| 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 | 38.9 | Very low | 41.7 | Very low | 245 Ų | 245 | 143.7 Ų | 143.7 | 100% | 1.207 | 85% | 0.85 | S | S | * | * | 0 | 109 | 0 | -72.1 | 175.8 | 166.6 | 0 | 0 | 107 | |||||
| 2 | L | 35 | Very low | 42.4 | Very low | 169 Ų | 169 | 145.1 Ų | 145.1 | 89% | 0.885 | 85% | 0.85 | S | S | * | * | P | Polyproline II helix | trans | -79.7 | 146.9 | 176.5 | -80.8 | 110.7 | 0 | 0 | 0 | 109.9 | ||
| 3 | P | 44.4 | Very low | 43.1 | Very low | 123 Ų | 123 | 140.7 Ų | 140.7 | 80% | 0.799 | 83% | 0.829 | S | S | * | * | P | Polyproline II helix | trans | -74.9 | 129.2 | 171.4 | 17.6 | -7 | 0 | 0 | 0 | 110 | ||
| 4 | T | 42.3 | Very low | 44.3 | Very low | 136 Ų | 136 | 134.7 Ų | 134.7 | 83% | 0.834 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -70.9 | 130.7 | 173.4 | 36.6 | 0 | 0 | 0 | 0 | 110.4 | S6 | T4-S6 PolarHBondContact O-N 3.41Š|
| 5 | T | 42.3 | Very low | 45.1 | Very low | 141 Ų | 141 | 132.7 Ų | 132.7 | 87% | 0.865 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -64.9 | 122.1 | 171.6 | 39.1 | 0 | 0 | 0 | 0 | 109.7 | ||
| 6 | S | 36.7 | Very low | 45.6 | Very low | 108 Ų | 108 | 137.4 Ų | 137.4 | 76% | 0.755 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -72.9 | 144.9 | 168.7 | 20 | 0 | 0 | 0 | 0 | 109.8 | T4 | T4-S6 PolarHBondContact O-N 3.41Š|
| 7 | P | 43.4 | Very low | 46.1 | Very low | 124 Ų | 124 | 133.4 Ų | 133.4 | 81% | 0.805 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -69.1 | 136.2 | 179.9 | -7.7 | 23 | 0 | 0 | 0 | 110.5 | S9 | P7-S9 PolarHBondContact O-N 2.84Š|
| 8 | Q | 44.7 | Very low | 46.6 | Very low | 194 Ų | 194 | 128.5 Ų | 128.5 | 91% | 0.907 | 75% | 0.747 | S | S | * | * | trans | -53.1 | 109.6 | 170.6 | -82.8 | 168.2 | -42.3 | 0 | 0 | 110.5 | ||||
| 9 | S | 37.3 | Very low | 46.8 | Very low | 110 Ų | 110 | 124.7 Ų | 124.7 | 77% | 0.769 | 73% | 0.732 | S | S | * | * | trans | -78.5 | 117.3 | 161.3 | 63.9 | 0 | 0 | 0 | 0 | 108.6 | P7 G11 | P7-S9 PolarHBondContact O-N 2.84Å; S9-G11 PolarHBondContact O-N 3.11Å | ||
| 10 | N | 47.7 | Very low | 47.1 | Very low | 173 Ų | 173 | 128 Ų | 128 | 93% | 0.925 | 73% | 0.731 | S | S | * | * | trans | -68.3 | 74.6 | 164.6 | -87.3 | -11.3 | 0 | 0 | 0 | 109.2 | ||||
| 11 | G | 45.6 | Very low | 47.6 | Very low | 58 Ų | 58 | 128.2 Ų | 128.2 | 60% | 0.598 | 73% | 0.726 | S | S | * | * | trans | -95.8 | 114.9 | 166.3 | 0 | 0 | 0 | 0 | 0 | 108.6 | S9 | S9-G11 PolarHBondContact O-N 3.11Š| ||
| 12 | D | 50.3 | Low | 49 | Very low | 160 Ų | 160 | 120.3 Ų | 120.3 | 86% | 0.856 | 69% | 0.691 | S | S | * | * | P | Polyproline II helix | trans | -49.7 | 133.3 | 160.3 | -87.1 | -38 | 0 | 0 | 0 | 108.1 | S14 | D12-S14 PolarHBondContact O-N 3.36Š|
| 13 | P | 52.2 | Low | 50.3 | Low | 88 Ų | 88 | 116 Ų | 116 | 57% | 0.571 | 68% | 0.68 | S | S | * | * | P | Polyproline II helix | trans | -57.1 | 135.3 | -179.9 | 21.7 | -30.1 | 0 | 0 | 0 | 108.9 | S15 D17 | P13-S15 PolarHBondContact O-N 3.44Å; P13-D17 HydrophobicContact CB-CB 4.41Å |
| 14 | S | 58.9 | Low | 51.3 | Low | 57 Ų | 57 | 112.4 Ų | 112.4 | 40% | 0.399 | 67% | 0.665 | S | S | . | * | P | Polyproline II helix | trans | -52.3 | 143.7 | 176.8 | 83.7 | 0 | 0 | 0 | 0 | 109.2 | D12 R16 D17 A18 | D12-S14 PolarHBondContact O-N 3.36Å; S14-R16 PolarHBondContact O-N 2.91Å; S14-D17 WeakPolarHBondContact O-CA 3.31Å; S14-D17 PolarHBondContact O-N 3.11Å; S14-D17 VanDerWaalsContact OG-CG 3.27Å; S14-D17 PolarHBondContact OG-N 3.37Å; S14-D17 PolarHBondContact OG-OD2 3.47Å; S14-A18 PolarHBondContact O-N 3.43Å |
| 15 | S | 56.5 | Low | 52.4 | Low | 105 Ų | 105 | 107.8 Ų | 107.8 | 73% | 0.734 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -53.7 | -24.8 | -179.4 | 49.7 | 0 | 0 | 0 | 0 | 113.3 | P13 A19 | P13-S15 PolarHBondContact O-N 3.44Å; S15-A19 VanDerWaalsContact O-CB 3.32Å; S15-A19 WeakPolarHBondContact O-CB 3.29Å; S15-A19 PolarHBondContact O-N 3.46Å; S15-A19 VanDerWaalsContact O-N 3.09Å |
| 16 | R | 54 | Low | 53.7 | Low | 207 Ų | 207 | 104.9 Ų | 104.9 | 78% | 0.781 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -73.7 | -37.4 | 172.1 | -74.2 | 177.6 | 132.4 | 150.3 | -2.4 | 113.6 | S14 R20 | S14-R16 PolarHBondContact O-N 2.91Å; R16-R20 PolarHBondContact O-N 3.47Å; R16-R20 VanDerWaalsContact O-N 3.14Å |
| 17 | D | 53 | Low | 55.3 | Low | 69 Ų | 69 | 108.3 Ų | 108.3 | 37% | 0.369 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -72.3 | -42.2 | 174.7 | -63.9 | -45.4 | 0 | 0 | 0 | 110.6 | P13 S14 A19 R20 H21 | P13-D17 HydrophobicContact CB-CB 4.41Å; S14-D17 WeakPolarHBondContact O-CA 3.31Å; S14-D17 PolarHBondContact O-N 3.11Å; S14-D17 VanDerWaalsContact OG-CG 3.27Å; S14-D17 PolarHBondContact OG-N 3.37Å; S14-D17 PolarHBondContact OG-OD2 3.47Å; D17-A19 VanDerWaalsContact C-N 3.32Å; D17-A19 PolarHBondContact O-N 3.03Å; D17-R20 WeakPolarHBondContact O-CB 3.39Å; D17-R20 PolarHBondContact O-N 2.91Å; D17-R20 VanDerWaalsContact O-N 3.1Å; D17-H21 PolarHBondContact O-CD2 3.4Å; D17-H21 PolarHBondContact O-N 3.37Å; D17-H21 VanDerWaalsContact O-N 3.11Å |
| 18 | A | 55.2 | Low | 56.6 | Low | 46 Ų | 46 | 110 Ų | 110 | 38% | 0.38 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -58.9 | -41.1 | 172.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | S14 R20 H21 T22 | S14-A18 PolarHBondContact O-N 3.43Å; A18-R20 PolarHBondContact O-N 3.45Å; A18-H21 PolarHBondContact O-N 2.89Å; A18-T22 PolarHBondContact O-N 3.34Å; A18-T22 PolarHBondContact O-OG1 3.41Å |
| 19 | A | 51.6 | Low | 57.7 | Low | 57 Ų | 57 | 105.2 Ų | 105.2 | 47% | 0.471 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -65.5 | -35.1 | 174.9 | 0 | 0 | 0 | 0 | 0 | 113 | S15 D17 H21 T22 A25 | S15-A19 VanDerWaalsContact O-CB 3.32Å; S15-A19 WeakPolarHBondContact O-CB 3.29Å; S15-A19 PolarHBondContact O-N 3.46Å; S15-A19 VanDerWaalsContact O-N 3.09Å; D17-A19 VanDerWaalsContact C-N 3.32Å; D17-A19 PolarHBondContact O-N 3.03Å; A19-H21 VanDerWaalsContact C-N 3.29Å; A19-H21 PolarHBondContact O-N 2.91Å; A19-T22 WeakPolarHBondContact O-CB 3.34Å; A19-T22 PolarHBondContact O-N 3.21Å; A19-T22 PolarHBondContact O-OG1 3.29Å; A19-A25 WeakPolarHBondContact O-CB 3.24Å |
| 20 | R | 52.3 | Low | 59.3 | Low | 190 Ų | 190 | 102.4 Ų | 102.4 | 72% | 0.717 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -66.3 | -28.9 | 173.2 | -87.9 | 177.1 | 149.4 | 176.7 | -4.9 | 113.1 | R16 D17 A18 T22 | R16-R20 PolarHBondContact O-N 3.47Å; R16-R20 VanDerWaalsContact O-N 3.14Å; D17-R20 WeakPolarHBondContact O-CB 3.39Å; D17-R20 PolarHBondContact O-N 2.91Å; D17-R20 VanDerWaalsContact O-N 3.1Å; A18-R20 PolarHBondContact O-N 3.45Å; R20-T22 VanDerWaalsContact C-N 3.35Å |
| 21 | H | 56.8 | Low | 60.5 | Low | 133 Ų | 133 | 98.1 Ų | 98.1 | 62% | 0.616 | 53% | 0.53 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86 | -2.3 | 177.3 | -70.6 | -70 | 0 | 0 | 0 | 114.1 | D17 A18 A19 | D17-H21 PolarHBondContact O-CD2 3.4Å; D17-H21 PolarHBondContact O-N 3.37Å; D17-H21 VanDerWaalsContact O-N 3.11Å; A18-H21 PolarHBondContact O-N 2.89Å; A19-H21 VanDerWaalsContact C-N 3.29Å; A19-H21 PolarHBondContact O-N 2.91Å |
| 22 | T | 68.6 | Low | 61.8 | Low | 79 Ų | 79 | 102.6 Ų | 102.6 | 49% | 0.485 | 53% | 0.529 | S | S | . | . | S | Bend | trans | -67.6 | 141.6 | 178.5 | -55 | 0 | 0 | 0 | 0 | 111.3 | A18 A19 R20 G24 A25 K26 | A18-T22 PolarHBondContact O-N 3.34Å; A18-T22 PolarHBondContact O-OG1 3.41Å; A19-T22 WeakPolarHBondContact O-CB 3.34Å; A19-T22 PolarHBondContact O-N 3.21Å; A19-T22 PolarHBondContact O-OG1 3.29Å; R20-T22 VanDerWaalsContact C-N 3.35Å; T22-G24 PolarHBondContact O-N 3.15Å; T22-G24 VanDerWaalsContact O-N 3.14Å; T22-A25 WeakPolarHBondContact O-CB 3.34Å; T22-A25 PolarHBondContact O-N 3.37Å; T22-K26 PolarHBondContact O-N 3.48Å; T22-K26 VanDerWaalsContact O-N 3.11Å |
| 23 | A | 62.2 | Low | 62.8 | Low | 78 Ų | 78 | 99.5 Ų | 99.5 | 65% | 0.645 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -53.7 | -35.6 | -179.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | K26 R27 | A23-K26 PolarHBondContact O-N 3.37Å; A23-R27 WeakPolarHBondContact O-CB 3.24Å; A23-R27 PolarHBondContact O-N 3.41Å |
| 24 | G | 65.6 | Low | 63.7 | Low | 47 Ų | 47 | 97.8 Ų | 97.8 | 49% | 0.485 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -64.9 | -41.4 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | T22 R27 Y28 | T22-G24 PolarHBondContact O-N 3.15Å; T22-G24 VanDerWaalsContact O-N 3.14Å; G24-R27 PolarHBondContact O-N 3.35Å; G24-Y28 WeakPolarHBondContact O-CB 3.36Å; G24-Y28 PolarHBondContact O-N 3.09Å |
| 25 | A | 65.2 | Low | 64.2 | Low | 40 Ų | 40 | 101.5 Ų | 101.5 | 33% | 0.331 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -66.9 | -39 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | A19 T22 K29 | A19-A25 WeakPolarHBondContact O-CB 3.24Å; T22-A25 WeakPolarHBondContact O-CB 3.34Å; T22-A25 PolarHBondContact O-N 3.37Å; A25-K29 VanDerWaalsContact O-CB 3.29Å; A25-K29 WeakPolarHBondContact O-CB 3.43Å; A25-K29 PolarHBondContact O-N 3.25Å |
| 26 | K | 69.7 | Low | 65.1 | Low | 79 Ų | 79 | 101 Ų | 101 | 34% | 0.343 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -62.3 | -47.4 | 173.2 | -67.1 | -173.2 | 178.3 | -171.7 | 0 | 111.6 | T22 A23 K29 Y30 | T22-K26 PolarHBondContact O-N 3.48Å; T22-K26 VanDerWaalsContact O-N 3.11Å; A23-K26 PolarHBondContact O-N 3.37Å; K26-K29 PolarHBondContact O-N 3.29Å; K26-Y30 WeakPolarHBondContact O-CB 3.46Å; K26-Y30 PolarHBondContact O-N 3.08Å |
| 27 | R | 69.8 | Low | 65.7 | Low | 181 Ų | 181 | 97 Ų | 97 | 68% | 0.683 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -60.5 | -47.8 | 176.5 | -176.5 | -177.3 | 176.4 | -134.6 | 0.2 | 112.1 | A23 G24 K29 Y30 L31 | A23-R27 WeakPolarHBondContact O-CB 3.24Å; A23-R27 PolarHBondContact O-N 3.41Å; G24-R27 PolarHBondContact O-N 3.35Å; R27-K29 VanDerWaalsContact C-N 3.34Å; R27-K29 PolarHBondContact O-N 3.43Å; R27-Y30 PolarHBondContact O-N 2.86Å; R27-L31 HydrophobicContact CG-CD1 4.06Å; R27-L31 HydrophobicContact CG-CG 4.45Å; R27-L31 WeakPolarHBondContact O-CG 3.48Å; R27-L31 PolarHBondContact O-N 3.46Å |
| 28 | Y | 71.7 | Confident | 66.2 | Low | 159 Ų | 159 | 105.2 Ų | 105.2 | 62% | 0.624 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -60.6 | -43.2 | 178.1 | 175.7 | -106.8 | 0 | 0 | 0 | 111.8 | G24 Y30 L31 R32 | G24-Y28 WeakPolarHBondContact O-CB 3.36Å; G24-Y28 PolarHBondContact O-N 3.09Å; Y28-Y30 PolarHBondContact O-N 2.9Å; Y28-L31 PolarHBondContact O-N 3.46Å; Y28-R32 VanDerWaalsContact O-CB 3.28Å; Y28-R32 WeakPolarHBondContact O-CB 3.48Å; Y28-R32 PolarHBondContact O-N 2.87Å |
| 29 | K | 68.3 | Low | 66.9 | Low | 94 Ų | 94 | 110.4 Ų | 110.4 | 41% | 0.409 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -61.2 | -42.7 | 175.5 | -175.7 | -177 | 176.7 | -166.5 | 0 | 111.9 | A25 K26 R27 R33 D76 | A25-K29 VanDerWaalsContact O-CB 3.29Å; A25-K29 WeakPolarHBondContact O-CB 3.43Å; A25-K29 PolarHBondContact O-N 3.25Å; K26-K29 PolarHBondContact O-N 3.29Å; R27-K29 VanDerWaalsContact C-N 3.34Å; R27-K29 PolarHBondContact O-N 3.43Å; K29-R33 VanDerWaalsContact CE-CZ 3.42Å; K29-R33 WeakPolarHBondContact O-CB 3.33Å; K29-R33 VanDerWaalsContact O-CG 3.31Å; K29-R33 WeakPolarHBondContact O-CG 3.36Å; K29-R33 PolarHBondContact O-N 3.16Å; K29-R33 VanDerWaalsContact O-N 3.07Å; K29-D76 IonicContact NZ-OD2 3.93Å |
| 30 | Y | 70.5 | Confident | 68.4 | Low | 51 Ų | 51 | 108.4 Ų | 108.4 | 20% | 0.2 | 50% | 0.503 | C | S | . | . | H | α-helix | trans | -63.7 | -49.7 | 177.2 | -171.1 | -89.7 | 0 | 0 | 0 | 111.8 | K26 R27 Y28 R32 R33 L34 P78 | K26-Y30 WeakPolarHBondContact O-CB 3.46Å; K26-Y30 PolarHBondContact O-N 3.08Å; R27-Y30 PolarHBondContact O-N 2.86Å; Y28-Y30 PolarHBondContact O-N 2.9Å; Y30-R32 PolarHBondContact O-N 2.75Å; Y30-R33 PolarHBondContact O-N 2.69Å; Y30-R33 VanDerWaalsContact O-N 3.17Å; Y30-L34 HydrophobicContact CE1-CD1 4.42Å; Y30-L34 PolarHBondContact O-N 2.97Å; Y30-P78 HydrophobicContact CE1-CB 4.42Å; Y30-P78 HydrophobicContact CE2-CB 4.39Å |
| 31 | L | 73.5 | Confident | 70 | Confident | 82 Ų | 82 | 104.3 Ų | 104.3 | 43% | 0.429 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -61.8 | -41.1 | 177.6 | -69.1 | 173.9 | 0 | 0 | 0 | 112.3 | R27 Y28 R33 L34 | R27-L31 HydrophobicContact CG-CD1 4.06Å; R27-L31 HydrophobicContact CG-CG 4.45Å; R27-L31 WeakPolarHBondContact O-CG 3.48Å; R27-L31 PolarHBondContact O-N 3.46Å; Y28-L31 PolarHBondContact O-N 3.46Å; L31-R33 VanDerWaalsContact C-N 3.3Å; L31-R33 PolarHBondContact O-N 3.49Å; L31-L34 WeakPolarHBondContact O-CB 3.33Å; L31-L34 PolarHBondContact O-N 2.97Å |
| 32 | R | 72.6 | Confident | 71.5 | Confident | 153 Ų | 153 | 101.1 Ų | 101.1 | 58% | 0.577 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -62.1 | -38.5 | 175.8 | -177.1 | 179.4 | 176 | -161.8 | -0.6 | 112.1 | Y28 Y30 L35 H36 | Y28-R32 VanDerWaalsContact O-CB 3.28Å; Y28-R32 WeakPolarHBondContact O-CB 3.48Å; Y28-R32 PolarHBondContact O-N 2.87Å; Y30-R32 PolarHBondContact O-N 2.75Å; R32-L35 PolarHBondContact O-N 3.44Å; R32-H36 PolarHBondContact O-ND1 2.98Å; R32-H36 VanDerWaalsContact O-ND1 3.12Å |
| 33 | R | 70.9 | Confident | 72.5 | Confident | 95 Ų | 95 | 104.3 Ų | 104.3 | 36% | 0.358 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -70.6 | -31.1 | 177 | -77.1 | 176.1 | 173.2 | -175.3 | -6.8 | 112.5 | K29 Y30 L31 L35 H36 M40 D76 P78 | K29-R33 VanDerWaalsContact CE-CZ 3.42Å; K29-R33 WeakPolarHBondContact O-CB 3.33Å; K29-R33 VanDerWaalsContact O-CG 3.31Å; K29-R33 WeakPolarHBondContact O-CG 3.36Å; K29-R33 PolarHBondContact O-N 3.16Å; K29-R33 VanDerWaalsContact O-N 3.07Å; Y30-R33 PolarHBondContact O-N 2.69Å; Y30-R33 VanDerWaalsContact O-N 3.17Å; L31-R33 VanDerWaalsContact C-N 3.3Å; L31-R33 PolarHBondContact O-N 3.49Å; R33-L35 PolarHBondContact O-N 3.08Å; R33-H36 PolarHBondContact O-N 3.19Å; R33-M40 WeakPolarHBondContact O-CE 3.1Å; R33-D76 PolarHBondContact NH1-O 2.85Å; R33-D76 IonicContact NH1-OD2 2.68Å; R33-P78 HydrophobicContact CB-CG 4.15Å |
| 34 | L | 71.6 | Confident | 73.7 | Confident | 52 Ų | 52 | 104 Ų | 104 | 27% | 0.272 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -59.3 | -28.8 | 175.7 | -163.2 | 138.4 | 0 | 0 | 0 | 112.2 | Y30 L31 M40 P78 L81 | Y30-L34 HydrophobicContact CE1-CD1 4.42Å; Y30-L34 PolarHBondContact O-N 2.97Å; L31-L34 WeakPolarHBondContact O-CB 3.33Å; L31-L34 PolarHBondContact O-N 2.97Å; L34-M40 WeakPolarHBondContact O-CE 3.42Å; L34-P78 HydrophobicContact CB-CB 4.26Å; L34-P78 HydrophobicContact CD1-CB 4.29Å; L34-P78 HydrophobicContact CG-CB 4.37Å; L34-L81 HydrophobicContact CD1-CD2 4.15Å |
