C-N 3.33Å; M39-Q41 PolarHBondContact O-N 3.42Å; Q41-S44 PolarHBondContact O-N 3.27Å; Q41-W45 WeakPolarHBondContact O-CB 3.4Å; Q41-W45 PolarHBondContact O-N 3.03Å |
| 42 | Y | 92.4 | Very high | 88.7 | Confident | 128 Ų | 128 | 99.5 Ų | 99.5 | 50% | 0.502 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -60.1 | -48.7 | 179 | 178.9 | -99.3 | 0 | 0 | 0 | 112.2 | S38 M39 S44 W45 W46 | S38-Y42 PolarHBondContact O-N 3.48Å; M39-Y42 PolarHBondContact O-N 3.19Å; Y42-S44 PolarHBondContact O-N 3.33Å; Y42-W45 PolarHBondContact O-N 2.94Å; Y42-W46 WeakPolarHBondContact O-CB 3.49Å; Y42-W46 PolarHBondContact O-N 3.46Å |
| 43 | F | 89.2 | Confident | 87.9 | Confident | 139 Ų | 139 | 98.9 Ų | 98.9 | 61% | 0.61 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -64.2 | -39.6 | 178.3 | -79.3 | -70.8 | 0 | 0 | 0 | 112.7 | M39 W45 W46 N47 | M39-F43 WeakPolarHBondContact O-CD2 3.37Å; M39-F43 PolarHBondContact O-N 3.17Å; F43-W45 VanDerWaalsContact C-N 3.35Å; F43-W46 PolarHBondContact O-N 3.44Å; F43-N47 WeakPolarHBondContact O-CB 3.41Å; F43-N47 PolarHBondContact O-N 2.95Å |
| 44 | S | 85.9 | Confident | 86.8 | Confident | 64 Ų | 64 | 99.6 Ų | 99.6 | 45% | 0.448 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -62.1 | -43.3 | 176 | -174.6 | 0 | 0 | 0 | 0 | 111.8 | F40 Q41 Y42 S48 | F40-S44 WeakPolarHBondContact O-CB 3.18Å; F40-S44 PolarHBondContact O-N 3.06Å; Q41-S44 PolarHBondContact O-N 3.27Å; Y42-S44 PolarHBondContact O-N 3.33Å; S44-S48 WeakPolarHBondContact O-CB 3.43Å; S44-S48 PolarHBondContact O-N 2.82Å; S44-S48 PolarHBondContact O-OG 3.01Å |
| 45 | W | 84.5 | Confident | 85.8 | Confident | 178 Ų | 178 | 102.7 Ų | 102.7 | 67% | 0.674 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -68.2 | -43.8 | 178.4 | -166.8 | 65.2 | 0 | 0 | 0 | 112.2 | Q41 Y42 F43 N47 S48 Y49 | Q41-W45 WeakPolarHBondContact O-CB 3.4Å; Q41-W45 PolarHBondContact O-N 3.03Å; Y42-W45 PolarHBondContact O-N 2.94Å; F43-W45 VanDerWaalsContact C-N 3.35Å; W45-N47 VanDerWaalsContact C-N 3.35Å; W45-N47 PolarHBondContact O-N 3.35Å; W45-S48 PolarHBondContact O-N 3.22Å; W45-Y49 WeakPolarHBondContact O-CB 3.39Å; W45-Y49 PolarHBondContact O-N 2.92Å |
| 46 | W | 84.4 | Confident | 84.4 | Confident | 135 Ų | 135 | 102.6 Ų | 102.6 | 51% | 0.511 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -57.2 | -46.9 | 175.6 | -174.5 | -99.2 | 0 | 0 | 0 | 112 | Y42 F43 S48 Y49 N50 | Y42-W46 WeakPolarHBondContact O-CB 3.49Å; Y42-W46 PolarHBondContact O-N 3.46Å; F43-W46 PolarHBondContact O-N 3.44Å; W46-S48 VanDerWaalsContact C-N 3.35Å; W46-S48 PolarHBondContact O-N 3.49Å; W46-Y49 PolarHBondContact O-N 2.91Å; W46-N50 VanDerWaalsContact CD1-ND2 3.25Å; W46-N50 PolarHBondContact NE1-ND2 2.86Å; W46-N50 PolarHBondContact O-N 2.95Å; W46-N50 PolarHBondContact O-ND2 3.42Å |