| 35 | L | 69 | Low | 74.9 | Confident | 134 Ų | 134 | 101.7 Ų | 101.7 | 70% | 0.702 | 45% | 0.45 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.3 | -8.5 | 176 | -59.6 | 173.5 | 0 | 0 | 0 | 113.9 | R32 R33 | R32-L35 PolarHBondContact O-N 3.44Å; R33-L35 PolarHBondContact O-N 3.08Å |
| 36 | H | 74.6 | Confident | 76.2 | Confident | 95 Ų | 95 | 104.1 Ų | 104.1 | 44% | 0.44 | 46% | 0.457 | S | S | . | . | trans | -109.2 | 75.6 | -177.9 | -79.6 | 74.1 | 0 | 0 | 0 | 111.9 | R32 R33 R38 H39 | R32-H36 PolarHBondContact O-ND1 2.98Å; R32-H36 VanDerWaalsContact O-ND1 3.12Å; R33-H36 PolarHBondContact O-N 3.19Å; H36-R38 VanDerWaalsContact C-N 3.28Å; H36-R38 PolarHBondContact O-N 3.34Å; H36-R38 VanDerWaalsContact O-N 3.16Å; H36-H39 PolarHBondContact O-N 3.08Å | ||
| 37 | F | 67.8 | Low | 77.3 | Confident | 123 Ų | 123 | 106.1 Ų | 106.1 | 54% | 0.539 | 46% | 0.462 | S | S | . | . | G | 310 helix | trans | -55 | -33.1 | -176.5 | -69.5 | -82.6 | 0 | 0 | 0 | 115.4 | H39 M40 F42 V82 | F37-H39 PolarHBondContact O-N 3.37Å; F37-M40 HydrophobicContact CD1-CE 3.96Å; F37-M40 HydrophobicContact CD1-SD 4.18Å; F37-M40 HydrophobicContact CE1-CE 4.36Å; F37-M40 HydrophobicContact CG-CE 4.27Å; F37-M40 PolarHBondContact O-N 3.08Å; F37-F42 HydrophobicContact CD1-CZ 4.48Å; F37-V82 HydrophobicContact CE1-CG1 4.09Å |
| 38 | R | 62.2 | Low | 78.3 | Confident | 241 Ų | 241 | 97.6 Ų | 97.6 | 91% | 0.909 | 43% | 0.43 | S | S | * | . | G | 310 helix | trans | -70.8 | -14.6 | -175.6 | -67.3 | -167.5 | 71.4 | 145.8 | 2.2 | 115.2 | H36 | H36-R38 VanDerWaalsContact C-N 3.28Å; H36-R38 PolarHBondContact O-N 3.34Å; H36-R38 VanDerWaalsContact O-N 3.16Å |
| 39 | H | 70.8 | Confident | 79.3 | Confident | 156 Ų | 156 | 90.1 Ų | 90.1 | 72% | 0.722 | 40% | 0.401 | S | S | * | . | G | 310 helix | trans | -107.5 | 14.5 | -178.3 | -62.4 | 84.5 | 0 | 0 | 0 | 112.1 | H36 F37 | H36-H39 PolarHBondContact O-N 3.08Å; F37-H39 PolarHBondContact O-N 3.37Å |
| 40 | M | 82.6 | Confident | 80.5 | Confident | 14 Ų | 14 | 89.5 Ų | 89.5 | 7% | 0.069 | 40% | 0.401 | C | S | . | . | trans | -93.6 | 130.3 | 179.9 | -66 | -176.6 | -163.2 | 0 | 0 | 110.8 | R33 L34 F37 F42 P78 A79 V82 | R33-M40 WeakPolarHBondContact O-CE 3.1Å; L34-M40 WeakPolarHBondContact O-CE 3.42Å; F37-M40 HydrophobicContact CD1-CE 3.96Å; F37-M40 HydrophobicContact CD1-SD 4.18Å; F37-M40 HydrophobicContact CE1-CE 4.36Å; F37-M40 HydrophobicContact CG-CE 4.27Å; F37-M40 PolarHBondContact O-N 3.08Å; M40-F42 VanDerWaalsContact C-N 3.32Å; M40-F42 HydrophobicContact CB-CD2 4.13Å; M40-F42 HydrophobicContact CB-CE1 4.45Å; M40-F42 HydrophobicContact CB-CE2 3.69Å; M40-F42 HydrophobicContact CB-CZ 3.87Å; M40-F42 HydrophobicContact CG-CZ 4.46Å; M40-F42 WeakPolarHBondContact O-CD2 3.35Å; M40-F42 PolarHBondContact O-N 2.97Å; M40-F42 HydrophobicContact SD-CE1 4.35Å; M40-F42 HydrophobicContact SD-CE2 4.44Å; M40-F42 HydrophobicContact SD-CZ 3.78Å; M40-P78 HydrophobicContact CE-CG 3.72Å; M40-P78 HydrophobicContact CG-CG 4.01Å; M40-P78 HydrophobicContact SD-CG 3.96Å; M40-A79 HydrophobicContact CB-CB 4.03Å; M40-V82 HydrophobicContact CE-CG2 4.17Å; M40-V82 HydrophobicContact SD-CG2 3.92Å | ||
| 41 | D | 85.4 | Confident | 81.6 | Confident | 104 Ų | 104 | 89.7 Ų | 89.7 | 56% | 0.556 | 40% | 0.402 | S | S | * | . | trans | -82.1 | 72.1 | -179.9 | -62.1 | -36.7 | 0 | 0 | 0 | 111.3 | E43 F44 A45 | D41-E43 VanDerWaalsContact C-N 3.34Å; D41-E43 PolarHBondContact O-N 3.19Å; D41-F44 HydrophobicContact CB-CB 4.2Å; D41-F44 PolarHBondContact O-N 2.88Å; D41-A45 PolarHBondContact O-N 3.18Å; D41-A45 VanDerWaalsContact O-N 3.16Å | ||
| 42 | F | 88.6 | Confident | 82.6 | Confident | 67 Ų | 67 | 85.8 Ų | 85.8 | 29% | 0.294 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -62.1 | -36.2 | -177 | -71.7 | -70.7 | 0 | 0 | 0 | 113.9 | F37 M40 A45 L46 A79 V82 L83 | F37-F42 HydrophobicContact CD1-CZ 4.48Å; M40-F42 VanDerWaalsContact C-N 3.32Å; M40-F42 HydrophobicContact CB-CD2 4.13Å; M40-F42 HydrophobicContact CB-CE1 4.45Å; M40-F42 HydrophobicContact CB-CE2 3.69Å; M40-F42 HydrophobicContact CB-CZ 3.87Å; M40-F42 HydrophobicContact CG-CZ 4.46Å; M40-F42 WeakPolarHBondContact O-CD2 3.35Å; M40-F42 PolarHBondContact O-N 2.97Å; M40-F42 HydrophobicContact SD-CE1 4.35Å; M40-F42 HydrophobicContact SD-CE2 4.44Å; M40-F42 HydrophobicContact SD-CZ 3.78Å; F42-A45 PolarHBondContact O-N 3.42Å; F42-L46 WeakPolarHBondContact O-CB 3.36Å; F42-L46 WeakPolarHBondContact O-CG 3.44Å; F42-L46 PolarHBondContact O-N 2.87Å; F42-A79 HydrophobicContact CD1-CB 4.35Å; F42-V82 HydrophobicContact CE1-CB 4.44Å; F42-V82 HydrophobicContact CE1-CG1 4.07Å; F42-V82 HydrophobicContact CZ-CG1 4.42Å; F42-L83 HydrophobicContact CD1-CD1 4.24Å; F42-L83 HydrophobicContact CD1-CD2 4.05Å; F42-L83 HydrophobicContact CD1-CG 3.97Å; F42-L83 HydrophobicContact CE1-CD2 4.48Å; F42-L83 HydrophobicContact CE1-CG 4.39Å |
| 43 | E | 89.9 | Confident | 83.5 | Confident | 145 Ų | 145 | 81.5 Ų | 81.5 | 68% | 0.678 | 37% | 0.368 | S | S | * | . | H | α-helix | trans | -61.3 | -47.2 | 179 | -171.1 | -171.1 | 161.7 | 0 | 0 | 111 | D41 A45 L46 W47 | D41-E43 VanDerWaalsContact C-N 3.34Å; D41-E43 PolarHBondContact O-N 3.19Å; E43-A45 VanDerWaalsContact C-N 3.33Å; E43-A45 PolarHBondContact O-N 3.45Å; E43-L46 PolarHBondContact O-N 3.26Å; E43-W47 PolarHBondContact O-N 3.3Å |
| 44 | F | 88.4 | Confident | 84.4 | Confident | 71 Ų | 71 | 81.6 Ų | 81.6 | 31% | 0.311 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -61.1 | -44.2 | 176.3 | 178.4 | -104.7 | 0 | 0 | 0 | 111.3 | D41 L46 W47 Q48 N62 | D41-F44 HydrophobicContact CB-CB 4.2Å; D41-F44 PolarHBondContact O-N 2.88Å; F44-L46 PolarHBondContact O-N 3.26Å; F44-W47 PolarHBondContact O-N 2.71Å; F44-Q48 HydrophobicContact CD1-CG 4.24Å; F44-Q48 HydrophobicContact CE1-CG 3.89Å; F44-Q48 HydrophobicContact CE2-CG 4.44Å; F44-Q48 HydrophobicContact CZ-CG 3.99Å; F44-Q48 WeakPolarHBondContact O-CG 3.14Å; F44-Q48 PolarHBondContact O-N 2.91Å; F44-N62 HydrophobicContact CE2-CB 4.47Å; F44-N62 WeakPolarHBondContact CE2-ND2 3.49Å; F44-N62 HydrophobicContact CZ-CB 4.12Å |
| 45 | A | 90.6 | Very high | 85.4 | Confident | 0 Ų | 0 | 80.4 Ų | 80.4 | 0% | 0 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -64.7 | -38.1 | 179 | 0 | 0 | 0 | 0 | 0 | 112.9 | D41 F42 E43 Q48 M49 A79 F80 L83 | D41-A45 PolarHBondContact O-N 3.18Å; D41-A45 VanDerWaalsContact O-N 3.16Å; F42-A45 PolarHBondContact O-N 3.42Å; E43-A45 VanDerWaalsContact C-N 3.33Å; E43-A45 PolarHBondContact O-N 3.45Å; A45-Q48 WeakPolarHBondContact O-CB 3.48Å; A45-Q48 PolarHBondContact O-N 2.89Å; A45-M49 WeakPolarHBondContact O-CG 2.84Å; A45-M49 PolarHBondContact O-N 3.36Å; A45-A79 HydrophobicContact CB-CB 3.79Å; A45-F80 HydrophobicContact CB-CB 4.39Å; A45-L83 HydrophobicContact CB-CD1 3.63Å |
| 46 | L | 91.9 | Very high | 86.4 | Confident | 91 Ų | 91 | 74.7 Ų | 74.7 | 48% | 0.476 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -63.8 | -44.1 | 173.8 | -76.8 | 170.2 | 0 | 0 | 0 | 111.8 | F42 E43 F44 Q48 M49 L50 L83 | F42-L46 WeakPolarHBondContact O-CB 3.36Å; F42-L46 WeakPolarHBondContact O-CG 3.44Å; F42-L46 PolarHBondContact O-N 2.87Å; E43-L46 PolarHBondContact O-N 3.26Å; F44-L46 PolarHBondContact O-N 3.26Å; L46-Q48 VanDerWaalsContact C-N 3.31Å; L46-Q48 PolarHBondContact O-N 2.89Å; L46-M49 WeakPolarHBondContact O-CB 3.47Å; L46-M49 PolarHBondContact O-N 2.92Å; L46-L50 PolarHBondContact O-N 3.48Å; L46-L83 HydrophobicContact CD2-CD1 3.96Å; L46-L83 HydrophobicContact CD2-CD2 4.33Å; L46-L83 HydrophobicContact CG-CD1 3.88Å |
| 47 | W | 92.1 | Very high | 87.2 | Confident | 121 Ų | 121 | 76.2 Ų | 76.2 | 46% | 0.458 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -61.9 | -40.1 | 173.8 | -78.2 | 118.6 | 0 | 0 | 0 | 112.1 | E43 F44 M49 L50 Y51 | E43-W47 PolarHBondContact O-N 3.3Å; F44-W47 PolarHBondContact O-N 2.71Å; W47-M49 VanDerWaalsContact C-N 3.34Å; W47-M49 PolarHBondContact O-N 3.45Å; W47-L50 HydrophobicContact CE3-CD2 4.25Å; W47-L50 HydrophobicContact CZ3-CD1 4.22Å; W47-L50 HydrophobicContact CZ3-CD2 4.16Å; W47-L50 PolarHBondContact O-N 2.87Å; W47-Y51 HydrophobicContact CB-CD2 4.4Å; W47-Y51 HydrophobicContact CB-CE2 4.09Å; W47-Y51 HydrophobicContact CE3-CE1 4.14Å; W47-Y51 HydrophobicContact CE3-CE2 4.32Å; W47-Y51 AromaticContact CE3-CZ 3.82Å; W47-Y51 HydrophobicContact CZ3-CE1 4.49Å; W47-Y51 WeakPolarHBondContact O-CB 3.5Å; W47-Y51 WeakPolarHBondContact O-CD2 3.44Å; W47-Y51 VanDerWaalsContact O-CG 3.25Å; W47-Y51 PolarHBondContact O-N 3.24Å |
| 48 | Q | 91.1 | Very high | 88.1 | Confident | 1 Ų | 1 | 76.4 Ų | 76.4 | 1% | 0.005 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -58.9 | -46.4 | 173.5 | -72.6 | -171.4 | -43.2 | 0 | 0 | 111.4 | F44 A45 L46 L50 Y51 L52 F80 | F44-Q48 HydrophobicContact CD1-CG 4.24Å; F44-Q48 HydrophobicContact CE1-CG 3.89Å; F44-Q48 HydrophobicContact CE2-CG 4.44Å; F44-Q48 HydrophobicContact CZ-CG 3.99Å; F44-Q48 WeakPolarHBondContact O-CG 3.14Å; F44-Q48 PolarHBondContact O-N 2.91Å; A45-Q48 WeakPolarHBondContact O-CB 3.48Å; A45-Q48 PolarHBondContact O-N 2.89Å; L46-Q48 VanDerWaalsContact C-N 3.31Å; L46-Q48 PolarHBondContact O-N 2.89Å; Q48-L50 PolarHBondContact O-N 2.97Å; Q48-Y51 PolarHBondContact O-N 2.94Å; Q48-L52 WeakPolarHBondContact O-CG 3.34Å; Q48-L52 PolarHBondContact O-N 2.84Å; Q48-F80 HydrophobicContact CB-CD2 4.39Å |
| 49 | M | 93.8 | Very high | 89.4 | Confident | 3 Ų | 3 | 65 Ų | 65 | 2% | 0.015 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -59.5 | -44.8 | 176.6 | -77.3 | -177.6 | 164.4 | 0 | 0 | 112.5 | A45 L46 W47 L52 F53 F80 L83 L84 Y161 | A45-M49 WeakPolarHBondContact O-CG 2.84Å; A45-M49 PolarHBondContact O-N 3.36Å; L46-M49 WeakPolarHBondContact O-CB 3.47Å; L46-M49 PolarHBondContact O-N 2.92Å; W47-M49 VanDerWaalsContact C-N 3.34Å; W47-M49 PolarHBondContact O-N 3.45Å; M49-L52 PolarHBondContact O-N 2.87Å; M49-F53 WeakPolarHBondContact O-CD2 3.49Å; M49-F80 HydrophobicContact CE-CD2 4.15Å; M49-F80 HydrophobicContact CE-CE1 4.5Å; M49-F80 HydrophobicContact CE-CE2 4.05Å; M49-F80 HydrophobicContact CE-CG 4.44Å; M49-F80 HydrophobicContact CE-CZ 4.22Å; M49-F80 WeakPolarHBondContact CE-O 3.48Å; M49-F80 HydrophobicContact CG-CD2 4.04Å; M49-F80 HydrophobicContact CG-CE2 3.59Å; M49-F80 HydrophobicContact CG-CZ 4.33Å; M49-L83 HydrophobicContact CE-CB 3.5Å; M49-L83 HydrophobicContact SD-CB 3.81Å; M49-L83 HydrophobicContact SD-CD1 4.13Å; M49-L84 HydrophobicContact CE-CB 4.08Å; M49-Y161 HydrophobicContact CB-CD1 4.2Å; M49-Y161 HydrophobicContact CB-CE1 3.45Å; M49-Y161 VanDerWaalsContact CB-CE1 3.45Å; M49-Y161 HydrophobicContact CE-CD2 4.06Å; M49-Y161 HydrophobicContact CE-CE2 3.99Å; M49-Y161 HydrophobicContact CG-CD1 4.03Å; M49-Y161 HydrophobicContact CG-CE1 3.64Å; M49-Y161 HydrophobicContact CG-CE2 4.29Å; M49-Y161 HydrophobicContact CG-CG 4.48Å; M49-Y161 HydrophobicContact SD-CE1 4.31Å; M49-Y161 HydrophobicContact SD-CE2 3.95Å |
| 50 | L | 93.4 | Very high | 90.2 | Very high | 80 Ų | 80 | 57.8 Ų | 57.8 | 42% | 0.419 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -65.7 | -41 | 177.5 | -176.4 | 149.2 | 0 | 0 | 0 | 112.2 | L46 W47 Q48 L52 F53 T54 | L46-L50 PolarHBondContact O-N 3.48Å; W47-L50 HydrophobicContact CE3-CD2 4.25Å; W47-L50 HydrophobicContact CZ3-CD1 4.22Å; W47-L50 HydrophobicContact CZ3-CD2 4.16Å; W47-L50 PolarHBondContact O-N 2.87Å; Q48-L50 PolarHBondContact O-N 2.97Å; L50-L52 VanDerWaalsContact C-N 3.29Å; L50-L52 PolarHBondContact O-N 3.19Å; L50-F53 PolarHBondContact O-N 3.22Å; L50-T54 HydrophobicContact CD2-CG2 4.14Å; L50-T54 PolarHBondContact O-N 3.38Å; L50-T54 PolarHBondContact O-OG1 3.29Å; L50-T54 VanDerWaalsContact O-OG1 3.05Å |
| 51 | Y | 93.3 | Very high | 90.4 | Very high | 55 Ų | 55 | 63.5 Ų | 63.5 | 22% | 0.216 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -69.8 | -24.3 | 179 | -67.8 | -34.4 | 0 | 0 | 0 | 113.2 | W47 Q48 F53 T54 S55 P56 R58 V59 | W47-Y51 HydrophobicContact CB-CD2 4.4Å; W47-Y51 HydrophobicContact CB-CE2 4.09Å; W47-Y51 HydrophobicContact CE3-CE1 4.14Å; W47-Y51 HydrophobicContact CE3-CE2 4.32Å; W47-Y51 AromaticContact CE3-CZ 3.82Å; W47-Y51 HydrophobicContact CZ3-CE1 4.49Å; W47-Y51 WeakPolarHBondContact O-CB 3.5Å; W47-Y51 WeakPolarHBondContact O-CD2 3.44Å; W47-Y51 VanDerWaalsContact O-CG 3.25Å; W47-Y51 PolarHBondContact O-N 3.24Å; Q48-Y51 PolarHBondContact O-N 2.94Å; Y51-F53 PolarHBondContact O-N 3Å; Y51-T54 PolarHBondContact O-N 3.28Å; Y51-S55 WeakPolarHBondContact CD1-OG 3.34Å; Y51-S55 CarbonylContact O-C 3.52Å; Y51-S55 WeakPolarHBondContact O-CA 3.44Å; Y51-S55 PolarHBondContact O-N 3.46Å; Y51-P56 WeakPolarHBondContact O-CA 3.33Å; Y51-R58 HydrophobicContact CD2-CB 4.47Å; Y51-R58 HydrophobicContact CG-CB 4.48Å; Y51-V59 VanDerWaalsContact CB-CG2 3.49Å |
| 52 | L | 93.6 | Very high | 90.4 | Very high | 0 Ų | 0 | 60.3 Ų | 60.3 | 0% | 0 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -60.3 | -28.6 | 173.1 | -73.5 | 167.9 | 0 | 0 | 0 | 112.8 | Q48 M49 L50 V59 F80 N158 Y161 P162 I206 | Q48-L52 WeakPolarHBondContact O-CG 3.34Å; Q48-L52 PolarHBondContact O-N 2.84Å; M49-L52 PolarHBondContact O-N 2.87Å; L50-L52 VanDerWaalsContact C-N 3.29Å; L50-L52 PolarHBondContact O-N 3.19Å; L52-V59 HydrophobicContact CD2-CG1 4.44Å; L52-V59 HydrophobicContact CD2-CG2 4.24Å; L52-V59 HydrophobicContact CG-CG2 4.23Å; L52-F80 HydrophobicContact CD1-CE2 3.94Å; L52-F80 HydrophobicContact CD1-CZ 3.9Å; L52-N158 HydrophobicContact CD1-CB 4.27Å; L52-N158 WeakPolarHBondContact CD1-O 3.47Å; L52-N158 HydrophobicContact CD2-CB 3.88Å; L52-Y161 HydrophobicContact CD1-CD1 3.94Å; L52-P162 HydrophobicContact CB-CG 3.91Å; L52-I206 HydrophobicContact CD2-CD1 4.2Å; L52-I206 HydrophobicContact CD2-CG2 4.16Å |
| 53 | F | 91.3 | Very high | 90.2 | Very high | 64 Ų | 64 | 57.1 Ų | 57.1 | 28% | 0.281 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -88.6 | -44.3 | 174 | -63 | -74.2 | 0 | 0 | 0 | 113.3 | M49 L50 Y51 Y161 P162 V165 | M49-F53 WeakPolarHBondContact O-CD2 3.49Å; L50-F53 PolarHBondContact O-N 3.22Å; Y51-F53 PolarHBondContact O-N 3Å; F53-Y161 HydrophobicContact CD2-CE1 4.31Å; F53-Y161 HydrophobicContact CE2-CD1 4.03Å; F53-Y161 AromaticContact CE2-CE1 3.36Å; F53-Y161 HydrophobicContact CE2-CE1 3.36Å; F53-Y161 HydrophobicContact CZ-CD1 4.26Å; F53-Y161 AromaticContact CZ-CE1 3.92Å; F53-Y161 HydrophobicContact CZ-CE1 3.92Å; F53-P162 HydrophobicContact CD1-CB 4.23Å; F53-P162 HydrophobicContact CE1-CB 3.6Å; F53-P162 HydrophobicContact CE1-CG 4.07Å; F53-P162 HydrophobicContact CZ-CB 4.06Å; F53-P162 HydrophobicContact CZ-CG 4.2Å; F53-V165 HydrophobicContact CE1-CB 4.13Å; F53-V165 HydrophobicContact CE1-CG1 4.21Å; F53-V165 HydrophobicContact CE2-CG2 4.29Å; F53-V165 HydrophobicContact CZ-CB 3.57Å; F53-V165 HydrophobicContact CZ-CG1 3.78Å; F53-V165 HydrophobicContact CZ-CG2 3.67Å |
| 54 | T | 90.8 | Very high | 89.9 | Confident | 96 Ų | 96 | 53.5 Ų | 53.5 | 59% | 0.589 | 25% | 0.246 | S | C | * | . | H | α-helix | trans | -88.4 | -35.5 | -169.4 | 54.6 | 0 | 0 | 0 | 0 | 113.4 | L50 Y51 | L50-T54 HydrophobicContact CD2-CG2 4.14Å; L50-T54 PolarHBondContact O-N 3.38Å; L50-T54 PolarHBondContact O-OG1 3.29Å; L50-T54 VanDerWaalsContact O-OG1 3.05Å; Y51-T54 PolarHBondContact O-N 3.28Å |
| 55 | S | 92 | Very high | 89.7 | Confident | 27 Ų | 27 | 55.9 Ų | 55.9 | 19% | 0.189 | 25% | 0.254 | C | S | . | . | trans | -162.7 | 69.5 | -172.3 | 51 | 0 | 0 | 0 | 0 | 111.5 | Y51 Q57 R58 | Y51-S55 WeakPolarHBondContact CD1-OG 3.34Å; Y51-S55 CarbonylContact O-C 3.52Å; Y51-S55 WeakPolarHBondContact O-CA 3.44Å; Y51-S55 PolarHBondContact O-N 3.46Å; S55-Q57 PolarHBondContact O-N 2.87Å; S55-R58 WeakPolarHBondContact O-CB 3.22Å; S55-R58 PolarHBondContact O-N 3.41Å; S55-R58 WeakPolarHBondContact OG-CD 3.26Å | ||
| 56 | P | 90.7 | Very high | 89.4 | Confident | 14 Ų | 14 | 57.2 Ų | 57.2 | 9% | 0.091 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -61.4 | -24.4 | -171.2 | 23.5 | -34.9 | 0 | 0 | 0 | 112.9 | Y51 R58 V59 Y60 Y205 I206 L209 | Y51-P56 WeakPolarHBondContact O-CA 3.33Å; P56-R58 PolarHBondContact O-N 3.02Å; P56-V59 WeakPolarHBondContact O-CB 3.46Å; P56-V59 PolarHBondContact O-N 3.49Å; P56-V59 VanDerWaalsContact O-N 3.1Å; P56-Y60 WeakPolarHBondContact O-CD2 3.46Å; P56-Y60 PolarHBondContact O-N 3.39Å; P56-Y205 HydrophobicContact CG-CE1 3.86Å; P56-I206 HydrophobicContact CB-CG1 4.36Å; P56-L209 HydrophobicContact CB-CD2 3.84Å; P56-L209 HydrophobicContact CG-CD2 4.07Å |
| 57 | Q | 90.4 | Very high | 89.1 | Confident | 128 Ų | 128 | 55.4 Ų | 55.4 | 60% | 0.598 | 25% | 0.247 | S | C | * | . | H | α-helix | trans | -57.7 | -33.5 | 173.1 | -64.1 | 179.8 | -16 | 0 | 0 | 112.7 | S55 V59 Y60 R61 L209 | S55-Q57 PolarHBondContact O-N 2.87Å; Q57-V59 VanDerWaalsContact C-N 3.34Å; Q57-V59 PolarHBondContact O-N 3.41Å; Q57-Y60 PolarHBondContact O-N 3.27Å; Q57-R61 PolarHBondContact O-N 2.83Å; Q57-L209 HydrophobicContact CB-CD2 4.42Å; Q57-L209 HydrophobicContact CG-CD1 4Å; Q57-L209 HydrophobicContact CG-CD2 3.85Å |
| 58 | R | 88.3 | Confident | 88.8 | Confident | 127 Ų | 127 | 57.1 Ų | 57.1 | 48% | 0.479 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -66.6 | -36.4 | 177.4 | -67 | -170.8 | 177.5 | -177.1 | -2.2 | 112 | Y51 S55 P56 Y60 R61 | Y51-R58 HydrophobicContact CD2-CB 4.47Å; Y51-R58 HydrophobicContact CG-CB 4.48Å; S55-R58 WeakPolarHBondContact O-CB 3.22Å; S55-R58 PolarHBondContact O-N 3.41Å; S55-R58 WeakPolarHBondContact OG-CD 3.26Å; P56-R58 PolarHBondContact O-N 3.02Å; R58-Y60 VanDerWaalsContact C-N 3.31Å; R58-Y60 PolarHBondContact O-N 3.04Å; R58-R61 PolarHBondContact O-N 2.99Å |
| 59 | V | 88.8 | Confident | 88.5 | Confident | 0 Ų | 0 | 62.2 Ų | 62.2 | 0% | 0 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -60.6 | -45.6 | 178.2 | 179.4 | 0 | 0 | 0 | 0 | 109.8 | Y51 L52 P56 Q57 R61 N62 F63 | Y51-V59 VanDerWaalsContact CB-CG2 3.49Å; L52-V59 HydrophobicContact CD2-CG1 4.44Å; L52-V59 HydrophobicContact CD2-CG2 4.24Å; L52-V59 HydrophobicContact CG-CG2 4.23Å; P56-V59 WeakPolarHBondContact O-CB 3.46Å; P56-V59 PolarHBondContact O-N 3.49Å; P56-V59 VanDerWaalsContact O-N 3.1Å; Q57-V59 VanDerWaalsContact C-N 3.34Å; Q57-V59 PolarHBondContact O-N 3.41Å; V59-R61 PolarHBondContact O-N 2.94Å; V59-N62 WeakPolarHBondContact O-CB 3.02Å; V59-N62 PolarHBondContact O-N 3.06Å; V59-N62 VanDerWaalsContact O-N 3.14Å; V59-F63 HydrophobicContact CG1-CE2 4.02Å; V59-F63 VanDerWaalsContact O-CD2 3.31Å; V59-F63 WeakPolarHBondContact O-CD2 3.32Å |
| 60 | Y | 87.6 | Confident | 87.9 | Confident | 5 Ų | 5 | 68.1 Ų | 68.1 | 2% | 0.02 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -73.2 | -24.6 | -178.2 | -68.9 | -67.1 | 0 | 0 | 0 | 114.2 | P56 Q57 R58 N62 F63 H64 V155 I206 L209 A213 | P56-Y60 WeakPolarHBondContact O-CD2 3.46Å; P56-Y60 PolarHBondContact O-N 3.39Å; Q57-Y60 PolarHBondContact O-N 3.27Å; R58-Y60 VanDerWaalsContact C-N 3.31Å; R58-Y60 PolarHBondContact O-N 3.04Å; Y60-N62 PolarHBondContact O-N 3.49Å; Y60-F63 HydrophobicContact CD1-CD2 4.1Å; Y60-F63 HydrophobicContact CD1-CE2 4.33Å; Y60-F63 WeakPolarHBondContact O-CB 3.39Å; Y60-F63 PolarHBondContact O-N 2.69Å; Y60-F63 VanDerWaalsContact O-N 3.1Å; Y60-H64 PolarHBondContact O-CD2 3.49Å; Y60-H64 PolarHBondContact O-N 3.11Å; Y60-V155 HydrophobicContact CE1-CG2 4.33Å; Y60-I206 HydrophobicContact CE2-CG2 4.21Å; Y60-I206 VanDerWaalsContact OH-CG2 3.25Å; Y60-I206 WeakPolarHBondContact OH-CG2 3.41Å; Y60-I206 PolarHBondContact OH-O 2.73Å; Y60-L209 HydrophobicContact CD2-CB 4.11Å; Y60-L209 HydrophobicContact CD2-CD2 3.6Å; Y60-L209 HydrophobicContact CD2-CG 3.47Å; Y60-L209 VanDerWaalsContact CD2-CG 3.47Å; Y60-L209 HydrophobicContact CE2-CB 3.87Å; Y60-L209 HydrophobicContact CE2-CD2 3.85Å; Y60-L209 HydrophobicContact CE2-CG 3.76Å; Y60-L209 HydrophobicContact CG-CG 4.39Å; Y60-A213 HydrophobicContact CD1-CB 4.49Å; Y60-A213 HydrophobicContact CG-CB 4.46Å |
| 61 | R | 86.7 | Confident | 87.5 | Confident | 134 Ų | 134 | 69.8 Ų | 69.8 | 51% | 0.506 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -59.3 | -34.7 | 167.9 | -170 | 170.5 | 60.7 | -180 | 2.2 | 112.3 | Q57 R58 V59 F63 H64 Y65 | Q57-R61 PolarHBondContact O-N 2.83Å; R58-R61 PolarHBondContact O-N 2.99Å; V59-R61 PolarHBondContact O-N 2.94Å; R61-F63 VanDerWaalsContact C-N 3.28Å; R61-F63 PolarHBondContact O-N 3.44Å; R61-H64 WeakPolarHBondContact O-CB 3.28Å; R61-H64 PolarHBondContact O-N 2.88Å; R61-Y65 HydrophobicContact CG-CD2 4.34Å; R61-Y65 HydrophobicContact CG-CE2 3.67Å; R61-Y65 WeakPolarHBondContact O-CD2 3.39Å; R61-Y65 PolarHBondContact O-N 2.67Å |
| 62 | N | 85.1 | Confident | 87.1 | Confident | 38 Ų | 38 | 68.2 Ų | 68.2 | 20% | 0.203 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -66.4 | -29.9 | 176.7 | -63.1 | -19.7 | 0 | 0 | 0 | 112.8 | F44 V59 Y60 Y65 R66 | F44-N62 HydrophobicContact CE2-CB 4.47Å; F44-N62 WeakPolarHBondContact CE2-ND2 3.49Å; F44-N62 HydrophobicContact CZ-CB 4.12Å; V59-N62 WeakPolarHBondContact O-CB 3.02Å; V59-N62 PolarHBondContact O-N 3.06Å; V59-N62 VanDerWaalsContact O-N 3.14Å; Y60-N62 PolarHBondContact O-N 3.49Å; N62-Y65 PolarHBondContact O-N 3.01Å; N62-R66 WeakPolarHBondContact O-CG 3.39Å; N62-R66 PolarHBondContact O-N 3.33Å; N62-R66 VanDerWaalsContact O-N 3.08Å |
| 63 | F | 84 | Confident | 86.7 | Confident | 0 Ų | 0 | 68.7 Ų | 68.7 | 0% | 0 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -66.7 | -38.2 | 175.3 | -74.1 | -108.1 | 0 | 0 | 0 | 111.2 | V59 Y60 R61 R66 K67 W73 Y151 D154 | V59-F63 HydrophobicContact CG1-CE2 4.02Å; V59-F63 VanDerWaalsContact O-CD2 3.31Å; V59-F63 WeakPolarHBondContact O-CD2 3.32Å; Y60-F63 HydrophobicContact CD1-CD2 4.1Å; Y60-F63 HydrophobicContact CD1-CE2 4.33Å; Y60-F63 WeakPolarHBondContact O-CB 3.39Å; Y60-F63 PolarHBondContact O-N 2.69Å; Y60-F63 VanDerWaalsContact O-N 3.1Å; R61-F63 VanDerWaalsContact C-N 3.28Å; R61-F63 PolarHBondContact O-N 3.44Å; F63-R66 PolarHBondContact O-N 2.99Å; F63-K67 PolarHBondContact O-N 3.16Å; F63-W73 HydrophobicContact CB-CE3 4.09Å; F63-W73 HydrophobicContact CB-CZ3 4.28Å; F63-W73 VanDerWaalsContact CD1-O 3.24Å; F63-W73 WeakPolarHBondContact CD1-O 3.35Å; F63-Y151 AromaticContact CD1-CD2 3.62Å; F63-Y151 HydrophobicContact CD1-CD2 3.62Å; F63-Y151 AromaticContact CD1-CE2 3.31Å; F63-Y151 HydrophobicContact CD1-CE2 3.31Å; F63-Y151 AromaticContact CE1-CD2 3.77Å; F63-Y151 HydrophobicContact CE1-CD2 3.77Å; F63-Y151 AromaticContact CE1-CE2 3.67Å; F63-Y151 HydrophobicContact CE1-CE2 3.67Å; F63-Y151 HydrophobicContact CG-CE2 4.12Å; F63-D154 HydrophobicContact CE1-CB 4.14Å; F63-D154 HydrophobicContact CZ-CB 4.32Å |
| 64 | H | 85 | Confident | 86.5 | Confident | 68 Ų | 68 | 66.4 Ų | 66.4 | 32% | 0.315 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -60.8 | -44.8 | 172.2 | -74.2 | -80.7 | 0 | 0 | 0 | 112.5 | Y60 R61 R66 K67 Q68 W73 A213 | Y60-H64 PolarHBondContact O-CD2 3.49Å; Y60-H64 PolarHBondContact O-N 3.11Å; R61-H64 WeakPolarHBondContact O-CB 3.28Å; R61-H64 PolarHBondContact O-N 2.88Å; H64-R66 VanDerWaalsContact C-N 3.29Å; H64-R66 PolarHBondContact O-N 3.44Å; H64-K67 PolarHBondContact O-N 2.83Å; H64-Q68 PolarHBondContact O-N 3.44Å; H64-W73 AromaticContact ND1-CH2 3.72Å; H64-A213 PolarHBondContact CE1-O 3.48Å; H64-A213 PolarHBondContact NE2-O 3.4Å |
| 65 | Y | 83.2 | Confident | 86.2 | Confident | 121 Ų | 121 | 62.3 Ų | 62.3 | 48% | 0.475 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -61.5 | -37.7 | 177.2 | -67.4 | -53.3 | 0 | 0 | 0 | 112.2 | R61 N62 Q68 T69 | R61-Y65 HydrophobicContact CG-CD2 4.34Å; R61-Y65 HydrophobicContact CG-CE2 3.67Å; R61-Y65 WeakPolarHBondContact O-CD2 3.39Å; R61-Y65 PolarHBondContact O-N 2.67Å; N62-Y65 PolarHBondContact O-N 3.01Å; Y65-Q68 PolarHBondContact O-N 3.22Å; Y65-T69 WeakPolarHBondContact O-CG2 3.25Å; Y65-T69 PolarHBondContact O-N 3.49Å; Y65-T69 VanDerWaalsContact O-N 3.11Å; Y65-T69 PolarHBondContact O-OG1 3.04Å |
| 66 | R | 84.7 | Confident | 85.6 | Confident | 28 Ų | 28 | 62.5 Ų | 62.5 | 11% | 0.106 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -67.1 | -39.2 | 174.2 | -68.2 | -164.3 | -46.7 | -123 | 4.8 | 112.6 | N62 F63 H64 Q68 T69 K70 W73 | N62-R66 WeakPolarHBondContact O-CG 3.39Å; N62-R66 PolarHBondContact O-N 3.33Å; N62-R66 VanDerWaalsContact O-N 3.08Å; F63-R66 PolarHBondContact O-N 2.99Å; H64-R66 VanDerWaalsContact C-N 3.29Å; H64-R66 PolarHBondContact O-N 3.44Å; R66-Q68 VanDerWaalsContact C-N 3.27Å; R66-Q68 PolarHBondContact O-N 2.99Å; R66-T69 WeakPolarHBondContact CA-OG1 3.45Å; R66-T69 PolarHBondContact O-N 3.39Å; R66-T69 PolarHBondContact O-OG1 3.46Å; R66-K70 PolarHBondContact O-N 3.26Å; R66-W73 PolarHBondContact NH2-O 3.45Å |
| 67 | K | 86.1 | Confident | 85.2 | Confident | 54 Ų | 54 | 63 Ų | 63 | 24% | 0.235 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -60 | -40.3 | 174.7 | -175.4 | 58.1 | 173 | 168 | 0 | 111.2 | F63 H64 D71 W73 | F63-K67 PolarHBondContact O-N 3.16Å; H64-K67 PolarHBondContact O-N 2.83Å; K67-D71 VanDerWaalsContact CE-OD1 3.24Å; K67-D71 WeakPolarHBondContact CE-OD1 3.39Å; K67-D71 PolarHBondContact NZ-O 3.47Å; K67-D71 IonicContact NZ-OD1 3.42Å; K67-D71 PolarHBondContact NZ-OD1 2.81Å; K67-D71 WeakPolarHBondContact O-CA 3.24Å; K67-D71 PolarHBondContact O-N 2.92Å; K67-D71 VanDerWaalsContact O-N 3.1Å; K67-W73 HydrophobicContact CB-CD2 4.1Å; K67-W73 HydrophobicContact CB-CE3 4.14Å; K67-W73 HydrophobicContact CB-CH2 4.03Å; K67-W73 HydrophobicContact CB-CZ2 3.97Å; K67-W73 HydrophobicContact CB-CZ3 4.11Å; K67-W73 HydrophobicContact CD-CD2 4.25Å; K67-W73 HydrophobicContact CD-CG 4.39Å; K67-W73 HydrophobicContact CD-CZ2 4.21Å; K67-W73 HydrophobicContact CG-CD2 4.24Å; K67-W73 HydrophobicContact CG-CH2 4.16Å; K67-W73 HydrophobicContact CG-CZ2 3.62Å |
| 68 | Q | 85.4 | Confident | 85 | Confident | 156 Ų | 156 | 57 Ų | 57 | 73% | 0.729 | 26% | 0.263 | S | S | * | . | H | α-helix | trans | -69.5 | -32.5 | 178 | -69.2 | 174.6 | -6.2 | 0 | 0 | 113.8 | H64 Y65 R66 | H64-Q68 PolarHBondContact O-N 3.44Å; Y65-Q68 PolarHBondContact O-N 3.22Å; R66-Q68 VanDerWaalsContact C-N 3.27Å; R66-Q68 PolarHBondContact O-N 2.99Å |
| 69 | T | 85.3 | Confident | 85 | Confident | 109 Ų | 109 | 51 Ų | 51 | 67% | 0.669 | 24% | 0.24 | S | C | * | . | H | α-helix | trans | -97.7 | -28.8 | -172.7 | 50.8 | 0 | 0 | 0 | 0 | 114.5 | Y65 R66 | Y65-T69 WeakPolarHBondContact O-CG2 3.25Å; Y65-T69 PolarHBondContact O-N 3.49Å; Y65-T69 VanDerWaalsContact O-N 3.11Å; Y65-T69 PolarHBondContact O-OG1 3.04Å; R66-T69 WeakPolarHBondContact CA-OG1 3.45Å; R66-T69 PolarHBondContact O-N 3.39Å; R66-T69 PolarHBondContact O-OG1 3.46Å |
| 70 | K | 80.8 | Confident | 85.1 | Confident | 126 Ų | 126 | 51 Ų | 51 | 55% | 0.548 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -129.3 | 2.9 | -173.8 | -62.2 | -177.4 | -178.7 | 176 | 0 | 113.6 | R66 Q72 | R66-K70 PolarHBondContact O-N 3.26Å; K70-Q72 HydrophobicContact CB-CG 4.03Å; K70-Q72 PolarHBondContact O-N 3.4Å; K70-Q72 VanDerWaalsContact O-N 3.09Å |
| 71 | D | 84.6 | Confident | 85.2 | Confident | 116 Ų | 116 | 52 Ų | 52 | 62% | 0.62 | 25% | 0.245 | S | C | * | . | S | Bend | trans | 53.2 | 27.3 | -178.6 | -162.4 | 33.5 | 0 | 0 | 0 | 115.3 | K67 | K67-D71 VanDerWaalsContact CE-OD1 3.24Å; K67-D71 WeakPolarHBondContact CE-OD1 3.39Å; K67-D71 PolarHBondContact NZ-O 3.47Å; K67-D71 IonicContact NZ-OD1 3.42Å; K67-D71 PolarHBondContact NZ-OD1 2.81Å; K67-D71 WeakPolarHBondContact O-CA 3.24Å; K67-D71 PolarHBondContact O-N 2.92Å; K67-D71 VanDerWaalsContact O-N 3.1Å |
| 72 | Q | 84.8 | Confident | 85.4 | Confident | 22 Ų | 22 | 46.5 Ų | 46.5 | 10% | 0.103 | 23% | 0.227 | C | C | . | . | trans | -138.7 | 146.7 | -179.9 | 68.3 | -171.6 | -6.8 | 0 | 0 | 112 | K70 D76 E148 | K70-Q72 HydrophobicContact CB-CG 4.03Å; K70-Q72 PolarHBondContact O-N 3.4Å; K70-Q72 VanDerWaalsContact O-N 3.09Å; Q72-D76 PolarHBondContact NE2-OD1 3.27Å; Q72-D76 PolarHBondContact NE2-OD2 3.31Å; Q72-D76 PolarHBondContact OE1-OD1 2.95Å; Q72-E148 WeakPolarHBondContact CA-OE1 3.4Å | ||
| 73 | W | 85.6 | Confident | 85.8 | Confident | 10 Ų | 10 | 45.7 Ų | 45.7 | 4% | 0.038 | 22% | 0.222 | C | C | . | . | trans | -91.9 | -38.9 | 178.8 | -67 | 103.6 | 0 | 0 | 0 | 112.5 | F63 H64 R66 K67 E148 Y151 L214 F216 | F63-W73 HydrophobicContact CB-CE3 4.09Å; F63-W73 HydrophobicContact CB-CZ3 4.28Å; F63-W73 VanDerWaalsContact CD1-O 3.24Å; F63-W73 WeakPolarHBondContact CD1-O 3.35Å; H64-W73 AromaticContact ND1-CH2 3.72Å; R66-W73 PolarHBondContact NH2-O 3.45Å; K67-W73 HydrophobicContact CB-CD2 4.1Å; K67-W73 HydrophobicContact CB-CE3 4.14Å; K67-W73 HydrophobicContact CB-CH2 4.03Å; K67-W73 HydrophobicContact CB-CZ2 3.97Å; K67-W73 HydrophobicContact CB-CZ3 4.11Å; K67-W73 HydrophobicContact CD-CD2 4.25Å; K67-W73 HydrophobicContact CD-CG 4.39Å; K67-W73 HydrophobicContact CD-CZ2 4.21Å; K67-W73 HydrophobicContact CG-CD2 4.24Å; K67-W73 HydrophobicContact CG-CH2 4.16Å; K67-W73 HydrophobicContact CG-CZ2 3.62Å; W73-E148 PolarHBondContact N-OE1 2.98Å; W73-E148 PolarHBondContact N-OE2 3.16Å; W73-Y151 HydrophobicContact CB-CD2 3.6Å; W73-Y151 HydrophobicContact CB-CE2 4.31Å; W73-Y151 HydrophobicContact CB-CG 3.87Å; W73-L214 HydrophobicContact CD2-CD2 3.48Å; W73-L214 VanDerWaalsContact CD2-CD2 3.48Å; W73-L214 HydrophobicContact CE3-CD2 3.68Å; W73-L214 HydrophobicContact CG-CD2 4.02Å; W73-L214 HydrophobicContact CH2-CD2 3.92Å; W73-L214 HydrophobicContact CZ2-CD2 3.73Å; W73-L214 HydrophobicContact CZ3-CD2 3.9Å; W73-F216 HydrophobicContact CZ2-CE1 4.13Å; W73-F216 AromaticContact NE1-CE1 3.73Å | ||