| 47 | N | 78.1 | Confident | 83.1 | Confident | 82 Ų | 82 | 103.1 Ų | 103.1 | 44% | 0.439 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -64.9 | -40 | 178 | -166.6 | 29.1 | 0 | 0 | 0 | 111.9 | F43 W45 K51 | F43-N47 WeakPolarHBondContact O-CB 3.41Å; F43-N47 PolarHBondContact O-N 2.95Å; W45-N47 VanDerWaalsContact C-N 3.35Å; W45-N47 PolarHBondContact O-N 3.35Å; N47-K51 PolarHBondContact ND2-NZ 3.04Å; N47-K51 WeakPolarHBondContact O-CB 3.23Å; N47-K51 VanDerWaalsContact O-CG 3.23Å; N47-K51 WeakPolarHBondContact O-CG 3.4Å; N47-K51 PolarHBondContact O-N 3.46Å; N47-K51 WeakPolarHBondContact OD1-CE 3.39Å |
| 48 | S | 82.4 | Confident | 81.9 | Confident | 65 Ų | 65 | 103.1 Ų | 103.1 | 46% | 0.455 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -65.6 | -41.6 | 177.1 | -60 | 0 | 0 | 0 | 0 | 111.9 | S44 W45 W46 K51 A52 | S44-S48 WeakPolarHBondContact O-CB 3.43Å; S44-S48 PolarHBondContact O-N 2.82Å; S44-S48 PolarHBondContact O-OG 3.01Å; W45-S48 PolarHBondContact O-N 3.22Å; W46-S48 VanDerWaalsContact C-N 3.35Å; W46-S48 PolarHBondContact O-N 3.49Å; S48-K51 PolarHBondContact O-N 2.91Å; S48-A52 WeakPolarHBondContact O-CB 3.31Å; S48-A52 PolarHBondContact O-N 3.43Å |
| 49 | Y | 78.7 | Confident | 80.6 | Confident | 126 Ų | 126 | 101.4 Ų | 101.4 | 49% | 0.494 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -62.3 | -49.5 | 176.2 | -173.1 | -98.6 | 0 | 0 | 0 | 111.4 | W45 W46 K51 A52 I53 | W45-Y49 WeakPolarHBondContact O-CB 3.39Å; W45-Y49 PolarHBondContact O-N 2.92Å; W46-Y49 PolarHBondContact O-N 2.91Å; Y49-K51 VanDerWaalsContact C-N 3.33Å; Y49-K51 PolarHBondContact O-N 2.99Å; Y49-A52 PolarHBondContact O-N 3.34Å; Y49-I53 HydrophobicContact CD1-CG1 4.03Å; Y49-I53 HydrophobicContact CE1-CD1 4.27Å; Y49-I53 HydrophobicContact CE1-CG1 3.68Å; Y49-I53 HydrophobicContact CE2-CD1 4.42Å; Y49-I53 HydrophobicContact CE2-CG1 4.37Å; Y49-I53 WeakPolarHBondContact O-CG1 3.31Å; Y49-I53 PolarHBondContact O-N 3.49Å |
| 50 | N | 79.7 | Confident | 79 | Confident | 69 Ų | 69 | 100.1 Ų | 100.1 | 37% | 0.369 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -61.7 | -40.3 | 178.7 | -71 | -27.4 | 0 | 0 | 0 | 112.5 | W46 S54 | W46-N50 VanDerWaalsContact CD1-ND2 3.25Å; W46-N50 PolarHBondContact NE1-ND2 2.86Å; W46-N50 PolarHBondContact O-N 2.95Å; W46-N50 PolarHBondContact O-ND2 3.42Å; N50-S54 VanDerWaalsContact O-CB 3.3Å; N50-S54 WeakPolarHBondContact O-CB 3.46Å; N50-S54 PolarHBondContact O-N 3.44Å |