| 74 | A | 86.6 | Confident | 86.2 | Confident | 15 Ų | 15 | 45.7 Ų | 45.7 | 12% | 0.124 | 22% | 0.223 | C | C | . | . | S | Bend | trans | -63.5 | 153.4 | -179.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | E148 D154 | A74-E148 WeakPolarHBondContact CB-OE2 3.06Å; A74-E148 PolarHBondContact N-OE2 3.24Å; A74-D154 WeakPolarHBondContact CA-OD2 3.46Å |
| 75 | R | 84.6 | Confident | 86.5 | Confident | 11 Ų | 11 | 44.2 Ų | 44.2 | 4% | 0.042 | 22% | 0.22 | C | C | . | . | trans | -70.3 | 140.6 | 171.1 | -74.7 | -175.4 | 176.4 | 115.1 | -7.1 | 110.1 | D154 N158 | R75-D154 WeakPolarHBondContact CB-OD2 3.24Å; R75-D154 WeakPolarHBondContact CD-OD1 3.1Å; R75-D154 WeakPolarHBondContact CG-OD1 3.4Å; R75-D154 WeakPolarHBondContact CG-OD2 3.25Å; R75-D154 PolarHBondContact N-OD2 3.47Å; R75-D154 IonicContact NH1-OD1 3.93Å; R75-D154 PolarHBondContact NH1-OD1 3.25Å; R75-N158 VanDerWaalsContact CZ-OD1 3.25Å; R75-N158 PolarHBondContact NH1-OD1 3.06Å; R75-N158 PolarHBondContact NH2-OD1 3.47Å | ||
| 76 | D | 80.1 | Confident | 86.9 | Confident | 31 Ų | 31 | 42.8 Ų | 42.8 | 17% | 0.166 | 22% | 0.22 | C | C | . | . | trans | -106.3 | -13.3 | 178.5 | -104.4 | 10.8 | 0 | 0 | 0 | 112.4 | K29 R33 Q72 | K29-D76 IonicContact NZ-OD2 3.93Å; R33-D76 PolarHBondContact NH1-O 2.85Å; R33-D76 IonicContact NH1-OD2 2.68Å; Q72-D76 PolarHBondContact NE2-OD1 3.27Å; Q72-D76 PolarHBondContact NE2-OD2 3.31Å; Q72-D76 PolarHBondContact OE1-OD1 2.95Å | ||
| 77 | D | 81.6 | Confident | 87.3 | Confident | 24 Ų | 24 | 45.7 Ų | 45.7 | 13% | 0.128 | 23% | 0.23 | C | C | . | . | trans | -104.3 | 132.7 | -178.8 | 65.7 | -74 | 0 | 0 | 0 | 110.1 | A79 | D77-A79 VanDerWaalsContact C-N 3.28Å; D77-A79 PolarHBondContact O-N 2.95Å | ||
| 78 | P | 86.3 | Confident | 87.6 | Confident | 2 Ų | 2 | 43.1 Ų | 43.1 | 1% | 0.013 | 22% | 0.219 | C | C | . | . | trans | -84.6 | 1.2 | 179.1 | 34.1 | -36.5 | 0 | 0 | 0 | 113.3 | Y30 R33 L34 M40 F80 L81 V82 | Y30-P78 HydrophobicContact CE1-CB 4.42Å; Y30-P78 HydrophobicContact CE2-CB 4.39Å; R33-P78 HydrophobicContact CB-CG 4.15Å; L34-P78 HydrophobicContact CB-CB 4.26Å; L34-P78 HydrophobicContact CD1-CB 4.29Å; L34-P78 HydrophobicContact CG-CB 4.37Å; M40-P78 HydrophobicContact CE-CG 3.72Å; M40-P78 HydrophobicContact CG-CG 4.01Å; M40-P78 HydrophobicContact SD-CG 3.96Å; P78-F80 VanDerWaalsContact C-N 3.33Å; P78-F80 PolarHBondContact O-N 3.4Å; P78-L81 PolarHBondContact O-N 3.37Å; P78-L81 VanDerWaalsContact O-N 3.1Å; P78-V82 WeakPolarHBondContact O-CG2 3.37Å; P78-V82 PolarHBondContact O-N 2.91Å | ||
| 79 | A | 89.3 | Confident | 88 | Confident | 0 Ų | 0 | 38 Ų | 38 | 0% | 0 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -57.1 | -43.1 | -170.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | M40 F42 A45 D77 L81 V82 L83 | M40-A79 HydrophobicContact CB-CB 4.03Å; F42-A79 HydrophobicContact CD1-CB 4.35Å; A45-A79 HydrophobicContact CB-CB 3.79Å; D77-A79 VanDerWaalsContact C-N 3.28Å; D77-A79 PolarHBondContact O-N 2.95Å; A79-L81 PolarHBondContact O-N 2.94Å; A79-V82 PolarHBondContact O-N 3.06Å; A79-L83 WeakPolarHBondContact O-CG 3.39Å; A79-L83 PolarHBondContact O-N 2.9Å |
| 80 | F | 90.2 | Very high | 88.4 | Confident | 1 Ų | 1 | 36.4 Ų | 36.4 | 0% | 0.004 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -61 | -44.6 | 177.2 | -173.6 | -85.9 | 0 | 0 | 0 | 112.4 | A45 Q48 M49 L52 P78 L83 L84 L157 Y161 | A45-F80 HydrophobicContact CB-CB 4.39Å; Q48-F80 HydrophobicContact CB-CD2 4.39Å; M49-F80 HydrophobicContact CE-CD2 4.15Å; M49-F80 HydrophobicContact CE-CE1 4.5Å; M49-F80 HydrophobicContact CE-CE2 4.05Å; M49-F80 HydrophobicContact CE-CG 4.44Å; M49-F80 HydrophobicContact CE-CZ 4.22Å; M49-F80 WeakPolarHBondContact CE-O 3.48Å; M49-F80 HydrophobicContact CG-CD2 4.04Å; M49-F80 HydrophobicContact CG-CE2 3.59Å; M49-F80 HydrophobicContact CG-CZ 4.33Å; L52-F80 HydrophobicContact CD1-CE2 3.94Å; L52-F80 HydrophobicContact CD1-CZ 3.9Å; P78-F80 VanDerWaalsContact C-N 3.33Å; P78-F80 PolarHBondContact O-N 3.4Å; F80-L83 PolarHBondContact O-N 3.31Å; F80-L84 HydrophobicContact CE1-CD2 4.49Å; F80-L84 VanDerWaalsContact O-CB 3.29Å; F80-L84 WeakPolarHBondContact O-CB 3.36Å; F80-L84 PolarHBondContact O-N 3.41Å; F80-L157 HydrophobicContact CD1-CB 4.39Å; F80-L157 HydrophobicContact CE1-CB 3.95Å; F80-Y161 HydrophobicContact CZ-CG 4.49Å |
| 81 | L | 90.4 | Very high | 89 | Confident | 25 Ų | 25 | 30.4 Ų | 30.4 | 13% | 0.131 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -67.2 | -39.1 | 179.7 | -173.4 | 155.4 | 0 | 0 | 0 | 111.3 | L34 P78 A79 L84 S85 F153 L157 | L34-L81 HydrophobicContact CD1-CD2 4.15Å; P78-L81 PolarHBondContact O-N 3.37Å; P78-L81 VanDerWaalsContact O-N 3.1Å; A79-L81 PolarHBondContact O-N 2.94Å; L81-L84 PolarHBondContact O-N 3.17Å; L81-S85 WeakPolarHBondContact O-CB 3.47Å; L81-S85 PolarHBondContact O-N 3.45Å; L81-S85 PolarHBondContact O-OG 3.37Å; L81-F153 HydrophobicContact CD1-CE1 4.46Å; L81-L157 HydrophobicContact CD1-CD1 4.38Å |
| 82 | V | 90.4 | Very high | 89.4 | Confident | 19 Ų | 19 | 25 Ų | 25 | 12% | 0.115 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -62.9 | -48.5 | 175.6 | 172.1 | 0 | 0 | 0 | 0 | 110.7 | F37 M40 F42 P78 A79 L84 S85 I86 | F37-V82 HydrophobicContact CE1-CG1 4.09Å; M40-V82 HydrophobicContact CE-CG2 4.17Å; M40-V82 HydrophobicContact SD-CG2 3.92Å; F42-V82 HydrophobicContact CE1-CB 4.44Å; F42-V82 HydrophobicContact CE1-CG1 4.07Å; F42-V82 HydrophobicContact CZ-CG1 4.42Å; P78-V82 WeakPolarHBondContact O-CG2 3.37Å; P78-V82 PolarHBondContact O-N 2.91Å; A79-V82 PolarHBondContact O-N 3.06Å; V82-L84 VanDerWaalsContact C-N 3.33Å; V82-L84 PolarHBondContact O-N 2.92Å; V82-S85 WeakPolarHBondContact O-CB 3.37Å; V82-S85 PolarHBondContact O-N 3.16Å; V82-I86 HydrophobicContact CG1-CD1 4.42Å; V82-I86 WeakPolarHBondContact O-CG1 3.33Å; V82-I86 PolarHBondContact O-N 3.04Å |
| 83 | L | 92.4 | Very high | 89.7 | Confident | 21 Ų | 21 | 28.6 Ų | 28.6 | 11% | 0.11 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -60.1 | -44.4 | 175.4 | -72.5 | 173.3 | 0 | 0 | 0 | 111.2 | F42 A45 L46 M49 A79 F80 S85 I86 W87 | F42-L83 HydrophobicContact CD1-CD1 4.24Å; F42-L83 HydrophobicContact CD1-CD2 4.05Å; F42-L83 HydrophobicContact CD1-CG 3.97Å; F42-L83 HydrophobicContact CE1-CD2 4.48Å; F42-L83 HydrophobicContact CE1-CG 4.39Å; A45-L83 HydrophobicContact CB-CD1 3.63Å; L46-L83 HydrophobicContact CD2-CD1 3.96Å; L46-L83 HydrophobicContact CD2-CD2 4.33Å; L46-L83 HydrophobicContact CG-CD1 3.88Å; M49-L83 HydrophobicContact CE-CB 3.5Å; M49-L83 HydrophobicContact SD-CB 3.81Å; M49-L83 HydrophobicContact SD-CD1 4.13Å; A79-L83 WeakPolarHBondContact O-CG 3.39Å; A79-L83 PolarHBondContact O-N 2.9Å; F80-L83 PolarHBondContact O-N 3.31Å; L83-S85 VanDerWaalsContact C-N 3.26Å; L83-S85 PolarHBondContact O-N 3.29Å; L83-I86 HydrophobicContact CD2-CD1 4.5Å; L83-I86 WeakPolarHBondContact O-CB 3.44Å; L83-I86 PolarHBondContact O-N 3.33Å; L83-I86 VanDerWaalsContact O-N 3.1Å; L83-W87 PolarHBondContact O-N 3.26Å |
| 84 | L | 92.9 | Very high | 90 | Very high | 1 Ų | 1 | 28.9 Ų | 28.9 | 1% | 0.005 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -59.2 | -39.6 | 177.1 | 179 | 66.1 | 0 | 0 | 0 | 111.4 | M49 F80 L81 V82 I86 W87 L88 L157 F160 Y161 L164 | M49-L84 HydrophobicContact CE-CB 4.08Å; F80-L84 HydrophobicContact CE1-CD2 4.49Å; F80-L84 VanDerWaalsContact O-CB 3.29Å; F80-L84 WeakPolarHBondContact O-CB 3.36Å; F80-L84 PolarHBondContact O-N 3.41Å; L81-L84 PolarHBondContact O-N 3.17Å; V82-L84 VanDerWaalsContact C-N 3.33Å; V82-L84 PolarHBondContact O-N 2.92Å; L84-I86 VanDerWaalsContact C-N 3.35Å; L84-W87 PolarHBondContact O-N 3.34Å; L84-L88 HydrophobicContact CG-CD1 4.25Å; L84-L88 WeakPolarHBondContact O-CG 3.5Å; L84-L88 PolarHBondContact O-N 3.48Å; L84-L157 HydrophobicContact CD2-CD2 3.81Å; L84-F160 HydrophobicContact CD1-CD1 4.18Å; L84-F160 HydrophobicContact CD1-CE1 4.41Å; L84-F160 HydrophobicContact CD2-CD1 4.18Å; L84-Y161 HydrophobicContact CD1-CD2 3.74Å; L84-Y161 HydrophobicContact CD1-CG 4.39Å; L84-L164 HydrophobicContact CD1-CD1 4.09Å |
| 85 | S | 90.6 | Very high | 90.2 | Very high | 37 Ų | 37 | 28.2 Ų | 28.2 | 26% | 0.259 | 15% | 0.154 | S | C | . | . | H | α-helix | trans | -64.5 | -38.5 | 176.1 | -55.6 | 0 | 0 | 0 | 0 | 112 | L81 V82 L83 L88 C89 | L81-S85 WeakPolarHBondContact O-CB 3.47Å; L81-S85 PolarHBondContact O-N 3.45Å; L81-S85 PolarHBondContact O-OG 3.37Å; V82-S85 WeakPolarHBondContact O-CB 3.37Å; V82-S85 PolarHBondContact O-N 3.16Å; L83-S85 VanDerWaalsContact C-N 3.26Å; L83-S85 PolarHBondContact O-N 3.29Å; S85-L88 WeakPolarHBondContact O-CB 3.37Å; S85-L88 PolarHBondContact O-N 3.38Å; S85-C89 PolarHBondContact O-N 3.37Å; S85-C89 PolarHBondContact O-SG 3.38Å |
| 86 | I | 92.1 | Very high | 90.4 | Very high | 91 Ų | 91 | 27.9 Ų | 27.9 | 47% | 0.467 | 15% | 0.154 | S | C | . | . | H | α-helix | trans | -61.9 | -46 | 173.6 | -66 | 166.5 | 0 | 0 | 0 | 110.3 | V82 L83 L84 L88 C89 V90 | V82-I86 HydrophobicContact CG1-CD1 4.42Å; V82-I86 WeakPolarHBondContact O-CG1 3.33Å; V82-I86 PolarHBondContact O-N 3.04Å; L83-I86 HydrophobicContact CD2-CD1 4.5Å; L83-I86 WeakPolarHBondContact O-CB 3.44Å; L83-I86 PolarHBondContact O-N 3.33Å; L83-I86 VanDerWaalsContact O-N 3.1Å; L84-I86 VanDerWaalsContact C-N 3.35Å; I86-L88 VanDerWaalsContact C-N 3.35Å; I86-L88 PolarHBondContact O-N 2.9Å; I86-C89 WeakPolarHBondContact O-CB 3.41Å; I86-C89 PolarHBondContact O-N 3.1Å; I86-V90 HydrophobicContact CG2-CG2 4.46Å; I86-V90 WeakPolarHBondContact O-CG2 3.4Å; I86-V90 PolarHBondContact O-N 3.18Å |
| 87 | W | 93.6 | Very high | 90.8 | Very high | 88 Ų | 88 | 32.6 Ų | 32.6 | 33% | 0.333 | 18% | 0.179 | S | C | . | . | H | α-helix | trans | -60.7 | -42 | 176 | -74 | 106.9 | 0 | 0 | 0 | 112.2 | L83 L84 V90 S91 Y161 L164 F169 | L83-W87 PolarHBondContact O-N 3.26Å; L84-W87 PolarHBondContact O-N 3.34Å; W87-V90 PolarHBondContact O-N 3.09Å; W87-S91 VanDerWaalsContact O-CB 3.28Å; W87-S91 WeakPolarHBondContact O-CB 3.42Å; W87-S91 PolarHBondContact O-N 2.93Å; W87-S91 PolarHBondContact O-OG 3.3Å; W87-Y161 AromaticContact CD1-CE2 3.71Å; W87-Y161 HydrophobicContact CD2-CE2 4.35Å; W87-Y161 AromaticContact CG-CE2 4Å; W87-Y161 HydrophobicContact CG-CE2 4Å; W87-Y161 AromaticContact NE1-CE2 3.96Å; W87-L164 HydrophobicContact CB-CD2 4.2Å; W87-F169 HydrophobicContact CB-CE2 4.38Å; W87-F169 HydrophobicContact CD2-CZ 4.45Å; W87-F169 HydrophobicContact CE3-CD1 4.42Å; W87-F169 HydrophobicContact CE3-CD2 4.22Å; W87-F169 AromaticContact CE3-CE1 3.8Å; W87-F169 HydrophobicContact CE3-CE1 3.8Å; W87-F169 AromaticContact CE3-CE2 3.53Å; W87-F169 HydrophobicContact CE3-CE2 3.53Å; W87-F169 AromaticContact CE3-CZ 3.33Å; W87-F169 HydrophobicContact CE3-CZ 3.33Å; W87-F169 HydrophobicContact CZ3-CD1 4.19Å; W87-F169 AromaticContact CZ3-CE1 3.79Å; W87-F169 HydrophobicContact CZ3-CE1 3.79Å; W87-F169 HydrophobicContact CZ3-CE2 4.22Å; W87-F169 AromaticContact CZ3-CZ 3.84Å; W87-F169 HydrophobicContact CZ3-CZ 3.84Å; W87-F169 WeakPolarHBondContact O-CE2 3.49Å; W87-F169 WeakPolarHBondContact O-CZ 3.41Å |
| 88 | L | 93 | Very high | 91.1 | Very high | 0 Ų | 0 | 32.6 Ų | 32.6 | 0% | 0 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -58.8 | -47 | 173.8 | -75.7 | 162.5 | 0 | 0 | 0 | 111.5 | L84 S85 I86 S91 T92 V113 V114 C118 F160 L164 | L84-L88 HydrophobicContact CG-CD1 4.25Å; L84-L88 WeakPolarHBondContact O-CG 3.5Å; L84-L88 PolarHBondContact O-N 3.48Å; S85-L88 WeakPolarHBondContact O-CB 3.37Å; S85-L88 PolarHBondContact O-N 3.38Å; I86-L88 VanDerWaalsContact C-N 3.35Å; I86-L88 PolarHBondContact O-N 2.9Å; L88-S91 PolarHBondContact O-N 2.84Å; L88-S91 PolarHBondContact O-OG 3.32Å; L88-T92 WeakPolarHBondContact O-CB 3.32Å; L88-T92 PolarHBondContact O-N 2.96Å; L88-T92 PolarHBondContact O-OG1 2.92Å; L88-V113 HydrophobicContact CD2-CG1 3.46Å; L88-V113 VanDerWaalsContact CD2-CG1 3.46Å; L88-V114 HydrophobicContact CB-CG2 4.29Å; L88-V114 HydrophobicContact CD1-CG2 4.4Å; L88-C118 HydrophobicContact CD1-CB 3.87Å; L88-F160 HydrophobicContact CD2-CE1 4.06Å; L88-F160 HydrophobicContact CD2-CZ 4.21Å; L88-L164 HydrophobicContact CD2-CD1 3.24Å; L88-L164 HydrophobicContact CD2-CG 4.5Å; L88-L164 HydrophobicContact CG-CD1 3.55Å |
| 89 | C | 93.5 | Very high | 91.1 | Very high | 49 Ų | 49 | 33.2 Ų | 33.2 | 33% | 0.331 | 18% | 0.183 | S | C | . | . | H | α-helix | trans | -58.6 | -52.4 | 176.9 | -69.5 | 0 | 0 | 0 | 0 | 112.1 | S85 I86 S91 T92 I93 L110 | S85-C89 PolarHBondContact O-N 3.37Å; S85-C89 PolarHBondContact O-SG 3.38Å; I86-C89 WeakPolarHBondContact O-CB 3.41Å; I86-C89 PolarHBondContact O-N 3.1Å; C89-S91 VanDerWaalsContact C-N 3.3Å; C89-S91 PolarHBondContact O-N 2.85Å; C89-T92 PolarHBondContact O-N 3.24Å; C89-I93 WeakPolarHBondContact O-CG1 3.31Å; C89-I93 PolarHBondContact O-N 2.86Å; C89-L110 HydrophobicContact CB-CD1 4.33Å |
| 90 | V | 93.9 | Very high | 91 | Very high | 75 Ų | 75 | 41.7 Ų | 41.7 | 46% | 0.455 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -59.6 | -43.9 | -179.9 | 173.6 | 0 | 0 | 0 | 0 | 110.6 | I86 W87 T92 I93 G94 F169 | I86-V90 HydrophobicContact CG2-CG2 4.46Å; I86-V90 WeakPolarHBondContact O-CG2 3.4Å; I86-V90 PolarHBondContact O-N 3.18Å; W87-V90 PolarHBondContact O-N 3.09Å; V90-T92 PolarHBondContact O-N 2.98Å; V90-I93 PolarHBondContact O-N 3.28Å; V90-G94 PolarHBondContact O-N 3.33Å; V90-F169 HydrophobicContact CB-CE1 4.4Å; V90-F169 HydrophobicContact CB-CZ 4.01Å; V90-F169 HydrophobicContact CG1-CE1 3.71Å; V90-F169 HydrophobicContact CG1-CZ 3.83Å |
| 91 | S | 92.4 | Very high | 90.9 | Very high | 1 Ų | 1 | 42.8 Ų | 42.8 | 1% | 0.007 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -64.8 | -39.1 | 179.8 | 79 | 0 | 0 | 0 | 0 | 113 | W87 L88 C89 G94 F95 F169 | W87-S91 VanDerWaalsContact O-CB 3.28Å; W87-S91 WeakPolarHBondContact O-CB 3.42Å; W87-S91 PolarHBondContact O-N 2.93Å; W87-S91 PolarHBondContact O-OG 3.3Å; L88-S91 PolarHBondContact O-N 2.84Å; L88-S91 PolarHBondContact O-OG 3.32Å; C89-S91 VanDerWaalsContact C-N 3.3Å; C89-S91 PolarHBondContact O-N 2.85Å; S91-G94 WeakPolarHBondContact O-CA 3.37Å; S91-G94 PolarHBondContact O-N 3.35Å; S91-G94 VanDerWaalsContact O-N 3.15Å; S91-F95 WeakPolarHBondContact O-CD2 3.25Å; S91-F95 PolarHBondContact O-N 2.97Å; S91-F169 VanDerWaalsContact CB-CE2 3.44Å |