| 51 | K | 79.6 | Confident | 77.7 | Confident | 131 Ų | 131 | 99.1 Ų | 99.1 | 57% | 0.57 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -62.6 | -44.8 | 174.4 | -75.9 | 173.5 | -179.8 | -179.2 | 0 | 111.9 | N47 S48 Y49 S54 Y55 | N47-K51 PolarHBondContact ND2-NZ 3.04Å; N47-K51 WeakPolarHBondContact O-CB 3.23Å; N47-K51 VanDerWaalsContact O-CG 3.23Å; N47-K51 WeakPolarHBondContact O-CG 3.4Å; N47-K51 PolarHBondContact O-N 3.46Å; N47-K51 WeakPolarHBondContact OD1-CE 3.39Å; S48-K51 PolarHBondContact O-N 2.91Å; Y49-K51 VanDerWaalsContact C-N 3.33Å; Y49-K51 PolarHBondContact O-N 2.99Å; K51-S54 PolarHBondContact O-N 3.29Å; K51-Y55 VanDerWaalsContact O-CB 3.31Å; K51-Y55 WeakPolarHBondContact O-CB 3.31Å; K51-Y55 PolarHBondContact O-N 3.42Å |
| 52 | A | 80.6 | Confident | 76.4 | Confident | 49 Ų | 49 | 98.4 Ų | 98.4 | 41% | 0.405 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -63.1 | -46.3 | 178.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | S48 Y49 Y55 L56 | S48-A52 WeakPolarHBondContact O-CB 3.31Å; S48-A52 PolarHBondContact O-N 3.43Å; Y49-A52 PolarHBondContact O-N 3.34Å; A52-Y55 PolarHBondContact O-N 3Å; A52-L56 WeakPolarHBondContact O-CB 3.3Å; A52-L56 VanDerWaalsContact O-CG 3.26Å; A52-L56 WeakPolarHBondContact O-CG 3.5Å; A52-L56 PolarHBondContact O-N 3.25Å |
| 53 | I | 77.3 | Confident | 74.9 | Confident | 79 Ų | 79 | 99.8 Ų | 99.8 | 41% | 0.405 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -62.4 | -46.1 | 177.1 | -66.3 | -62.7 | 0 | 0 | 0 | 111.2 | Y49 Y55 L56 A57 | Y49-I53 HydrophobicContact CD1-CG1 4.03Å; Y49-I53 HydrophobicContact CE1-CD1 4.27Å; Y49-I53 HydrophobicContact CE1-CG1 3.68Å; Y49-I53 HydrophobicContact CE2-CD1 4.42Å; Y49-I53 HydrophobicContact CE2-CG1 4.37Å; Y49-I53 WeakPolarHBondContact O-CG1 3.31Å; Y49-I53 PolarHBondContact O-N 3.49Å; I53-Y55 VanDerWaalsContact C-N 3.28Å; I53-Y55 PolarHBondContact O-N 3.41Å; I53-L56 PolarHBondContact O-N 2.94Å; I53-A57 VanDerWaalsContact O-CB 3.28Å; I53-A57 WeakPolarHBondContact O-CB 3.42Å; I53-A57 PolarHBondContact O-N 3.35Å |
| 54 | S | 71.9 | Confident | 73.7 | Confident | 73 Ų | 73 | 98.1 Ų | 98.1 | 51% | 0.51 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -62.2 | -36.5 | 177.7 | -173.3 | 0 | 0 | 0 | 0 | 112.1 | N50 K51 T58 | N50-S54 VanDerWaalsContact O-CB 3.3Å; N50-S54 WeakPolarHBondContact O-CB 3.46Å; N50-S54 PolarHBondContact O-N 3.44Å; K51-S54 PolarHBondContact O-N 3.29Å; S54-T58 WeakPolarHBondContact O-CG2 3.41Å; S54-T58 PolarHBondContact O-N 3.42Å; S54-T58 PolarHBondContact O-OG1 2.94Å |
| 55 | Y | 75.6 | Confident | 73 | Confident | 158 Ų | 158 | 99.4 Ų | 99.4 | 62% | 0.62 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -70.6 | -42.2 | 176.2 | -176.2 | -97.3 | 0 | 0 | 0 | 112.3 | K51 A52 I53 A57 T58 V59 | K51-Y55 VanDerWaalsContact O-CB 3.31Å; K51-Y55 WeakPolarHBondContact O-CB 3.31Å; K51-Y55 PolarHBondContact O-N 3.42Å; A52-Y55 PolarHBondContact O-N 3Å; I53-Y55 VanDerWaalsContact C-N 3.28Å; I53-Y55 PolarHBondContact O-N 3.41Å; Y55-A57 VanDerWaalsContact C-N 3.28Å; Y55-A57 PolarHBondContact O-N 2.93Å; Y55-T58 PolarHBondContact O-N 3.04Å; Y55-T58 PolarHBondContact O-OG1 3.36Å; Y55-V59 HydrophobicContact CE1-CG2 4.23Å; Y55-V59 WeakPolarHBondContact O-CG2 3.28Å; Y55-V59 PolarHBondContact O-N 2.94Å |
| 56 | L | 68.3 | Low | 72.3 | Confident | 69 Ų | 69 | 93.7 Ų | 93.7 | 36% | 0.361 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -65 | -34.9 | 175.1 | -68.9 | 171.8 | 0 | 0 | 0 | 111.5 | A52 I53 V59 Y62 | A52-L56 WeakPolarHBondContact O-CB 3.3Å; A52-L56 VanDerWaalsContact O-CG 3.26Å; A52-L56 WeakPolarHBondContact O-CG 3.5Å; A52-L56 PolarHBondContact O-N 3.25Å; I53-L56 PolarHBondContact O-N 2.94Å; L56-V59 PolarHBondContact O-N 3.36Å; L56-Y62 HydrophobicContact CD2-CD1 4.26Å; L56-Y62 HydrophobicContact CD2-CD2 3.56Å; L56-Y62 HydrophobicContact CD2-CE1 4.15Å; L56-Y62 HydrophobicContact CD2-CE2 3.45Å; L56-Y62 VanDerWaalsContact CD2-CE2 3.45Å; L56-Y62 HydrophobicContact CD2-CG 3.98Å |
| 57 | A | 67.4 | Low | 71.5 | Confident | 59 Ų | 59 | 90.9 Ų | 90.9 | 49% | 0.488 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -69.6 | -31.9 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | I53 Y55 R63 | I53-A57 VanDerWaalsContact O-CB 3.28Å; I53-A57 WeakPolarHBondContact O-CB 3.42Å; I53-A57 PolarHBondContact O-N 3.35Å; Y55-A57 VanDerWaalsContact C-N 3.28Å; Y55-A57 PolarHBondContact O-N 2.93Å; A57-R63 VanDerWaalsContact O-CD 3.29Å; A57-R63 WeakPolarHBondContact O-CD 3.46Å |
| 58 | T | 70.4 | Confident | 71.2 | Confident | 97 Ų | 97 | 92.5 Ų | 92.5 | 60% | 0.595 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -76.2 | -26.3 | 176.6 | 53.9 | 0 | 0 | 0 | 0 | 112.5 | S54 Y55 P60 | S54-T58 WeakPolarHBondContact O-CG2 3.41Å; S54-T58 PolarHBondContact O-N 3.42Å; S54-T58 PolarHBondContact O-OG1 2.94Å; Y55-T58 PolarHBondContact O-N 3.04Å; Y55-T58 PolarHBondContact O-OG1 3.36Å; T58-P60 VanDerWaalsContact O-CD 3.32Å; T58-P60 WeakPolarHBondContact O-CD 3.36Å |
| 59 | V | 68.7 | Low | 71 | Confident | 36 Ų | 36 | 93.2 Ų | 93.2 | 22% | 0.218 | 48% | 0.479 | C | S | . | . | trans | -78.7 | 116.2 | -179 | 172.7 | 0 | 0 | 0 | 0 | 110.4 | Y55 L56 K61 Y62 R63 | Y55-V59 HydrophobicContact CE1-CG2 4.23Å; Y55-V59 WeakPolarHBondContact O-CG2 3.28Å; Y55-V59 PolarHBondContact O-N 2.94Å; L56-V59 PolarHBondContact O-N 3.36Å; V59-K61 HydrophobicContact CG1-CB 3.92Å; V59-K61 PolarHBondContact O-N 3.1Å; V59-Y62 HydrophobicContact CB-CD2 3.75Å; V59-Y62 HydrophobicContact CB-CE2 4.25Å; V59-Y62 HydrophobicContact CG1-CD2 3.53Å; V59-Y62 HydrophobicContact CG1-CE2 3.82Å; V59-Y62 PolarHBondContact O-N 3.01Å; V59-R63 PolarHBondContact O-N 3.34Å | ||