| 92 | T | 92.7 | Very high | 91 | Very high | 2 Ų | 2 | 43.3 Ų | 43.3 | 1% | 0.012 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -68.2 | -39.8 | 179.8 | -55.4 | 0 | 0 | 0 | 0 | 111.2 | L88 C89 V90 G94 F95 G96 T106 L109 L110 | L88-T92 WeakPolarHBondContact O-CB 3.32Å; L88-T92 PolarHBondContact O-N 2.96Å; L88-T92 PolarHBondContact O-OG1 2.92Å; C89-T92 PolarHBondContact O-N 3.24Å; V90-T92 PolarHBondContact O-N 2.98Å; T92-G94 VanDerWaalsContact C-N 3.27Å; T92-G94 PolarHBondContact O-N 3.31Å; T92-F95 PolarHBondContact O-N 3.26Å; T92-G96 PolarHBondContact O-N 2.87Å; T92-T106 HydrophobicContact CG2-CG2 4.4Å; T92-L109 HydrophobicContact CG2-CB 3.97Å; T92-L109 HydrophobicContact CG2-CD2 3.94Å; T92-L109 HydrophobicContact CG2-CG 3.84Å; T92-L110 HydrophobicContact CG2-CB 3.87Å; T92-L110 HydrophobicContact CG2-CD1 4.33Å |
| 93 | I | 92.6 | Very high | 91.1 | Very high | 98 Ų | 98 | 48.6 Ų | 48.6 | 50% | 0.503 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -59.8 | -43.7 | 171.8 | -66.5 | 165.8 | 0 | 0 | 0 | 109.6 | C89 V90 F95 G96 L97 | C89-I93 WeakPolarHBondContact O-CG1 3.31Å; C89-I93 PolarHBondContact O-N 2.86Å; V90-I93 PolarHBondContact O-N 3.28Å; I93-F95 PolarHBondContact O-N 3.46Å; I93-G96 PolarHBondContact O-N 2.85Å; I93-L97 HydrophobicContact CG2-CD1 4.23Å; I93-L97 HydrophobicContact CG2-CG 4.49Å; I93-L97 WeakPolarHBondContact O-CG 3.5Å; I93-L97 PolarHBondContact O-N 3.5Å |
| 94 | G | 91.3 | Very high | 91.2 | Very high | 15 Ų | 15 | 52.6 Ų | 52.6 | 16% | 0.155 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -55.9 | -47.1 | 174.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | V90 S91 T92 L97 V98 | V90-G94 PolarHBondContact O-N 3.33Å; S91-G94 WeakPolarHBondContact O-CA 3.37Å; S91-G94 PolarHBondContact O-N 3.35Å; S91-G94 VanDerWaalsContact O-N 3.15Å; T92-G94 VanDerWaalsContact C-N 3.27Å; T92-G94 PolarHBondContact O-N 3.31Å; G94-L97 PolarHBondContact O-N 2.87Å; G94-V98 WeakPolarHBondContact O-CB 3.37Å; G94-V98 WeakPolarHBondContact O-CG2 3.49Å; G94-V98 PolarHBondContact O-N 3.37Å |
| 95 | F | 89.5 | Confident | 91.2 | Very high | 1 Ų | 1 | 55.4 Ų | 55.4 | 0% | 0.004 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -63.4 | -41.1 | 173.8 | -87.4 | -75.9 | 0 | 0 | 0 | 112.9 | S91 T92 I93 L97 V98 L99 L109 H168 L172 I175 Y252 | S91-F95 WeakPolarHBondContact O-CD2 3.25Å; S91-F95 PolarHBondContact O-N 2.97Å; T92-F95 PolarHBondContact O-N 3.26Å; I93-F95 PolarHBondContact O-N 3.46Å; F95-L97 VanDerWaalsContact C-N 3.29Å; F95-L97 PolarHBondContact O-N 3.23Å; F95-V98 PolarHBondContact O-N 3.45Å; F95-L99 HydrophobicContact CD1-CD1 4.02Å; F95-L99 HydrophobicContact CD1-CG 4.39Å; F95-L99 VanDerWaalsContact O-CB 3.26Å; F95-L99 WeakPolarHBondContact O-CB 3.02Å; F95-L99 WeakPolarHBondContact O-CG 3.48Å; F95-L99 PolarHBondContact O-N 3.24Å; F95-L109 HydrophobicContact CB-CD2 4.13Å; F95-H168 HydrophobicContact CE2-CB 3.73Å; F95-H168 AromaticContact CE2-CD2 3.54Å; F95-H168 AromaticContact CE2-CG 3.65Å; F95-L172 HydrophobicContact CD1-CD1 3.78Å; F95-L172 HydrophobicContact CD2-CD1 4.21Å; F95-L172 HydrophobicContact CE1-CD1 3.89Å; F95-L172 HydrophobicContact CE2-CD1 4.31Å; F95-L172 HydrophobicContact CG-CD1 3.95Å; F95-L172 HydrophobicContact CZ-CD1 4.15Å; F95-I175 HydrophobicContact CE1-CD1 3.95Å; F95-Y252 HydrophobicContact CD1-CD2 4.12Å; F95-Y252 HydrophobicContact CD1-CE2 4.22Å; F95-Y252 HydrophobicContact CD2-CE2 4.38Å; F95-Y252 HydrophobicContact CE1-CD2 4.32Å; F95-Y252 HydrophobicContact CE1-CE2 4.15Å; F95-Y252 HydrophobicContact CE2-CE2 4.31Å; F95-Y252 HydrophobicContact CG-CD2 4.43Å; F95-Y252 HydrophobicContact CG-CE2 4.33Å; F95-Y252 HydrophobicContact CZ-CE2 4.2Å |
| 96 | G | 89.9 | Confident | 91.4 | Very high | 4 Ų | 4 | 54.9 Ų | 54.9 | 4% | 0.041 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -58.9 | -41.8 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112 | T92 I93 E100 M101 | T92-G96 PolarHBondContact O-N 2.87Å; I93-G96 PolarHBondContact O-N 2.85Å; G96-E100 PolarHBondContact O-N 3.15Å; G96-M101 PolarHBondContact O-N 3.5Å |
| 97 | L | 89.4 | Confident | 91.5 | Very high | 130 Ų | 130 | 55.2 Ų | 55.2 | 68% | 0.681 | 31% | 0.307 | S | S | * | . | H | α-helix | trans | -68.5 | -45 | 175.7 | -66.9 | 174.1 | 0 | 0 | 0 | 112.5 | I93 G94 F95 E100 | I93-L97 HydrophobicContact CG2-CD1 4.23Å; I93-L97 HydrophobicContact CG2-CG 4.49Å; I93-L97 WeakPolarHBondContact O-CG 3.5Å; I93-L97 PolarHBondContact O-N 3.5Å; G94-L97 PolarHBondContact O-N 2.87Å; F95-L97 VanDerWaalsContact C-N 3.29Å; F95-L97 PolarHBondContact O-N 3.23Å; L97-E100 PolarHBondContact O-N 3.01Å |
| 98 | V | 87.1 | Confident | 91.5 | Very high | 25 Ų | 25 | 55.5 Ų | 55.5 | 15% | 0.152 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -70.9 | -35.9 | -177 | 166.3 | 0 | 0 | 0 | 0 | 112.5 | G94 F95 E100 L172 I175 N176 | G94-V98 WeakPolarHBondContact O-CB 3.37Å; G94-V98 WeakPolarHBondContact O-CG2 3.49Å; G94-V98 PolarHBondContact O-N 3.37Å; F95-V98 PolarHBondContact O-N 3.45Å; V98-E100 VanDerWaalsContact C-N 3.3Å; V98-L172 HydrophobicContact CB-CD1 3.85Å; V98-L172 HydrophobicContact CG1-CD1 4.08Å; V98-L172 HydrophobicContact CG2-CD1 3.7Å; V98-L172 HydrophobicContact CG2-CG 4Å; V98-I175 HydrophobicContact CG1-CB 4.03Å; V98-I175 HydrophobicContact CG1-CG2 3.51Å; V98-N176 HydrophobicContact CG1-CB 4.3Å |
| 99 | L | 86.1 | Confident | 91.5 | Very high | 15 Ų | 15 | 55.6 Ų | 55.6 | 8% | 0.079 | 31% | 0.311 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -89 | 3.1 | -179.5 | -60.9 | 178.4 | 0 | 0 | 0 | 113.2 | F95 M101 C249 | F95-L99 HydrophobicContact CD1-CD1 4.02Å; F95-L99 HydrophobicContact CD1-CG 4.39Å; F95-L99 VanDerWaalsContact O-CB 3.26Å; F95-L99 WeakPolarHBondContact O-CB 3.02Å; F95-L99 WeakPolarHBondContact O-CG 3.48Å; F95-L99 PolarHBondContact O-N 3.24Å; L99-M101 VanDerWaalsContact C-N 3.33Å; L99-M101 HydrophobicContact CB-CG 3.79Å; L99-M101 HydrophobicContact CB-SD 3.83Å; L99-M101 HydrophobicContact CD1-SD 3.93Å; L99-M101 HydrophobicContact CG-SD 4.49Å; L99-M101 PolarHBondContact O-N 3.35Å; L99-C249 HydrophobicContact CD2-CB 4.17Å |
| 100 | E | 87.6 | Confident | 91.5 | Very high | 178 Ų | 178 | 55.3 Ų | 55.3 | 83% | 0.832 | 31% | 0.306 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 56 | 43 | -178 | -59.5 | 179.6 | 179.2 | 0 | 0 | 113 | G96 L97 V98 | G96-E100 PolarHBondContact O-N 3.15Å; L97-E100 PolarHBondContact O-N 3.01Å; V98-E100 VanDerWaalsContact C-N 3.3Å |
| 101 | M | 88.5 | Confident | 91.5 | Very high | 23 Ų | 23 | 55.9 Ų | 55.9 | 11% | 0.113 | 31% | 0.306 | C | S | . | . | trans | -85.5 | 147.2 | -176.7 | -63.3 | 171 | 55.4 | 0 | 0 | 112 | G96 L99 E105 L109 V256 | G96-M101 PolarHBondContact O-N 3.5Å; L99-M101 VanDerWaalsContact C-N 3.33Å; L99-M101 HydrophobicContact CB-CG 3.79Å; L99-M101 HydrophobicContact CB-SD 3.83Å; L99-M101 HydrophobicContact CD1-SD 3.93Å; L99-M101 HydrophobicContact CG-SD 4.49Å; L99-M101 PolarHBondContact O-N 3.35Å; M101-E105 WeakPolarHBondContact CA-OE2 3.27Å; M101-E105 HydrophobicContact CB-CB 4.13Å; M101-E105 HydrophobicContact CE-CB 3.8Å; M101-L109 HydrophobicContact CE-CB 4.11Å; M101-L109 HydrophobicContact CE-CD2 3.94Å; M101-L109 HydrophobicContact SD-CD2 4.11Å; M101-V256 HydrophobicContact CE-CB 3.91Å; M101-V256 HydrophobicContact CE-CG1 3.9Å; M101-V256 HydrophobicContact CE-CG2 3.37Å; M101-V256 HydrophobicContact SD-CG2 4.44Å | ||
| 102 | G | 92.3 | Very high | 91.5 | Very high | 37 Ų | 37 | 59.4 Ų | 59.4 | 38% | 0.381 | 32% | 0.319 | S | S | . | . | trans | -66.5 | 165.2 | 172.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | V104 E105 T106 | G102-V104 VanDerWaalsContact C-N 3.31Å; G102-V104 PolarHBondContact O-N 2.84Å; G102-E105 PolarHBondContact N-OE2 2.94Å; G102-E105 PolarHBondContact O-N 2.97Å; G102-T106 WeakPolarHBondContact O-CB 3.5Å; G102-T106 PolarHBondContact O-N 3.42Å; G102-T106 PolarHBondContact O-OG1 3.25Å | ||
| 103 | V | 92.5 | Very high | 91.5 | Very high | 130 Ų | 130 | 59.5 Ų | 59.5 | 79% | 0.788 | 32% | 0.32 | S | S | * | . | H | α-helix | trans | -60.1 | -41.6 | 178.6 | 178.2 | 0 | 0 | 0 | 0 | 111.7 | T106 L107 | V103-T106 PolarHBondContact O-N 3.46Å; V103-L107 WeakPolarHBondContact O-CB 3.36Å; V103-L107 PolarHBondContact O-N 3.25Å |
| 104 | V | 93.8 | Very high | 91.4 | Very high | 104 Ų | 104 | 56.1 Ų | 56.1 | 63% | 0.63 | 30% | 0.304 | S | S | * | . | H | α-helix | trans | -66.4 | -41.9 | 179.2 | 178.9 | 0 | 0 | 0 | 0 | 111.1 | G102 L107 K108 | G102-V104 VanDerWaalsContact C-N 3.31Å; G102-V104 PolarHBondContact O-N 2.84Å; V104-L107 PolarHBondContact O-N 3.22Å; V104-K108 WeakPolarHBondContact O-CG 3.38Å; V104-K108 PolarHBondContact O-N 3.05Å |
| 105 | E | 93.3 | Very high | 91.5 | Very high | 61 Ų | 61 | 61.8 Ų | 61.8 | 29% | 0.285 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -65.6 | -42.3 | 177.9 | -63.4 | 174.8 | 166.6 | 0 | 0 | 111.2 | M101 G102 L107 K108 L109 V256 | M101-E105 WeakPolarHBondContact CA-OE2 3.27Å; M101-E105 HydrophobicContact CB-CB 4.13Å; M101-E105 HydrophobicContact CE-CB 3.8Å; G102-E105 PolarHBondContact N-OE2 2.94Å; G102-E105 PolarHBondContact O-N 2.97Å; E105-L107 VanDerWaalsContact C-N 3.31Å; E105-L107 PolarHBondContact O-N 2.98Å; E105-K108 PolarHBondContact O-N 2.77Å; E105-L109 WeakPolarHBondContact O-CB 3.32Å; E105-L109 PolarHBondContact O-N 2.79Å; E105-V256 HydrophobicContact CB-CB 3.98Å; E105-V256 HydrophobicContact CB-CG2 4.08Å; E105-V256 HydrophobicContact CG-CB 4.44Å; E105-V256 HydrophobicContact CG-CG2 4.48Å |
| 106 | T | 93.6 | Very high | 91.6 | Very high | 25 Ų | 25 | 64.3 Ų | 64.3 | 15% | 0.153 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -62.8 | -39 | 174.9 | -56.4 | 0 | 0 | 0 | 0 | 111.1 | T92 G102 V103 L109 L110 | T92-T106 HydrophobicContact CG2-CG2 4.4Å; G102-T106 WeakPolarHBondContact O-CB 3.5Å; G102-T106 PolarHBondContact O-N 3.42Å; G102-T106 PolarHBondContact O-OG1 3.25Å; V103-T106 PolarHBondContact O-N 3.46Å; T106-L109 PolarHBondContact O-N 3.38Å; T106-L110 WeakPolarHBondContact O-CB 3.28Å; T106-L110 PolarHBondContact O-N 3.4Å |
| 107 | L | 94.4 | Very high | 91.6 | Very high | 98 Ų | 98 | 65.9 Ų | 65.9 | 51% | 0.513 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -66.5 | -43.1 | 174.5 | -178.4 | 62.4 | 0 | 0 | 0 | 112 | V103 V104 E105 L109 L110 L111 | V103-L107 WeakPolarHBondContact O-CB 3.36Å; V103-L107 PolarHBondContact O-N 3.25Å; V104-L107 PolarHBondContact O-N 3.22Å; E105-L107 VanDerWaalsContact C-N 3.31Å; E105-L107 PolarHBondContact O-N 2.98Å; L107-L109 VanDerWaalsContact C-N 3.32Å; L107-L109 PolarHBondContact O-N 3.05Å; L107-L110 PolarHBondContact O-N 3.39Å; L107-L111 WeakPolarHBondContact O-CG 3.35Å; L107-L111 PolarHBondContact O-N 2.84Å |
| 108 | K | 94.2 | Very high | 91.7 | Very high | 95 Ų | 95 | 60 Ų | 60 | 41% | 0.413 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -58.4 | -45.2 | 173.1 | -72.6 | 178.4 | -174.5 | 175.5 | 0 | 110.9 | V104 E105 L110 L111 W112 V256 | V104-K108 WeakPolarHBondContact O-CG 3.38Å; V104-K108 PolarHBondContact O-N 3.05Å; E105-K108 PolarHBondContact O-N 2.77Å; K108-L110 VanDerWaalsContact C-N 3.33Å; K108-L110 PolarHBondContact O-N 3.26Å; K108-L111 PolarHBondContact O-N 3.46Å; K108-W112 WeakPolarHBondContact O-CB 3.41Å; K108-W112 PolarHBondContact O-N 2.92Å; K108-V256 HydrophobicContact CB-CG1 4.21Å; K108-V256 WeakPolarHBondContact CD-O 3.37Å; K108-V256 PolarHBondContact NZ-O 2.84Å |
| 109 | L | 93.4 | Very high | 91.9 | Very high | 2 Ų | 2 | 61.2 Ų | 61.2 | 1% | 0.01 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -60.3 | -43.7 | 177.2 | -171.4 | 59.2 | 0 | 0 | 0 | 111.2 | T92 F95 M101 E105 T106 L107 L111 W112 V113 Y252 V256 | T92-L109 HydrophobicContact CG2-CB 3.97Å; T92-L109 HydrophobicContact CG2-CD2 3.94Å; T92-L109 HydrophobicContact CG2-CG 3.84Å; F95-L109 HydrophobicContact CB-CD2 4.13Å; M101-L109 HydrophobicContact CE-CB 4.11Å; M101-L109 HydrophobicContact CE-CD2 3.94Å; M101-L109 HydrophobicContact SD-CD2 4.11Å; E105-L109 WeakPolarHBondContact O-CB 3.32Å; E105-L109 PolarHBondContact O-N 2.79Å; T106-L109 PolarHBondContact O-N 3.38Å; L107-L109 VanDerWaalsContact C-N 3.32Å; L107-L109 PolarHBondContact O-N 3.05Å; L109-L111 PolarHBondContact O-N 3.35Å; L109-W112 WeakPolarHBondContact O-CB 3.48Å; L109-W112 PolarHBondContact O-N 3.01Å; L109-V113 HydrophobicContact CD1-CG2 4.03Å; L109-V113 HydrophobicContact CG-CG2 4.19Å; L109-V113 WeakPolarHBondContact O-CB 3.26Å; L109-V113 WeakPolarHBondContact O-CG2 3.48Å; L109-V113 PolarHBondContact O-N 3.33Å; L109-Y252 HydrophobicContact CD1-CD1 3.82Å; L109-Y252 HydrophobicContact CD1-CD2 4.16Å; L109-Y252 HydrophobicContact CD1-CE1 4.26Å; L109-Y252 HydrophobicContact CD1-CG 3.77Å; L109-Y252 HydrophobicContact CD2-CD2 4.28Å; L109-V256 HydrophobicContact CB-CG1 3.92Å; L109-V256 HydrophobicContact CD1-CG1 4.32Å |
| 110 | L | 93.9 | Very high | 92.3 | Very high | 42 Ų | 42 | 62.1 Ų | 62.1 | 22% | 0.22 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -60.9 | -47.9 | 179.7 | 178.4 | 63 | 0 | 0 | 0 | 111.5 | C89 T92 T106 L107 K108 W112 V113 V114 | C89-L110 HydrophobicContact CB-CD1 4.33Å; T92-L110 HydrophobicContact CG2-CB 3.87Å; T92-L110 HydrophobicContact CG2-CD1 4.33Å; T106-L110 WeakPolarHBondContact O-CB 3.28Å; T106-L110 PolarHBondContact O-N 3.4Å; L107-L110 PolarHBondContact O-N 3.39Å; K108-L110 VanDerWaalsContact C-N 3.33Å; K108-L110 PolarHBondContact O-N 3.26Å; L110-W112 VanDerWaalsContact C-N 3.29Å; L110-W112 PolarHBondContact O-N 3.04Å; L110-V113 PolarHBondContact O-N 2.91Å; L110-V114 HydrophobicContact CD1-CG2 4.01Å; L110-V114 WeakPolarHBondContact O-CB 3.11Å; L110-V114 VanDerWaalsContact O-CG2 3.3Å; L110-V114 WeakPolarHBondContact O-CG2 3.44Å; L110-V114 PolarHBondContact O-N 3.47Å |
| 111 | L | 93.4 | Very high | 92.6 | Very high | 87 Ų | 87 | 56.6 Ų | 56.6 | 46% | 0.455 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -61.4 | -41.4 | 177.4 | -66.3 | 173.8 | 0 | 0 | 0 | 110.9 | L107 K108 L109 F115 | L107-L111 WeakPolarHBondContact O-CG 3.35Å; L107-L111 PolarHBondContact O-N 2.84Å; K108-L111 PolarHBondContact O-N 3.46Å; L109-L111 PolarHBondContact O-N 3.35Å; L111-F115 HydrophobicContact CB-CD2 4.37Å; L111-F115 HydrophobicContact CD2-CD2 4.12Å; L111-F115 HydrophobicContact CD2-CE2 3.7Å; L111-F115 WeakPolarHBondContact O-CB 3.38Å; L111-F115 VanDerWaalsContact O-CD2 3.28Å; L111-F115 WeakPolarHBondContact O-CD2 3.4Å; L111-F115 PolarHBondContact O-N 3.15Å |