| 60 | P | 61.8 | Low | 70.6 | Confident | 84 Ų | 84 | 88.5 Ų | 88.5 | 55% | 0.545 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -64.3 | -26.5 | -175.2 | 22.9 | -31.6 | 0 | 0 | 0 | 113.4 | T58 Y62 R63 I64 | T58-P60 VanDerWaalsContact O-CD 3.32Å; T58-P60 WeakPolarHBondContact O-CD 3.36Å; P60-Y62 VanDerWaalsContact C-N 3.34Å; P60-Y62 PolarHBondContact O-N 3.22Å; P60-R63 WeakPolarHBondContact O-CB 3.36Å; P60-R63 PolarHBondContact O-N 3.37Å; P60-I64 WeakPolarHBondContact O-CG1 3.48Å; P60-I64 PolarHBondContact O-N 2.89Å |
| 61 | K | 64.9 | Low | 70 | Confident | 137 Ų | 137 | 92.8 Ų | 92.8 | 60% | 0.596 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -58.1 | -42.5 | 176.5 | -174.6 | -179.5 | 178.6 | -178.7 | 0 | 112.6 | V59 Q65 | V59-K61 HydrophobicContact CG1-CB 3.92Å; V59-K61 PolarHBondContact O-N 3.1Å; K61-Q65 PolarHBondContact O-N 3.11Å |
| 62 | Y | 62 | Low | 69.8 | Low | 109 Ų | 109 | 94.6 Ų | 94.6 | 43% | 0.427 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -78.9 | -28 | 179.7 | -63.3 | -70.4 | 0 | 0 | 0 | 112.4 | L56 V59 P60 Q65 A66 | L56-Y62 HydrophobicContact CD2-CD1 4.26Å; L56-Y62 HydrophobicContact CD2-CD2 3.56Å; L56-Y62 HydrophobicContact CD2-CE1 4.15Å; L56-Y62 HydrophobicContact CD2-CE2 3.45Å; L56-Y62 VanDerWaalsContact CD2-CE2 3.45Å; L56-Y62 HydrophobicContact CD2-CG 3.98Å; V59-Y62 HydrophobicContact CB-CD2 3.75Å; V59-Y62 HydrophobicContact CB-CE2 4.25Å; V59-Y62 HydrophobicContact CG1-CD2 3.53Å; V59-Y62 HydrophobicContact CG1-CE2 3.82Å; V59-Y62 PolarHBondContact O-N 3.01Å; P60-Y62 VanDerWaalsContact C-N 3.34Å; P60-Y62 PolarHBondContact O-N 3.22Å; Y62-Q65 PolarHBondContact O-N 2.69Å; Y62-A66 WeakPolarHBondContact O-CB 3.39Å; Y62-A66 PolarHBondContact O-N 3.04Å |
| 63 | R | 62.5 | Low | 69.4 | Low | 157 Ų | 157 | 98.5 Ų | 98.5 | 59% | 0.592 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -63 | -47.1 | 171.6 | -67.1 | 175 | 58.2 | -174.2 | -0.2 | 111.3 | A57 V59 P60 Q65 A66 T67 | A57-R63 VanDerWaalsContact O-CD 3.29Å; A57-R63 WeakPolarHBondContact O-CD 3.46Å; V59-R63 PolarHBondContact O-N 3.34Å; P60-R63 WeakPolarHBondContact O-CB 3.36Å; P60-R63 PolarHBondContact O-N 3.37Å; R63-Q65 VanDerWaalsContact C-N 3.34Å; R63-Q65 PolarHBondContact O-N 3.25Å; R63-A66 PolarHBondContact O-N 3.34Å; R63-T67 PolarHBondContact O-N 3.46Å; R63-T67 PolarHBondContact O-OG1 3.2Å |
| 64 | I | 63.3 | Low | 69.1 | Low | 104 Ų | 104 | 97.6 Ų | 97.6 | 53% | 0.533 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -59.8 | -45.3 | 178.4 | -65.5 | 166 | 0 | 0 | 0 | 110.4 | P60 A66 T67 E68 | P60-I64 WeakPolarHBondContact O-CG1 3.48Å; P60-I64 PolarHBondContact O-N 2.89Å; I64-A66 PolarHBondContact O-N 3.38Å; I64-T67 WeakPolarHBondContact O-CB 3.31Å; I64-T67 PolarHBondContact O-N 3.16Å; I64-T67 VanDerWaalsContact O-N 3.11Å; I64-E68 PolarHBondContact O-N 3Å |
| 65 | Q | 70.3 | Confident | 69 | Low | 91 Ų | 91 | 100.5 Ų | 100.5 | 43% | 0.425 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -61.4 | -43.1 | 174.8 | -73.7 | -175.7 | 2.5 | 0 | 0 | 113 | K61 Y62 R63 T67 E68 I69 | K61-Q65 PolarHBondContact O-N 3.11Å; Y62-Q65 PolarHBondContact O-N 2.69Å; R63-Q65 VanDerWaalsContact C-N 3.34Å; R63-Q65 PolarHBondContact O-N 3.25Å; Q65-T67 PolarHBondContact O-N 3Å; Q65-E68 PolarHBondContact O-N 3.27Å; Q65-I69 WeakPolarHBondContact O-CB 3.31Å; Q65-I69 VanDerWaalsContact O-CG1 3.25Å; Q65-I69 WeakPolarHBondContact O-CG1 3.42Å; Q65-I69 PolarHBondContact O-N 3.47Å |
| 66 | A | 70.1 | Confident | 68.3 | Low | 58 Ų | 58 | 97.4 Ų | 97.4 | 48% | 0.479 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -62.2 | -34.5 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | Y62 R63 I64 A70 | Y62-A66 WeakPolarHBondContact O-CB 3.39Å; Y62-A66 PolarHBondContact O-N 3.04Å; R63-A66 PolarHBondContact O-N 3.34Å; I64-A66 PolarHBondContact O-N 3.38Å; A66-A70 VanDerWaalsContact O-CB 3.24Å; A66-A70 WeakPolarHBondContact O-CB 3.47Å; A66-A70 PolarHBondContact O-N 2.95Å |
| 67 | T | 68.1 | Low | 67.8 | Low | 76 Ų | 76 | 103.8 Ų | 103.8 | 47% | 0.466 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -72 | -38.6 | 177 | -27.7 | 0 | 0 | 0 | 0 | 111.4 | R63 I64 Q65 K71 L76 | R63-T67 PolarHBondContact O-N 3.46Å; R63-T67 PolarHBondContact O-OG1 3.2Å; I64-T67 WeakPolarHBondContact O-CB 3.31Å; I64-T67 PolarHBondContact O-N 3.16Å; I64-T67 VanDerWaalsContact O-N 3.11Å; Q65-T67 PolarHBondContact O-N 3Å; T67-K71 VanDerWaalsContact O-CB 3.31Å; T67-K71 WeakPolarHBondContact O-CB 3.3Å; T67-K71 PolarHBondContact O-N 3.21Å; T67-L76 HydrophobicContact CG2-CD1 3.89Å |
| 68 | E | 72.8 | Confident | 66.9 | Low | 115 Ų | 115 | 110.6 Ų | 110.6 | 54% | 0.537 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -63.8 | -47.7 | 172.5 | -89.1 | 174.4 | 158.8 | 0 | 0 | 111.9 | I64 Q65 A70 K71 E72 | I64-E68 PolarHBondContact O-N 3Å; Q65-E68 PolarHBondContact O-N 3.27Å; E68-A70 VanDerWaalsContact C-N 3.34Å; E68-A70 PolarHBondContact O-N 3.48Å; E68-K71 CarbonylContact O-C 3.6Å; E68-K71 WeakPolarHBondContact O-CA 3.35Å; E68-K71 WeakPolarHBondContact O-CB 3.04Å; E68-K71 PolarHBondContact O-N 3.43Å; E68-K71 VanDerWaalsContact O-N 3.1Å; E68-E72 PolarHBondContact O-N 3.08Å |