| 112 | W | 92.4 | Very high | 92.9 | Very high | 76 Ų | 76 | 55.5 Ų | 55.5 | 29% | 0.288 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -61.9 | -53.8 | 176.6 | -174 | -81.9 | 0 | 0 | 0 | 112.1 | K108 L109 L110 V114 F115 V116 D117 F251 | K108-W112 WeakPolarHBondContact O-CB 3.41Å; K108-W112 PolarHBondContact O-N 2.92Å; L109-W112 WeakPolarHBondContact O-CB 3.48Å; L109-W112 PolarHBondContact O-N 3.01Å; L110-W112 VanDerWaalsContact C-N 3.29Å; L110-W112 PolarHBondContact O-N 3.04Å; W112-V114 VanDerWaalsContact C-N 3.3Å; W112-V114 PolarHBondContact O-N 3.15Å; W112-F115 PolarHBondContact O-N 2.93Å; W112-V116 HydrophobicContact CD2-CB 4.1Å; W112-V116 HydrophobicContact CD2-CG1 4.48Å; W112-V116 HydrophobicContact CD2-CG2 3.93Å; W112-V116 HydrophobicContact CE3-CG2 3.94Å; W112-V116 HydrophobicContact CG-CB 4.37Å; W112-V116 HydrophobicContact CG-CG2 4.42Å; W112-V116 HydrophobicContact CH2-CG1 4.15Å; W112-V116 HydrophobicContact CH2-CG2 4.26Å; W112-V116 HydrophobicContact CZ2-CB 4.18Å; W112-V116 HydrophobicContact CZ2-CG1 3.65Å; W112-V116 HydrophobicContact CZ2-CG2 4.3Å; W112-V116 HydrophobicContact CZ3-CG2 4.12Å; W112-V116 WeakPolarHBondContact O-CA 3.41Å; W112-V116 VanDerWaalsContact O-CB 3.24Å; W112-V116 WeakPolarHBondContact O-CB 3.45Å; W112-V116 PolarHBondContact O-N 2.95Å; W112-D117 PolarHBondContact NE1-OD1 3.37Å; W112-D117 PolarHBondContact O-N 3.48Å; W112-D117 VanDerWaalsContact O-N 3.16Å; W112-F251 HydrophobicContact CZ2-CZ 4.36Å |
| 113 | V | 92.1 | Very high | 93.1 | Very high | 3 Ų | 3 | 57 Ų | 57 | 2% | 0.018 | 31% | 0.306 | C | S | . | . | I | π-helix | trans | -61.5 | -38.2 | -176.9 | 164.3 | 0 | 0 | 0 | 0 | 111.4 | L88 L109 L110 C118 | L88-V113 HydrophobicContact CD2-CG1 3.46Å; L88-V113 VanDerWaalsContact CD2-CG1 3.46Å; L109-V113 HydrophobicContact CD1-CG2 4.03Å; L109-V113 HydrophobicContact CG-CG2 4.19Å; L109-V113 WeakPolarHBondContact O-CB 3.26Å; L109-V113 WeakPolarHBondContact O-CG2 3.48Å; L109-V113 PolarHBondContact O-N 3.33Å; L110-V113 PolarHBondContact O-N 2.91Å; V113-C118 WeakPolarHBondContact O-CB 3.36Å; V113-C118 PolarHBondContact O-N 2.84Å |
| 114 | V | 91.6 | Very high | 93.3 | Very high | 28 Ų | 28 | 55.8 Ų | 55.8 | 17% | 0.17 | 30% | 0.295 | C | S | . | . | I | π-helix | trans | -74.6 | -56.1 | 177.4 | 173.5 | 0 | 0 | 0 | 0 | 111.5 | L88 L110 W112 C118 I119 | L88-V114 HydrophobicContact CB-CG2 4.29Å; L88-V114 HydrophobicContact CD1-CG2 4.4Å; L110-V114 HydrophobicContact CD1-CG2 4.01Å; L110-V114 WeakPolarHBondContact O-CB 3.11Å; L110-V114 VanDerWaalsContact O-CG2 3.3Å; L110-V114 WeakPolarHBondContact O-CG2 3.44Å; L110-V114 PolarHBondContact O-N 3.47Å; W112-V114 VanDerWaalsContact C-N 3.3Å; W112-V114 PolarHBondContact O-N 3.15Å; V114-C118 WeakPolarHBondContact O-CB 3.3Å; V114-I119 WeakPolarHBondContact O-CG1 3.24Å; V114-I119 PolarHBondContact O-N 3.35Å |
| 115 | F | 92.1 | Very high | 93.4 | Very high | 133 Ų | 133 | 52.9 Ų | 52.9 | 58% | 0.583 | 28% | 0.276 | S | S | * | . | I | π-helix | trans | -82.7 | -35.5 | -169.3 | -69.5 | -69.4 | 0 | 0 | 0 | 113.5 | L111 W112 G120 | L111-F115 HydrophobicContact CB-CD2 4.37Å; L111-F115 HydrophobicContact CD2-CD2 4.12Å; L111-F115 HydrophobicContact CD2-CE2 3.7Å; L111-F115 WeakPolarHBondContact O-CB 3.38Å; L111-F115 VanDerWaalsContact O-CD2 3.28Å; L111-F115 WeakPolarHBondContact O-CD2 3.4Å; L111-F115 PolarHBondContact O-N 3.15Å; W112-F115 PolarHBondContact O-N 2.93Å; F115-G120 PolarHBondContact O-N 2.91Å |
| 116 | V | 92.1 | Very high | 93.5 | Very high | 54 Ų | 54 | 50 Ų | 50 | 33% | 0.327 | 26% | 0.262 | S | S | . | . | I | π-helix | trans | -91.9 | -59.4 | -177.8 | -174 | 0 | 0 | 0 | 0 | 110.2 | W112 G120 V121 | W112-V116 HydrophobicContact CD2-CB 4.1Å; W112-V116 HydrophobicContact CD2-CG1 4.48Å; W112-V116 HydrophobicContact CD2-CG2 3.93Å; W112-V116 HydrophobicContact CE3-CG2 3.94Å; W112-V116 HydrophobicContact CG-CB 4.37Å; W112-V116 HydrophobicContact CG-CG2 4.42Å; W112-V116 HydrophobicContact CH2-CG1 4.15Å; W112-V116 HydrophobicContact CH2-CG2 4.26Å; W112-V116 HydrophobicContact CZ2-CB 4.18Å; W112-V116 HydrophobicContact CZ2-CG1 3.65Å; W112-V116 HydrophobicContact CZ2-CG2 4.3Å; W112-V116 HydrophobicContact CZ3-CG2 4.12Å; W112-V116 WeakPolarHBondContact O-CA 3.41Å; W112-V116 VanDerWaalsContact O-CB 3.24Å; W112-V116 WeakPolarHBondContact O-CB 3.45Å; W112-V116 PolarHBondContact O-N 2.95Å; V116-G120 CarbonylContact O-C 3.55Å; V116-G120 VanDerWaalsContact O-CA 3.27Å; V116-G120 WeakPolarHBondContact O-CA 3.41Å; V116-G120 PolarHBondContact O-N 3.44Å; V116-G120 VanDerWaalsContact O-N 3.11Å; V116-V121 PolarHBondContact O-N 3.19Å |
| 117 | D | 90.7 | Very high | 93.6 | Very high | 38 Ų | 38 | 51.8 Ų | 51.8 | 20% | 0.203 | 27% | 0.273 | C | S | . | . | I | π-helix | trans | -74.7 | -41.4 | -170.1 | -59 | -19.7 | 0 | 0 | 0 | 112.4 | W112 V121 | W112-D117 PolarHBondContact NE1-OD1 3.37Å; W112-D117 PolarHBondContact O-N 3.48Å; W112-D117 VanDerWaalsContact O-N 3.16Å; D117-V121 WeakPolarHBondContact O-CB 3.44Å |
| 118 | C | 90.7 | Very high | 93.6 | Very high | 5 Ų | 5 | 51.5 Ų | 51.5 | 3% | 0.034 | 27% | 0.272 | C | S | . | . | I | π-helix | trans | -83 | -58.6 | 177.6 | -179.6 | 0 | 0 | 0 | 0 | 111.8 | L88 V113 V114 G122 F160 | L88-C118 HydrophobicContact CD1-CB 3.87Å; V113-C118 WeakPolarHBondContact O-CB 3.36Å; V113-C118 PolarHBondContact O-N 2.84Å; V114-C118 WeakPolarHBondContact O-CB 3.3Å; C118-G122 WeakPolarHBondContact O-CA 3.37Å; C118-G122 PolarHBondContact O-N 2.88Å; C118-F160 HydrophobicContact CB-CE1 3.99Å; C118-F160 HydrophobicContact CB-CZ 4.15Å |
| 119 | I | 91.8 | Very high | 93.7 | Very high | 52 Ų | 52 | 49.3 Ų | 49.3 | 27% | 0.267 | 26% | 0.263 | S | S | . | . | I | π-helix | trans | -78.1 | -54.3 | -174.8 | -58.9 | -60.3 | 0 | 0 | 0 | 111.8 | V114 G122 L123 F153 | V114-I119 WeakPolarHBondContact O-CG1 3.24Å; V114-I119 PolarHBondContact O-N 3.35Å; I119-G122 PolarHBondContact O-N 3.01Å; I119-L123 HydrophobicContact CG2-CD1 3.97Å; I119-L123 HydrophobicContact CG2-CG 4.25Å; I119-L123 VanDerWaalsContact O-CG 3.23Å; I119-L123 WeakPolarHBondContact O-CG 3.18Å; I119-L123 PolarHBondContact O-N 3.36Å; I119-F153 HydrophobicContact CD1-CZ 4.24Å |
| 120 | G | 94.3 | Very high | 93.8 | Very high | 33 Ų | 33 | 53.7 Ų | 53.7 | 34% | 0.34 | 28% | 0.28 | S | S | . | . | I | π-helix | trans | -59.9 | -55.9 | -174.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | F115 V116 G122 L123 L124 | F115-G120 PolarHBondContact O-N 2.91Å; V116-G120 CarbonylContact O-C 3.55Å; V116-G120 VanDerWaalsContact O-CA 3.27Å; V116-G120 WeakPolarHBondContact O-CA 3.41Å; V116-G120 PolarHBondContact O-N 3.44Å; V116-G120 VanDerWaalsContact O-N 3.11Å; G120-G122 VanDerWaalsContact C-N 3.27Å; G120-G122 PolarHBondContact O-N 2.91Å; G120-L123 PolarHBondContact O-N 2.89Å; G120-L124 PolarHBondContact O-N 2.89Å; G120-L124 VanDerWaalsContact O-N 3.15Å |
| 121 | V | 94.3 | Very high | 93.8 | Very high | 62 Ų | 62 | 56.4 Ų | 56.4 | 38% | 0.376 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -62.5 | -37.7 | 175.6 | 176.2 | 0 | 0 | 0 | 0 | 110.5 | V116 D117 L123 L124 I125 | V116-V121 PolarHBondContact O-N 3.19Å; D117-V121 WeakPolarHBondContact O-CB 3.44Å; V121-L123 PolarHBondContact O-N 3.15Å; V121-L124 WeakPolarHBondContact O-CB 3.44Å; V121-L124 PolarHBondContact O-N 3.42Å; V121-I125 HydrophobicContact CG1-CD1 3.58Å; V121-I125 HydrophobicContact CG1-CG1 4.07Å; V121-I125 WeakPolarHBondContact O-CG1 3.45Å; V121-I125 PolarHBondContact O-N 3.5Å |
| 122 | G | 94.5 | Very high | 93.9 | Very high | 0 Ų | 0 | 55.1 Ų | 55.1 | 0% | 0 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -61.1 | -44.9 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | C118 I119 G120 L124 I125 S126 H156 | C118-G122 WeakPolarHBondContact O-CA 3.37Å; C118-G122 PolarHBondContact O-N 2.88Å; I119-G122 PolarHBondContact O-N 3.01Å; G120-G122 VanDerWaalsContact C-N 3.27Å; G120-G122 PolarHBondContact O-N 2.91Å; G122-L124 VanDerWaalsContact C-N 3.32Å; G122-L124 PolarHBondContact O-N 2.94Å; G122-I125 PolarHBondContact O-N 3.44Å; G122-S126 WeakPolarHBondContact O-CB 3.41Å; G122-S126 PolarHBondContact O-N 3.43Å; G122-S126 PolarHBondContact O-OG 3.46Å; G122-H156 WeakPolarHBondContact CA-CD2 3.41Å; G122-H156 WeakPolarHBondContact CA-NE2 3.46Å |
| 123 | L | 95.2 | Very high | 94 | Very high | 69 Ų | 69 | 51.6 Ų | 51.6 | 36% | 0.361 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -61.3 | -41.4 | 174.8 | -68 | 175.2 | 0 | 0 | 0 | 111.5 | I119 G120 V121 T127 W149 F153 | I119-L123 HydrophobicContact CG2-CD1 3.97Å; I119-L123 HydrophobicContact CG2-CG 4.25Å; I119-L123 VanDerWaalsContact O-CG 3.23Å; I119-L123 WeakPolarHBondContact O-CG 3.18Å; I119-L123 PolarHBondContact O-N 3.36Å; G120-L123 PolarHBondContact O-N 2.89Å; V121-L123 PolarHBondContact O-N 3.15Å; L123-T127 WeakPolarHBondContact O-CB 3.38Å; L123-T127 PolarHBondContact O-N 2.78Å; L123-T127 PolarHBondContact O-OG1 3.5Å; L123-W149 HydrophobicContact CD2-CH2 3.31Å; L123-W149 HydrophobicContact CD2-CZ2 3.45Å; L123-W149 VanDerWaalsContact CD2-CZ2 3.45Å; L123-F153 HydrophobicContact CD2-CD2 4.47Å; L123-F153 HydrophobicContact CD2-CE2 4.32Å |
| 124 | L | 96.9 | Very high | 94 | Very high | 105 Ų | 105 | 53 Ų | 53 | 55% | 0.55 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -63 | -55.3 | 177.6 | 178.2 | 64.5 | 0 | 0 | 0 | 111.2 | G120 V121 G122 S126 T127 L128 | G120-L124 PolarHBondContact O-N 2.89Å; G120-L124 VanDerWaalsContact O-N 3.15Å; V121-L124 WeakPolarHBondContact O-CB 3.44Å; V121-L124 PolarHBondContact O-N 3.42Å; G122-L124 VanDerWaalsContact C-N 3.32Å; G122-L124 PolarHBondContact O-N 2.94Å; L124-S126 VanDerWaalsContact C-N 3.3Å; L124-S126 PolarHBondContact O-N 3.11Å; L124-T127 PolarHBondContact O-N 2.71Å; L124-L128 HydrophobicContact CD1-CD1 4.24Å; L124-L128 HydrophobicContact CD1-CG 4.43Å; L124-L128 HydrophobicContact CG-CD1 4.16Å; L124-L128 WeakPolarHBondContact O-CG 3.41Å; L124-L128 PolarHBondContact O-N 2.97Å |
| 125 | I | 95.8 | Very high | 94 | Very high | 43 Ų | 43 | 57.6 Ų | 57.6 | 22% | 0.221 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -61 | -41.9 | -178.7 | -65.6 | 174.7 | 0 | 0 | 0 | 110.7 | V121 G122 T127 L128 M129 Y203 | V121-I125 HydrophobicContact CG1-CD1 3.58Å; V121-I125 HydrophobicContact CG1-CG1 4.07Å; V121-I125 WeakPolarHBondContact O-CG1 3.45Å; V121-I125 PolarHBondContact O-N 3.5Å; G122-I125 PolarHBondContact O-N 3.44Å; I125-T127 VanDerWaalsContact C-N 3.34Å; I125-T127 PolarHBondContact O-N 2.93Å; I125-L128 PolarHBondContact O-N 3.01Å; I125-M129 HydrophobicContact CG2-CG 4.13Å; I125-M129 WeakPolarHBondContact O-CB 3.28Å; I125-M129 WeakPolarHBondContact O-CG 3.34Å; I125-M129 PolarHBondContact O-N 3.16Å; I125-Y203 WeakPolarHBondContact CD1-OH 3.49Å |
| 126 | S | 95.3 | Very high | 94 | Very high | 0 Ų | 0 | 58.2 Ų | 58.2 | 0% | 0 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -64.5 | -40 | 180 | -55.5 | 0 | 0 | 0 | 0 | 111.9 | G122 L124 W130 F153 | G122-S126 WeakPolarHBondContact O-CB 3.41Å; G122-S126 PolarHBondContact O-N 3.43Å; G122-S126 PolarHBondContact O-OG 3.46Å; L124-S126 VanDerWaalsContact C-N 3.3Å; L124-S126 PolarHBondContact O-N 3.11Å; S126-W130 WeakPolarHBondContact O-CB 3.34Å; S126-W130 PolarHBondContact O-N 2.91Å; S126-F153 WeakPolarHBondContact OG-CA 3.48Å; S126-F153 WeakPolarHBondContact OG-CD2 3.27Å |
| 127 | T | 95.6 | Very high | 94 | Very high | 63 Ų | 63 | 56.1 Ų | 56.1 | 39% | 0.387 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -67.3 | -42.6 | 176.6 | -57.2 | 0 | 0 | 0 | 0 | 111.4 | L123 L124 I125 F131 W149 | L123-T127 WeakPolarHBondContact O-CB 3.38Å; L123-T127 PolarHBondContact O-N 2.78Å; L123-T127 PolarHBondContact O-OG1 3.5Å; L124-T127 PolarHBondContact O-N 2.71Å; I125-T127 VanDerWaalsContact C-N 3.34Å; I125-T127 PolarHBondContact O-N 2.93Å; T127-F131 WeakPolarHBondContact O-CB 3.26Å; T127-F131 PolarHBondContact O-N 2.7Å; T127-W149 PolarHBondContact OG1-NE1 2.95Å; T127-W149 VanDerWaalsContact OG1-NE1 3.11Å |
| 128 | L | 96.4 | Very high | 94.1 | Very high | 92 Ų | 92 | 56 Ų | 56 | 48% | 0.482 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -62.1 | -48.3 | 175.4 | -70.5 | 172.9 | 0 | 0 | 0 | 111.5 | L124 I125 F131 I132 | L124-L128 HydrophobicContact CD1-CD1 4.24Å; L124-L128 HydrophobicContact CD1-CG 4.43Å; L124-L128 HydrophobicContact CG-CD1 4.16Å; L124-L128 WeakPolarHBondContact O-CG 3.41Å; L124-L128 PolarHBondContact O-N 2.97Å; I125-L128 PolarHBondContact O-N 3.01Å; L128-F131 PolarHBondContact O-N 3.13Å; L128-I132 WeakPolarHBondContact O-CB 3.39Å; L128-I132 VanDerWaalsContact O-CG1 3.26Å; L128-I132 WeakPolarHBondContact O-CG1 3.15Å; L128-I132 PolarHBondContact O-N 2.83Å |
| 129 | M | 95.8 | Very high | 93.8 | Very high | 49 Ų | 49 | 60.8 Ų | 60.8 | 24% | 0.241 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -70 | -36.8 | -179.1 | -70 | -67.1 | 166.3 | 0 | 0 | 112.6 | I125 F131 I132 S133 Y211 L223 | I125-M129 HydrophobicContact CG2-CG 4.13Å; I125-M129 WeakPolarHBondContact O-CB 3.28Å; I125-M129 WeakPolarHBondContact O-CG 3.34Å; I125-M129 PolarHBondContact O-N 3.16Å; M129-F131 VanDerWaalsContact C-N 3.33Å; M129-F131 PolarHBondContact O-N 3.09Å; M129-I132 PolarHBondContact O-N 3.37Å; M129-S133 VanDerWaalsContact O-CB 3.24Å; M129-S133 WeakPolarHBondContact O-CB 3.25Å; M129-S133 PolarHBondContact O-N 2.93Å; M129-S133 PolarHBondContact O-OG 2.6Å; M129-Y211 HydrophobicContact CB-CE2 4.16Å; M129-Y211 WeakPolarHBondContact CB-OH 3.24Å; M129-Y211 HydrophobicContact CG-CE2 4.45Å; M129-L223 HydrophobicContact SD-CD2 4.11Å |
| 130 | W | 95.5 | Very high | 93.3 | Very high | 94 Ų | 94 | 65.1 Ų | 65.1 | 36% | 0.356 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -58.4 | -44.7 | 170.4 | 171.7 | 77.7 | 0 | 0 | 0 | 111.6 | S126 S133 N134 V147 W149 A152 | S126-W130 WeakPolarHBondContact O-CB 3.34Å; S126-W130 PolarHBondContact O-N 2.91Å; W130-S133 PolarHBondContact O-OG 3.25Å; W130-S133 VanDerWaalsContact O-OG 3.13Å; W130-N134 PolarHBondContact NE1-ND2 2.87Å; W130-N134 WeakPolarHBondContact O-CB 3.48Å; W130-N134 PolarHBondContact O-N 3.33Å; W130-N134 VanDerWaalsContact O-N 3.16Å; W130-N134 PolarHBondContact O-ND2 3.02Å; W130-V147 PolarHBondContact NE1-O 2.87Å; W130-W149 HydrophobicContact CG-CB 4.23Å; W130-A152 HydrophobicContact CB-CB 4.07Å |