| 69 | I | 76.4 | Confident | 65.9 | Low | 81 Ų | 81 | 113.9 Ų | 113.9 | 42% | 0.415 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -61.5 | -42.8 | 176.2 | -65.9 | 164.3 | 0 | 0 | 0 | 110.6 | Q65 K71 E72 Q73 | Q65-I69 WeakPolarHBondContact O-CB 3.31Å; Q65-I69 VanDerWaalsContact O-CG1 3.25Å; Q65-I69 WeakPolarHBondContact O-CG1 3.42Å; Q65-I69 PolarHBondContact O-N 3.47Å; I69-K71 VanDerWaalsContact C-N 3.26Å; I69-K71 PolarHBondContact O-N 3.09Å; I69-E72 PolarHBondContact O-N 3.39Å; I69-Q73 HydrophobicContact CG2-CG 4.29Å; I69-Q73 WeakPolarHBondContact O-CB 3.4Å; I69-Q73 VanDerWaalsContact O-CG 3.27Å; I69-Q73 WeakPolarHBondContact O-CG 3.38Å; I69-Q73 PolarHBondContact O-N 3.47Å |
| 70 | A | 70.3 | Confident | 65.8 | Low | 26 Ų | 26 | 117.8 Ų | 117.8 | 22% | 0.215 | 61% | 0.613 | C | S | . | * | H | α-helix | trans | -66 | -29.1 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113 | A66 E68 G74 L75 L76 | A66-A70 VanDerWaalsContact O-CB 3.24Å; A66-A70 WeakPolarHBondContact O-CB 3.47Å; A66-A70 PolarHBondContact O-N 2.95Å; E68-A70 VanDerWaalsContact C-N 3.34Å; E68-A70 PolarHBondContact O-N 3.48Å; A70-G74 PolarHBondContact O-N 3.05Å; A70-L75 PolarHBondContact O-N 3.47Å; A70-L75 VanDerWaalsContact O-N 3.09Å; A70-L76 HydrophobicContact CB-CD1 3.95Å; A70-L76 HydrophobicContact CB-CG 4.05Å; A70-L76 PolarHBondContact O-N 3.27Å |
| 71 | K | 68.8 | Low | 66 | Low | 160 Ų | 160 | 119.5 Ų | 119.5 | 70% | 0.696 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -73.9 | -41.1 | 173.6 | -171.7 | -178.6 | 177.4 | -172.5 | 0 | 111.4 | T67 E68 I69 G74 L76 | T67-K71 VanDerWaalsContact O-CB 3.31Å; T67-K71 WeakPolarHBondContact O-CB 3.3Å; T67-K71 PolarHBondContact O-N 3.21Å; E68-K71 CarbonylContact O-C 3.6Å; E68-K71 WeakPolarHBondContact O-CA 3.35Å; E68-K71 WeakPolarHBondContact O-CB 3.04Å; E68-K71 PolarHBondContact O-N 3.43Å; E68-K71 VanDerWaalsContact O-N 3.1Å; I69-K71 VanDerWaalsContact C-N 3.26Å; I69-K71 PolarHBondContact O-N 3.09Å; K71-G74 PolarHBondContact O-N 3.23Å; K71-L76 HydrophobicContact CB-CD1 4.2Å |
| 72 | E | 74.4 | Confident | 66.1 | Low | 168 Ų | 168 | 118.6 Ų | 118.6 | 79% | 0.785 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -66.1 | -38.8 | 174.3 | -74.6 | -175.8 | 165.4 | 0 | 0 | 112.4 | E68 I69 G74 | E68-E72 PolarHBondContact O-N 3.08Å; I69-E72 PolarHBondContact O-N 3.39Å; E72-G74 PolarHBondContact O-N 3.4Å |
| 73 | Q | 73.3 | Confident | 66.3 | Low | 132 Ų | 132 | 119.1 Ų | 119.1 | 62% | 0.617 | 63% | 0.629 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.5 | -0.1 | 177.1 | -68.9 | 179.8 | -0.1 | 0 | 0 | 113.5 | I69 L75 | I69-Q73 HydrophobicContact CG2-CG 4.29Å; I69-Q73 WeakPolarHBondContact O-CB 3.4Å; I69-Q73 VanDerWaalsContact O-CG 3.27Å; I69-Q73 WeakPolarHBondContact O-CG 3.38Å; I69-Q73 PolarHBondContact O-N 3.47Å; Q73-L75 HydrophobicContact CB-CD1 4.12Å; Q73-L75 HydrophobicContact CB-CG 4.25Å; Q73-L75 PolarHBondContact O-N 3.42Å; Q73-L75 VanDerWaalsContact O-N 3.16Å |
| 74 | G | 70.4 | Confident | 66.6 | Low | 60 Ų | 60 | 116.8 Ų | 116.8 | 62% | 0.619 | 63% | 0.631 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 67.9 | 11.2 | 177.8 | 0 | 0 | 0 | 0 | 0 | 114.8 | A70 K71 E72 L76 | A70-G74 PolarHBondContact O-N 3.05Å; K71-G74 PolarHBondContact O-N 3.23Å; E72-G74 PolarHBondContact O-N 3.4Å; G74-L76 VanDerWaalsContact C-N 3.31Å |
| 75 | L | 69.4 | Low | 66.8 | Low | 134 Ų | 134 | 117.6 Ų | 117.6 | 70% | 0.702 | 64% | 0.638 | S | S | * | * | trans | -76.5 | -20 | -180 | -69.5 | 168.5 | 0 | 0 | 0 | 112.4 | A70 Q73 K77 | A70-L75 PolarHBondContact O-N 3.47Å; A70-L75 VanDerWaalsContact O-N 3.09Å; Q73-L75 HydrophobicContact CB-CD1 4.12Å; Q73-L75 HydrophobicContact CB-CG 4.25Å; Q73-L75 PolarHBondContact O-N 3.42Å; Q73-L75 VanDerWaalsContact O-N 3.16Å; L75-K77 PolarHBondContact O-N 3.1Å | ||
| 76 | L | 61.5 | Low | 66.5 | Low | 93 Ų | 93 | 119.5 Ų | 119.5 | 49% | 0.487 | 65% | 0.653 | S | S | . | * | S | Bend | trans | -85.9 | 94 | 172.1 | -74.7 | 170.3 | 0 | 0 | 0 | 110.1 | T67 A70 K71 G74 K78 | T67-L76 HydrophobicContact CG2-CD1 3.89Å; A70-L76 HydrophobicContact CB-CD1 3.95Å; A70-L76 HydrophobicContact CB-CG 4.05Å; A70-L76 PolarHBondContact O-N 3.27Å; K71-L76 HydrophobicContact CB-CD1 4.2Å; G74-L76 VanDerWaalsContact C-N 3.31Å; L76-K78 PolarHBondContact O-N 3.32Å; L76-K78 VanDerWaalsContact O-N 3.17Å |
| 77 | K | 57.2 | Low | 66.2 | Low | 203 Ų | 203 | 124.2 Ų | 124.2 | 88% | 0.883 | 67% | 0.666 | S | S | * | * | trans | -62.7 | 116.1 | 166.2 | -157.2 | -179.4 | -172.3 | -176 | 0 | 108.2 | L75 A79 | L75-K77 PolarHBondContact O-N 3.1Å; K77-A79 PolarHBondContact O-N 3.14Å | ||
| 78 | K | 49.5 | Very low | 66.1 | Low | 202 Ų | 202 | 128.3 Ų | 128.3 | 88% | 0.878 | 68% | 0.683 | S | S | * | * | trans | -58.8 | 115.5 | 173.2 | -165.2 | 177.7 | -176.8 | -175.9 | 0 | 108.2 | L76 | L76-K78 PolarHBondContact O-N 3.32Å; L76-K78 VanDerWaalsContact O-N 3.17Å | ||
| 79 | A | 49.3 | Very low | 65.5 | Low | 165 Ų | 165 | 129.5 Ų | 129.5 | 100% | 1.364 | 70% | 0.696 | S | S | * | * | trans | -76.6 | 0 | 160.1 | 0 | 0 | 0 | 0 | 0 | 108.8 | K77 | K77-A79 PolarHBondContact O-N 3.14Š|
Retrieved 79 of 79 residues in 170.7 ms
(Link to these results)