| 131 | F | 94.4 | Very high | 92 | Very high | 99 Ų | 99 | 69.4 Ų | 69.4 | 43% | 0.434 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -65.5 | -48.9 | 176.1 | 177.2 | -99.3 | 0 | 0 | 0 | 112.1 | T127 L128 M129 S133 K135 Y136 | T127-F131 WeakPolarHBondContact O-CB 3.26Å; T127-F131 PolarHBondContact O-N 2.7Å; L128-F131 PolarHBondContact O-N 3.13Å; M129-F131 VanDerWaalsContact C-N 3.33Å; M129-F131 PolarHBondContact O-N 3.09Å; F131-S133 PolarHBondContact O-N 3.22Å; F131-K135 HydrophobicContact CE1-CD 3.79Å; F131-K135 HydrophobicContact CE2-CD 3.95Å; F131-K135 HydrophobicContact CZ-CD 3.38Å; F131-K135 WeakPolarHBondContact O-CB 3.36Å; F131-K135 PolarHBondContact O-N 2.9Å; F131-Y136 HydrophobicContact CE1-CE2 4.4Å |
| 132 | I | 94.3 | Very high | 90.5 | Very high | 60 Ų | 60 | 69 Ų | 69 | 31% | 0.308 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -61 | -46.5 | -178.8 | -70.2 | 165.4 | 0 | 0 | 0 | 110.7 | L128 M129 K135 Y136 | L128-I132 WeakPolarHBondContact O-CB 3.39Å; L128-I132 VanDerWaalsContact O-CG1 3.26Å; L128-I132 WeakPolarHBondContact O-CG1 3.15Å; L128-I132 PolarHBondContact O-N 2.83Å; M129-I132 PolarHBondContact O-N 3.37Å; I132-K135 PolarHBondContact O-N 3.27Å; I132-Y136 HydrophobicContact CG2-CD2 4.35Å; I132-Y136 WeakPolarHBondContact O-CB 3.02Å; I132-Y136 PolarHBondContact O-N 3.44Å |
| 133 | S | 94.1 | Very high | 88.9 | Confident | 2 Ų | 2 | 81.9 Ų | 81.9 | 1% | 0.014 | 39% | 0.39 | C | S | . | . | I | π-helix | trans | -65.1 | -46.9 | -177.5 | 56 | 0 | 0 | 0 | 0 | 112.5 | M129 W130 F131 K135 L137 L138 | M129-S133 VanDerWaalsContact O-CB 3.24Å; M129-S133 WeakPolarHBondContact O-CB 3.25Å; M129-S133 PolarHBondContact O-N 2.93Å; M129-S133 PolarHBondContact O-OG 2.6Å; W130-S133 PolarHBondContact O-OG 3.25Å; W130-S133 VanDerWaalsContact O-OG 3.13Å; F131-S133 PolarHBondContact O-N 3.22Å; S133-K135 PolarHBondContact O-N 2.97Å; S133-L137 WeakPolarHBondContact O-CA 3.49Å; S133-L137 WeakPolarHBondContact O-CB 3.46Å; S133-L137 PolarHBondContact O-N 3.24Å; S133-L138 PolarHBondContact O-N 3.33Å |
| 134 | N | 93 | Very high | 87.7 | Confident | 33 Ų | 33 | 82.2 Ų | 82.2 | 18% | 0.176 | 40% | 0.398 | C | S | . | . | I | π-helix | trans | -70 | -31.3 | 178.3 | -75.6 | -51.2 | 0 | 0 | 0 | 113.1 | W130 L138 D146 V147 | W130-N134 PolarHBondContact NE1-ND2 2.87Å; W130-N134 WeakPolarHBondContact O-CB 3.48Å; W130-N134 PolarHBondContact O-N 3.33Å; W130-N134 VanDerWaalsContact O-N 3.16Å; W130-N134 PolarHBondContact O-ND2 3.02Å; N134-L138 WeakPolarHBondContact O-CD1 3.23Å; N134-D146 WeakPolarHBondContact OD1-CA 3.46Å; N134-V147 PolarHBondContact ND2-O 2.8Å; N134-V147 PolarHBondContact OD1-N 3.13Å |
| 135 | K | 91.3 | Very high | 86.6 | Confident | 123 Ų | 123 | 82.6 Ų | 82.6 | 54% | 0.535 | 40% | 0.395 | S | S | . | . | I | π-helix | trans | -84.3 | -37.3 | -178.4 | -172 | 169.6 | 179.2 | -176.6 | 0 | 113.5 | F131 I132 S133 | F131-K135 HydrophobicContact CE1-CD 3.79Å; F131-K135 HydrophobicContact CE2-CD 3.95Å; F131-K135 HydrophobicContact CZ-CD 3.38Å; F131-K135 WeakPolarHBondContact O-CB 3.36Å; F131-K135 PolarHBondContact O-N 2.9Å; I132-K135 PolarHBondContact O-N 3.27Å; S133-K135 PolarHBondContact O-N 2.97Å |
| 136 | Y | 92.2 | Very high | 86.2 | Confident | 146 Ų | 146 | 85.2 Ų | 85.2 | 57% | 0.573 | 41% | 0.41 | S | S | * | . | I | π-helix | trans | -120.8 | -20.1 | -167.6 | -59.1 | -72.4 | 0 | 0 | 0 | 115 | F131 I132 | F131-Y136 HydrophobicContact CE1-CE2 4.4Å; I132-Y136 HydrophobicContact CG2-CD2 4.35Å; I132-Y136 WeakPolarHBondContact O-CB 3.02Å; I132-Y136 PolarHBondContact O-N 3.44Å |
| 137 | L | 92.5 | Very high | 85.9 | Confident | 11 Ų | 11 | 85.3 Ų | 85.3 | 6% | 0.058 | 41% | 0.41 | C | S | . | . | I | π-helix | trans | -107.3 | -10.3 | -172 | -56.9 | -177.6 | 0 | 0 | 0 | 114.2 | S133 K139 L217 S218 L223 | S133-L137 WeakPolarHBondContact O-CA 3.49Å; S133-L137 WeakPolarHBondContact O-CB 3.46Å; S133-L137 PolarHBondContact O-N 3.24Å; L137-K139 PolarHBondContact O-N 3.03Å; L137-L217 HydrophobicContact CB-CD2 3.97Å; L137-L217 CarbonylContact O-C 3.53Å; L137-L217 WeakPolarHBondContact O-CA 3.29Å; L137-S218 PolarHBondContact O-N 2.95Å; L137-S218 PolarHBondContact O-OG 3.46Å; L137-L223 HydrophobicContact CD1-CD1 4.35Å; L137-L223 HydrophobicContact CD1-CD2 4.36Å; L137-L223 HydrophobicContact CD1-CG 4.37Å |
| 138 | L | 92 | Very high | 85.7 | Confident | 34 Ų | 34 | 83.9 Ų | 83.9 | 18% | 0.178 | 40% | 0.4 | C | S | . | . | B | Isolated β-bridge | trans | -63.6 | 129.5 | 177.5 | -73.6 | 176 | 0 | 0 | 0 | 111.9 | S133 N134 F216 L217 | S133-L138 PolarHBondContact O-N 3.33Å; N134-L138 WeakPolarHBondContact O-CD1 3.23Å; L138-F216 HydrophobicContact CD2-CD2 3.65Å; L138-F216 HydrophobicContact CD2-CE2 4.11Å; L138-L217 HydrophobicContact CD2-CD2 3.92Å; L138-L217 HydrophobicContact CG-CD2 4.43Å |
| 139 | K | 85.6 | Confident | 85.6 | Confident | 106 Ų | 106 | 84.3 Ų | 84.3 | 46% | 0.461 | 40% | 0.395 | S | S | . | . | S | Bend | trans | -63.1 | -47.3 | 175 | -80.4 | 173.3 | 175.6 | 165.2 | 0 | 112.7 | L137 P215 F216 L217 S218 | L137-K139 PolarHBondContact O-N 3.03Å; K139-P215 PolarHBondContact NZ-O 3.03Å; K139-F216 WeakPolarHBondContact CB-O 3.31Å; K139-F216 PolarHBondContact N-O 3.13Å; K139-L217 WeakPolarHBondContact CE-O 3.44Å; K139-L217 PolarHBondContact NZ-O 3.49Å; K139-S218 VanDerWaalsContact CG-CB 3.44Å |
| 140 | H | 79.6 | Confident | 85.4 | Confident | 144 Ų | 144 | 83.2 Ų | 83.2 | 67% | 0.667 | 40% | 0.396 | S | S | * | . | S | Bend | trans | -132.9 | 111 | -179.8 | -62.5 | -58.5 | 0 | 0 | 0 | 107.1 | S142 | H140-S142 PolarHBondContact O-N 3.08Š|
| 141 | P | 67.4 | Low | 85.2 | Confident | 123 Ų | 123 | 78.8 Ų | 78.8 | 80% | 0.799 | 38% | 0.379 | S | S | * | . | trans | -70.4 | 76.2 | 172.3 | 13.9 | -8.6 | 0 | 0 | 0 | 109.3 | ||||
| 142 | S | 62.8 | Low | 85.3 | Confident | 52 Ų | 52 | 74.1 Ų | 74.1 | 36% | 0.364 | 36% | 0.359 | S | S | . | . | trans | -103.4 | 149.2 | 167.2 | 67.8 | 0 | 0 | 0 | 0 | 109.2 | H140 S144 | H140-S142 PolarHBondContact O-N 3.08Å; S142-S144 PolarHBondContact O-N 3Å; S142-S144 PolarHBondContact OG-OG 2.72Å | ||
| 143 | R | 61.9 | Low | 85.3 | Confident | 271 Ų | 271 | 72.5 Ų | 72.5 | 100% | 1.023 | 35% | 0.349 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.7 | -5.9 | 179.9 | -86 | -175.6 | 170.2 | 144.7 | -2.3 | 115.1 | ||
| 144 | S | 68.3 | Low | 85.4 | Confident | 77 Ų | 77 | 72.7 Ų | 72.7 | 54% | 0.538 | 35% | 0.35 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -94.7 | -17 | -170.7 | 56.8 | 0 | 0 | 0 | 0 | 114.6 | S142 | S142-S144 PolarHBondContact O-N 3Å; S142-S144 PolarHBondContact OG-OG 2.72Å |
| 145 | F | 74.8 | Confident | 85.5 | Confident | 112 Ų | 112 | 71.1 Ų | 71.1 | 49% | 0.491 | 34% | 0.342 | S | S | . | . | trans | -134.3 | 110 | -174.7 | -58.8 | -69.3 | 0 | 0 | 0 | 111.4 | F216 | F145-F216 HydrophobicContact CB-CB 4.38Å; F145-F216 HydrophobicContact CB-CD2 4.39Å; F145-F216 HydrophobicContact CB-CG 4.25Å | ||
| 146 | D | 86.6 | Confident | 85.8 | Confident | 99 Ų | 99 | 65.6 Ų | 65.6 | 53% | 0.529 | 32% | 0.318 | S | S | . | . | trans | -126.7 | 154.7 | 171.4 | 66.9 | -32.2 | 0 | 0 | 0 | 110.9 | N134 E148 | N134-D146 WeakPolarHBondContact OD1-CA 3.46Å; D146-E148 PolarHBondContact O-N 3.48Å | ||
| 147 | V | 90.8 | Very high | 85.9 | Confident | 1 Ų | 1 | 58.7 Ų | 58.7 | 1% | 0.006 | 29% | 0.291 | C | S | . | . | trans | -74.3 | 121.5 | 168.6 | -177.1 | 0 | 0 | 0 | 0 | 107.9 | W130 N134 W149 Y151 Y211 L214 F216 L217 | W130-V147 PolarHBondContact NE1-O 2.87Å; N134-V147 PolarHBondContact ND2-O 2.8Å; N134-V147 PolarHBondContact OD1-N 3.13Å; V147-W149 PolarHBondContact O-N 3.16Å; V147-Y151 HydrophobicContact CG1-CD1 4.03Å; V147-Y211 HydrophobicContact CG1-CE1 4.2Å; V147-L214 HydrophobicContact CG1-CD1 4.09Å; V147-L214 HydrophobicContact CG2-CD1 3.88Å; V147-F216 HydrophobicContact CG2-CE2 3.82Å; V147-F216 HydrophobicContact CG2-CZ 4.37Å; V147-L217 HydrophobicContact CG2-CD1 4.1Å; V147-L217 HydrophobicContact CG2-CD2 3.98Å; V147-L217 HydrophobicContact CG2-CG 4.41Å | ||
| 148 | E | 91.6 | Very high | 86.1 | Confident | 34 Ų | 34 | 58.2 Ų | 58.2 | 16% | 0.159 | 29% | 0.288 | C | S | . | . | trans | -64.9 | 131.1 | 174.3 | -64.7 | 170.9 | -149.3 | 0 | 0 | 110.3 | Q72 W73 A74 D146 G150 Y151 A152 | Q72-E148 WeakPolarHBondContact CA-OE1 3.4Å; W73-E148 PolarHBondContact N-OE1 2.98Å; W73-E148 PolarHBondContact N-OE2 3.16Å; A74-E148 WeakPolarHBondContact CB-OE2 3.06Å; A74-E148 PolarHBondContact N-OE2 3.24Å; D146-E148 PolarHBondContact O-N 3.48Å; E148-G150 PolarHBondContact O-N 3.37Å; E148-Y151 WeakPolarHBondContact O-CB 3.14Å; E148-Y151 PolarHBondContact O-N 2.98Å; E148-A152 PolarHBondContact O-N 3.45Å; E148-A152 VanDerWaalsContact O-N 3.13Å | ||
| 149 | W | 92.9 | Very high | 86.3 | Confident | 101 Ų | 101 | 56.6 Ų | 56.6 | 38% | 0.383 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -58.3 | -37.8 | 176.8 | 179.8 | 93.4 | 0 | 0 | 0 | 112.4 | L123 T127 W130 V147 Y151 A152 F153 | L123-W149 HydrophobicContact CD2-CH2 3.31Å; L123-W149 HydrophobicContact CD2-CZ2 3.45Å; L123-W149 VanDerWaalsContact CD2-CZ2 3.45Å; T127-W149 PolarHBondContact OG1-NE1 2.95Å; T127-W149 VanDerWaalsContact OG1-NE1 3.11Å; W130-W149 HydrophobicContact CG-CB 4.23Å; V147-W149 PolarHBondContact O-N 3.16Å; W149-Y151 VanDerWaalsContact C-N 3.26Å; W149-Y151 PolarHBondContact O-N 3.36Å; W149-A152 WeakPolarHBondContact O-CB 3.19Å; W149-A152 PolarHBondContact O-N 2.91Å; W149-A152 VanDerWaalsContact O-N 3.15Å; W149-F153 HydrophobicContact CZ3-CB 4.45Å; W149-F153 PolarHBondContact O-N 2.9Å |
| 150 | G | 91.1 | Very high | 86.8 | Confident | 25 Ų | 25 | 52.4 Ų | 52.4 | 26% | 0.258 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -63 | -32.1 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | E148 F153 D154 | E148-G150 PolarHBondContact O-N 3.37Å; G150-F153 PolarHBondContact O-N 2.89Å; G150-D154 PolarHBondContact O-N 3.12Å |
| 151 | Y | 93.1 | Very high | 87.5 | Confident | 1 Ų | 1 | 46.2 Ų | 46.2 | 0% | 0.004 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -69.7 | -41.5 | 173.3 | 175.5 | -96.7 | 0 | 0 | 0 | 111.6 | F63 W73 V147 E148 W149 F153 D154 V155 G210 L214 | F63-Y151 AromaticContact CD1-CD2 3.62Å; F63-Y151 HydrophobicContact CD1-CD2 3.62Å; F63-Y151 AromaticContact CD1-CE2 3.31Å; F63-Y151 HydrophobicContact CD1-CE2 3.31Å; F63-Y151 AromaticContact CE1-CD2 3.77Å; F63-Y151 HydrophobicContact CE1-CD2 3.77Å; F63-Y151 AromaticContact CE1-CE2 3.67Å; F63-Y151 HydrophobicContact CE1-CE2 3.67Å; F63-Y151 HydrophobicContact CG-CE2 4.12Å; W73-Y151 HydrophobicContact CB-CD2 3.6Å; W73-Y151 HydrophobicContact CB-CE2 4.31Å; W73-Y151 HydrophobicContact CB-CG 3.87Å; V147-Y151 HydrophobicContact CG1-CD1 4.03Å; E148-Y151 WeakPolarHBondContact O-CB 3.14Å; E148-Y151 PolarHBondContact O-N 2.98Å; W149-Y151 VanDerWaalsContact C-N 3.26Å; W149-Y151 PolarHBondContact O-N 3.36Å; Y151-F153 PolarHBondContact O-N 3.35Å; Y151-D154 WeakPolarHBondContact O-CB 3.16Å; Y151-D154 PolarHBondContact O-N 3.28Å; Y151-D154 VanDerWaalsContact O-N 3.13Å; Y151-V155 HydrophobicContact CD1-CG2 4.13Å; Y151-V155 HydrophobicContact CE1-CG2 3.61Å; Y151-V155 HydrophobicContact CE2-CG2 4.23Å; Y151-V155 WeakPolarHBondContact O-CG2 3.44Å; Y151-V155 PolarHBondContact O-N 3.13Å; Y151-G210 PolarHBondContact OH-O 2.96Å; Y151-L214 HydrophobicContact CD1-CD1 3.98Å; Y151-L214 HydrophobicContact CE1-CD1 3.53Å; Y151-L214 HydrophobicContact CE1-CD2 4.04Å; Y151-L214 HydrophobicContact CE1-CG 3.87Å |
| 152 | A | 95.7 | Very high | 88.9 | Confident | 1 Ų | 1 | 40.3 Ų | 40.3 | 1% | 0.008 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -58.5 | -38.8 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | W130 E148 W149 V155 H156 Y211 | W130-A152 HydrophobicContact CB-CB 4.07Å; E148-A152 PolarHBondContact O-N 3.45Å; E148-A152 VanDerWaalsContact O-N 3.13Å; W149-A152 WeakPolarHBondContact O-CB 3.19Å; W149-A152 PolarHBondContact O-N 2.91Å; W149-A152 VanDerWaalsContact O-N 3.15Å; A152-V155 PolarHBondContact O-N 3Å; A152-H156 PolarHBondContact O-N 3.05Å; A152-H156 VanDerWaalsContact O-N 3.09Å; A152-Y211 WeakPolarHBondContact CA-OH 3.48Å; A152-Y211 VanDerWaalsContact CB-OH 3.3Å; A152-Y211 WeakPolarHBondContact CB-OH 3.46Å |
| 153 | F | 95.2 | Very high | 90.4 | Very high | 26 Ų | 26 | 39.2 Ų | 39.2 | 11% | 0.114 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -66.4 | -41.5 | 173 | -171.9 | -110 | 0 | 0 | 0 | 113.4 | L81 I119 L123 S126 W149 G150 Y151 V155 H156 L157 | L81-F153 HydrophobicContact CD1-CE1 4.46Å; I119-F153 HydrophobicContact CD1-CZ 4.24Å; L123-F153 HydrophobicContact CD2-CD2 4.47Å; L123-F153 HydrophobicContact CD2-CE2 4.32Å; S126-F153 WeakPolarHBondContact OG-CA 3.48Å; S126-F153 WeakPolarHBondContact OG-CD2 3.27Å; W149-F153 HydrophobicContact CZ3-CB 4.45Å; W149-F153 PolarHBondContact O-N 2.9Å; G150-F153 PolarHBondContact O-N 2.89Å; Y151-F153 PolarHBondContact O-N 3.35Å; F153-V155 VanDerWaalsContact C-N 3.32Å; F153-V155 PolarHBondContact O-N 3.27Å; F153-H156 WeakPolarHBondContact O-CB 3.39Å; F153-H156 PolarHBondContact O-N 3.33Å; F153-L157 HydrophobicContact CD1-CD1 3.93Å; F153-L157 HydrophobicContact CD1-CG 4.27Å; F153-L157 HydrophobicContact CE1-CD1 3.54Å; F153-L157 HydrophobicContact CE1-CD2 4.28Å; F153-L157 HydrophobicContact CE1-CG 3.98Å; F153-L157 HydrophobicContact CE2-CD2 4.4Å; F153-L157 HydrophobicContact CZ-CD1 4.09Å; F153-L157 HydrophobicContact CZ-CD2 3.96Å; F153-L157 HydrophobicContact CZ-CG 4.11Å; F153-L157 WeakPolarHBondContact O-CG 3.49Å; F153-L157 PolarHBondContact O-N 2.77Å |
| 154 | D | 94.6 | Very high | 92 | Very high | 6 Ų | 6 | 26.3 Ų | 26.3 | 3% | 0.032 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -61.2 | -39.3 | 173.2 | -77.4 | -42 | 0 | 0 | 0 | 113.3 | F63 A74 R75 G150 Y151 H156 L157 N158 | F63-D154 HydrophobicContact CE1-CB 4.14Å; F63-D154 HydrophobicContact CZ-CB 4.32Å; A74-D154 WeakPolarHBondContact CA-OD2 3.46Å; R75-D154 WeakPolarHBondContact CB-OD2 3.24Å; R75-D154 WeakPolarHBondContact CD-OD1 3.1Å; R75-D154 WeakPolarHBondContact CG-OD1 3.4Å; R75-D154 WeakPolarHBondContact CG-OD2 3.25Å; R75-D154 PolarHBondContact N-OD2 3.47Å; R75-D154 IonicContact NH1-OD1 3.93Å; R75-D154 PolarHBondContact NH1-OD1 3.25Å; G150-D154 PolarHBondContact O-N 3.12Å; Y151-D154 WeakPolarHBondContact O-CB 3.16Å; Y151-D154 PolarHBondContact O-N 3.28Å; Y151-D154 VanDerWaalsContact O-N 3.13Å; D154-H156 VanDerWaalsContact C-N 3.34Å; D154-L157 PolarHBondContact O-N 3Å; D154-N158 WeakPolarHBondContact O-CB 3.43Å; D154-N158 PolarHBondContact O-N 2.94Å; D154-N158 PolarHBondContact O-ND2 3.04Å; D154-N158 PolarHBondContact O-OD1 2.8Å |
| 155 | V | 96.1 | Very high | 93.2 | Very high | 1 Ų | 1 | 23.6 Ų | 23.6 | 1% | 0.006 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -63 | -43.3 | 175.9 | 173.3 | 0 | 0 | 0 | 0 | 110.2 | Y60 Y151 A152 F153 N158 A159 T207 Y211 | Y60-V155 HydrophobicContact CE1-CG2 4.33Å; Y151-V155 HydrophobicContact CD1-CG2 4.13Å; Y151-V155 HydrophobicContact CE1-CG2 3.61Å; Y151-V155 HydrophobicContact CE2-CG2 4.23Å; Y151-V155 WeakPolarHBondContact O-CG2 3.44Å; Y151-V155 PolarHBondContact O-N 3.13Å; A152-V155 PolarHBondContact O-N 3Å; F153-V155 VanDerWaalsContact C-N 3.32Å; F153-V155 PolarHBondContact O-N 3.27Å; V155-N158 PolarHBondContact O-N 3.42Å; V155-A159 WeakPolarHBondContact O-CB 3.41Å; V155-A159 PolarHBondContact O-N 3.37Å; V155-T207 HydrophobicContact CG1-CG2 4.24Å; V155-Y211 HydrophobicContact CB-CE2 4.41Å; V155-Y211 HydrophobicContact CG1-CD2 4.28Å; V155-Y211 HydrophobicContact CG1-CE2 3.81Å |
| 156 | H | 96.5 | Very high | 94.1 | Very high | 6 Ų | 6 | 18.7 Ų | 18.7 | 3% | 0.028 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -58.4 | -51.1 | 173.1 | 169.5 | 72.3 | 0 | 0 | 0 | 111.6 | G122 A152 F153 D154 N158 A159 F160 Y203 | G122-H156 WeakPolarHBondContact CA-CD2 3.41Å; G122-H156 WeakPolarHBondContact CA-NE2 3.46Å; A152-H156 PolarHBondContact O-N 3.05Å; A152-H156 VanDerWaalsContact O-N 3.09Å; F153-H156 WeakPolarHBondContact O-CB 3.39Å; F153-H156 PolarHBondContact O-N 3.33Å; D154-H156 VanDerWaalsContact C-N 3.34Å; H156-N158 VanDerWaalsContact C-N 3.29Å; H156-N158 PolarHBondContact O-N 3.15Å; H156-A159 PolarHBondContact O-N 3.35Å; H156-A159 VanDerWaalsContact O-N 3.13Å; H156-F160 VanDerWaalsContact O-CB 3.25Å; H156-F160 WeakPolarHBondContact O-CB 3.39Å; H156-F160 PolarHBondContact O-N 2.96Å; H156-Y203 AromaticContact ND1-CE2 3.88Å; H156-Y203 AromaticContact ND1-CZ 3.74Å; H156-Y203 PolarHBondContact ND1-OH 3.01Å |
| 157 | L | 95.1 | Very high | 94.4 | Very high | 2 Ų | 2 | 14.1 Ų | 14.1 | 1% | 0.01 | 7% | 0.07 | C | C | . | . | H | α-helix | trans | -60.6 | -38.1 | 179.9 | -67.3 | -177.9 | 0 | 0 | 0 | 112.4 | F80 L81 L84 F153 D154 Y161 | F80-L157 HydrophobicContact CD1-CB 4.39Å; F80-L157 HydrophobicContact CE1-CB 3.95Å; L81-L157 HydrophobicContact CD1-CD1 4.38Å; L84-L157 HydrophobicContact CD2-CD2 3.81Å; F153-L157 HydrophobicContact CD1-CD1 3.93Å; F153-L157 HydrophobicContact CD1-CG 4.27Å; F153-L157 HydrophobicContact CE1-CD1 3.54Å; F153-L157 HydrophobicContact CE1-CD2 4.28Å; F153-L157 HydrophobicContact CE1-CG 3.98Å; F153-L157 HydrophobicContact CE2-CD2 4.4Å; F153-L157 HydrophobicContact CZ-CD1 4.09Å; F153-L157 HydrophobicContact CZ-CD2 3.96Å; F153-L157 HydrophobicContact CZ-CG 4.11Å; F153-L157 WeakPolarHBondContact O-CG 3.49Å; F153-L157 PolarHBondContact O-N 2.77Å; D154-L157 PolarHBondContact O-N 3Å; L157-Y161 PolarHBondContact O-N 3.36Å; L157-Y161 VanDerWaalsContact O-N 3.16Å |
| 158 | N | 95.8 | Very high | 94.3 | Very high | 0 Ų | 0 | 14.7 Ų | 14.7 | 0% | 0 | 7% | 0.073 | C | C | . | . | H | α-helix | trans | -65.2 | -40.6 | 175.5 | -73.5 | -14.7 | 0 | 0 | 0 | 112.4 | L52 R75 D154 V155 H156 P162 I206 | L52-N158 HydrophobicContact CD1-CB 4.27Å; L52-N158 WeakPolarHBondContact CD1-O 3.47Å; L52-N158 HydrophobicContact CD2-CB 3.88Å; R75-N158 VanDerWaalsContact CZ-OD1 3.25Å; R75-N158 PolarHBondContact NH1-OD1 3.06Å; R75-N158 PolarHBondContact NH2-OD1 3.47Å; D154-N158 WeakPolarHBondContact O-CB 3.43Å; D154-N158 PolarHBondContact O-N 2.94Å; D154-N158 PolarHBondContact O-ND2 3.04Å; D154-N158 PolarHBondContact O-OD1 2.8Å; V155-N158 PolarHBondContact O-N 3.42Å; H156-N158 VanDerWaalsContact C-N 3.29Å; H156-N158 PolarHBondContact O-N 3.15Å; N158-P162 WeakPolarHBondContact O-CD 3.38Å; N158-I206 HydrophobicContact CB-CG2 3.99Å |
| 159 | A | 96.4 | Very high | 94.1 | Very high | 0 Ų | 0 | 14.6 Ų | 14.6 | 0% | 0 | 7% | 0.072 | C | C | . | . | H | α-helix | trans | -74.1 | -35.3 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112 | V155 H156 Y203 I206 | V155-A159 WeakPolarHBondContact O-CB 3.41Å; V155-A159 PolarHBondContact O-N 3.37Å; H156-A159 PolarHBondContact O-N 3.35Å; H156-A159 VanDerWaalsContact O-N 3.13Å; A159-Y203 VanDerWaalsContact C-CD2 3.43Å; A159-Y203 HydrophobicContact CB-CD1 4.31Å; A159-Y203 HydrophobicContact CB-CD2 3.53Å; A159-Y203 HydrophobicContact CB-CE1 4.39Å; A159-Y203 HydrophobicContact CB-CE2 3.63Å; A159-Y203 HydrophobicContact CB-CG 3.86Å; A159-Y203 WeakPolarHBondContact CB-O 3.37Å; A159-Y203 WeakPolarHBondContact O-CD2 3.45Å; A159-I206 HydrophobicContact CB-CB 4.1Å; A159-I206 HydrophobicContact CB-CG2 3.96Å |
| 160 | F | 96.2 | Very high | 93.9 | Very high | 19 Ų | 19 | 13.8 Ų | 13.8 | 8% | 0.083 | 8% | 0.075 | C | C | . | . | H | α-helix | trans | -68 | -37.1 | -180 | -179.4 | -106.5 | 0 | 0 | 0 | 112.5 | L84 L88 C118 H156 L163 L164 Y203 | L84-F160 HydrophobicContact CD1-CD1 4.18Å; L84-F160 HydrophobicContact CD1-CE1 4.41Å; L84-F160 HydrophobicContact CD2-CD1 4.18Å; L88-F160 HydrophobicContact CD2-CE1 4.06Å; L88-F160 HydrophobicContact CD2-CZ 4.21Å; C118-F160 HydrophobicContact CB-CE1 3.99Å; C118-F160 HydrophobicContact CB-CZ 4.15Å; H156-F160 VanDerWaalsContact O-CB 3.25Å; H156-F160 WeakPolarHBondContact O-CB 3.39Å; H156-F160 PolarHBondContact O-N 2.96Å; F160-L163 HydrophobicContact CD2-CD2 4.35Å; F160-L163 HydrophobicContact CE2-CD2 4.36Å; F160-L163 WeakPolarHBondContact O-CB 3.45Å; F160-L163 PolarHBondContact O-N 2.87Å; F160-L164 HydrophobicContact CD1-CD1 4.49Å; F160-L164 HydrophobicContact CE1-CB 4.35Å; F160-L164 HydrophobicContact CE1-CD1 3.72Å; F160-L164 HydrophobicContact CZ-CD1 4.18Å; F160-L164 WeakPolarHBondContact O-CB 3.26Å; F160-L164 PolarHBondContact O-N 3.42Å; F160-Y203 HydrophobicContact CB-CE2 4.34Å |
| 161 | Y | 95.4 | Very high | 93.7 | Very high | 13 Ų | 13 | 12.6 Ų | 12.6 | 5% | 0.051 | 6% | 0.063 | C | C | . | . | H | α-helix | trans | -60.3 | -49.3 | -176.6 | 173.5 | -109.2 | 0 | 0 | 0 | 113.9 | M49 L52 F53 F80 L84 W87 L157 L163 L164 V165 | M49-Y161 HydrophobicContact CB-CD1 4.2Å; M49-Y161 HydrophobicContact CB-CE1 3.45Å; M49-Y161 VanDerWaalsContact CB-CE1 3.45Å; M49-Y161 HydrophobicContact CE-CD2 4.06Å; M49-Y161 HydrophobicContact CE-CE2 3.99Å; M49-Y161 HydrophobicContact CG-CD1 4.03Å; M49-Y161 HydrophobicContact CG-CE1 3.64Å; M49-Y161 HydrophobicContact CG-CE2 4.29Å; M49-Y161 HydrophobicContact CG-CG 4.48Å; M49-Y161 HydrophobicContact SD-CE1 4.31Å; M49-Y161 HydrophobicContact SD-CE2 3.95Å; L52-Y161 HydrophobicContact CD1-CD1 3.94Å; F53-Y161 HydrophobicContact CD2-CE1 4.31Å; F53-Y161 HydrophobicContact CE2-CD1 4.03Å; F53-Y161 AromaticContact CE2-CE1 3.36Å; F53-Y161 HydrophobicContact CE2-CE1 3.36Å; F53-Y161 HydrophobicContact CZ-CD1 4.26Å; F53-Y161 AromaticContact CZ-CE1 3.92Å; F53-Y161 HydrophobicContact CZ-CE1 3.92Å; F80-Y161 HydrophobicContact CZ-CG 4.49Å; L84-Y161 HydrophobicContact CD1-CD2 3.74Å; L84-Y161 HydrophobicContact CD1-CG 4.39Å; W87-Y161 AromaticContact CD1-CE2 3.71Å; W87-Y161 HydrophobicContact CD2-CE2 4.35Å; W87-Y161 AromaticContact CG-CE2 4Å; W87-Y161 HydrophobicContact CG-CE2 4Å; W87-Y161 AromaticContact NE1-CE2 3.96Å; L157-Y161 PolarHBondContact O-N 3.36Å; L157-Y161 VanDerWaalsContact O-N 3.16Å; Y161-L163 VanDerWaalsContact C-N 3.35Å; Y161-L163 PolarHBondContact O-N 3.42Å; Y161-L164 WeakPolarHBondContact O-CB 3.31Å; Y161-L164 PolarHBondContact O-N 2.93Å; Y161-V165 HydrophobicContact CD2-CG2 4.26Å; Y161-V165 HydrophobicContact CE1-CG2 4.44Å; Y161-V165 HydrophobicContact CE2-CG2 3.79Å; Y161-V165 WeakPolarHBondContact O-CG2 3.48Å; Y161-V165 PolarHBondContact O-N 2.97Å |
| 162 | P | 95.7 | Very high | 93.4 | Very high | 0 Ų | 0 | 13.5 Ų | 13.5 | 0% | 0 | 7% | 0.067 | C | C | . | . | H | α-helix | trans | -62.1 | -39.1 | 173.7 | -30.3 | 41.4 | 0 | 0 | 0 | 113.9 | L52 F53 N158 L164 V165 I166 Y202 I206 | L52-P162 HydrophobicContact CB-CG 3.91Å; F53-P162 HydrophobicContact CD1-CB 4.23Å; F53-P162 HydrophobicContact CE1-CB 3.6Å; F53-P162 HydrophobicContact CE1-CG 4.07Å; F53-P162 HydrophobicContact CZ-CB 4.06Å; F53-P162 HydrophobicContact CZ-CG 4.2Å; N158-P162 WeakPolarHBondContact O-CD 3.38Å; P162-L164 VanDerWaalsContact C-N 3.32Å; P162-L164 PolarHBondContact O-N 3.41Å; P162-V165 PolarHBondContact O-N 3.36Å; P162-I166 WeakPolarHBondContact O-CD1 3.48Å; P162-I166 VanDerWaalsContact O-CG1 3.25Å; P162-I166 WeakPolarHBondContact O-CG1 3.41Å; P162-I166 PolarHBondContact O-N 3.13Å; P162-Y202 HydrophobicContact CB-CD1 4.3Å; P162-I206 HydrophobicContact CB-CD1 4.28Å; P162-I206 HydrophobicContact CG-CD1 3.59Å |
| 163 | L | 95.3 | Very high | 92.5 | Very high | 28 Ų | 28 | 20.1 Ų | 20.1 | 15% | 0.147 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -58 | -46.6 | 174.5 | 178 | 154.1 | 0 | 0 | 0 | 110.8 | F160 Y161 I166 L167 A199 Y203 | F160-L163 HydrophobicContact CD2-CD2 4.35Å; F160-L163 HydrophobicContact CE2-CD2 4.36Å; F160-L163 WeakPolarHBondContact O-CB 3.45Å; F160-L163 PolarHBondContact O-N 2.87Å; Y161-L163 VanDerWaalsContact C-N 3.35Å; Y161-L163 PolarHBondContact O-N 3.42Å; L163-I166 PolarHBondContact O-N 3.21Å; L163-L167 HydrophobicContact CD2-CD1 3.83Å; L163-L167 HydrophobicContact CG-CD1 3.92Å; L163-L167 WeakPolarHBondContact O-CB 3.34Å; L163-L167 WeakPolarHBondContact O-CG 3.36Å; L163-L167 PolarHBondContact O-N 2.76Å; L163-A199 HydrophobicContact CG-CB 4.2Å; L163-Y203 HydrophobicContact CD1-CD2 3.96Å; L163-Y203 HydrophobicContact CD1-CG 4.22Å |
| 164 | L | 94.4 | Very high | 91.6 | Very high | 0 Ų | 0 | 22.8 Ų | 22.8 | 0% | 0 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -60.3 | -47 | 175.9 | 176.1 | 158.1 | 0 | 0 | 0 | 111.8 | L84 W87 L88 F160 Y161 P162 I166 H168 F169 | L84-L164 HydrophobicContact CD1-CD1 4.09Å; W87-L164 HydrophobicContact CB-CD2 4.2Å; L88-L164 HydrophobicContact CD2-CD1 3.24Å; L88-L164 HydrophobicContact CD2-CG 4.5Å; L88-L164 HydrophobicContact CG-CD1 3.55Å; F160-L164 HydrophobicContact CD1-CD1 4.49Å; F160-L164 HydrophobicContact CE1-CB 4.35Å; F160-L164 HydrophobicContact CE1-CD1 3.72Å; F160-L164 HydrophobicContact CZ-CD1 4.18Å; F160-L164 WeakPolarHBondContact O-CB 3.26Å; F160-L164 PolarHBondContact O-N 3.42Å; Y161-L164 WeakPolarHBondContact O-CB 3.31Å; Y161-L164 PolarHBondContact O-N 2.93Å; P162-L164 VanDerWaalsContact C-N 3.32Å; P162-L164 PolarHBondContact O-N 3.41Å; L164-I166 VanDerWaalsContact C-N 3.32Å; L164-I166 PolarHBondContact O-N 3.49Å; L164-H168 HydrophobicContact CG-CB 4.41Å; L164-H168 WeakPolarHBondContact O-CA 3.5Å; L164-H168 WeakPolarHBondContact O-CB 3.36Å; L164-H168 PolarHBondContact O-N 2.9Å; L164-F169 HydrophobicContact CD2-CD2 3.88Å; L164-F169 HydrophobicContact CD2-CE2 3.71Å |
| 165 | V | 93.6 | Very high | 90.5 | Very high | 21 Ų | 21 | 23.4 Ų | 23.4 | 13% | 0.127 | 11% | 0.111 | C | C | . | . | I | π-helix | trans | -64.2 | -40.2 | 179.8 | 172.5 | 0 | 0 | 0 | 0 | 111.1 | F53 Y161 P162 F169 L170 | F53-V165 HydrophobicContact CE1-CB 4.13Å; F53-V165 HydrophobicContact CE1-CG1 4.21Å; F53-V165 HydrophobicContact CE2-CG2 4.29Å; F53-V165 HydrophobicContact CZ-CB 3.57Å; F53-V165 HydrophobicContact CZ-CG1 3.78Å; F53-V165 HydrophobicContact CZ-CG2 3.67Å; Y161-V165 HydrophobicContact CD2-CG2 4.26Å; Y161-V165 HydrophobicContact CE1-CG2 4.44Å; Y161-V165 HydrophobicContact CE2-CG2 3.79Å; Y161-V165 WeakPolarHBondContact O-CG2 3.48Å; Y161-V165 PolarHBondContact O-N 2.97Å; P162-V165 PolarHBondContact O-N 3.36Å; V165-F169 HydrophobicContact CG1-CB 4.47Å; V165-F169 WeakPolarHBondContact O-CA 3.4Å; V165-F169 VanDerWaalsContact O-CB 3.26Å; V165-F169 WeakPolarHBondContact O-CB 3.43Å; V165-F169 PolarHBondContact O-N 3.49Å; V165-F169 VanDerWaalsContact O-N 3.15Å; V165-L170 PolarHBondContact O-N 3.34Å |
| 166 | I | 94 | Very high | 89 | Confident | 9 Ų | 9 | 27.7 Ų | 27.7 | 5% | 0.046 | 13% | 0.134 | C | C | . | . | I | π-helix | trans | -68.1 | -49.3 | 179.4 | -64.8 | 160.7 | 0 | 0 | 0 | 110.9 | P162 L163 L164 L170 Q171 L195 I198 A199 Y202 | P162-I166 WeakPolarHBondContact O-CD1 3.48Å; P162-I166 VanDerWaalsContact O-CG1 3.25Å; P162-I166 WeakPolarHBondContact O-CG1 3.41Å; P162-I166 PolarHBondContact O-N 3.13Å; L163-I166 PolarHBondContact O-N 3.21Å; L164-I166 VanDerWaalsContact C-N 3.32Å; L164-I166 PolarHBondContact O-N 3.49Å; I166-L170 HydrophobicContact CG1-CD1 4.37Å; I166-L170 WeakPolarHBondContact O-CB 3.48Å; I166-Q171 VanDerWaalsContact O-CB 3.32Å; I166-Q171 WeakPolarHBondContact O-CB 3.25Å; I166-Q171 PolarHBondContact O-N 3.37Å; I166-L195 HydrophobicContact CG2-CB 4.36Å; I166-L195 HydrophobicContact CG2-CD2 4.21Å; I166-I198 HydrophobicContact CD1-CG2 4.1Å; I166-A199 HydrophobicContact CB-CB 4.05Å; I166-A199 HydrophobicContact CD1-CB 4.31Å; I166-A199 HydrophobicContact CG2-CB 3.88Å; I166-Y202 HydrophobicContact CD1-CD2 4.1Å; I166-Y202 HydrophobicContact CD1-CG 4.45Å |
| 167 | L | 92.4 | Very high | 87 | Confident | 2 Ų | 2 | 35.9 Ų | 35.9 | 1% | 0.01 | 17% | 0.172 | C | C | . | . | I | π-helix | trans | -86.2 | -27.9 | -172.3 | -60.5 | -177.6 | 0 | 0 | 0 | 114.4 | L163 Q171 W196 A199 | L163-L167 HydrophobicContact CD2-CD1 3.83Å; L163-L167 HydrophobicContact CG-CD1 3.92Å; L163-L167 WeakPolarHBondContact O-CB 3.34Å; L163-L167 WeakPolarHBondContact O-CG 3.36Å; L163-L167 PolarHBondContact O-N 2.76Å; L167-Q171 WeakPolarHBondContact O-CB 3.4Å; L167-W196 HydrophobicContact CD1-CD2 4.01Å; L167-W196 HydrophobicContact CD1-CE3 3.6Å; L167-W196 HydrophobicContact CD1-CH2 3.79Å; L167-W196 HydrophobicContact CD1-CZ2 4.16Å; L167-W196 HydrophobicContact CD1-CZ3 3.48Å; L167-W196 VanDerWaalsContact CD1-CZ3 3.48Å; L167-W196 HydrophobicContact CD2-CD2 3.92Å; L167-W196 HydrophobicContact CD2-CE3 4.28Å; L167-W196 HydrophobicContact CD2-CG 4.08Å; L167-A199 HydrophobicContact CD1-CB 3.94Å; L167-A199 HydrophobicContact CD2-CB 3.7Å; L167-A199 HydrophobicContact CG-CB 3.61Å |
| 168 | H | 88.9 | Confident | 84.8 | Confident | 14 Ų | 14 | 39.7 Ų | 39.7 | 7% | 0.065 | 19% | 0.192 | C | C | . | . | I | π-helix | trans | -107.4 | -20.5 | -176.1 | -64.7 | 51.2 | 0 | 0 | 0 | 114 | F95 L164 L172 Y252 | F95-H168 HydrophobicContact CE2-CB 3.73Å; F95-H168 AromaticContact CE2-CD2 3.54Å; F95-H168 AromaticContact CE2-CG 3.65Å; L164-H168 HydrophobicContact CG-CB 4.41Å; L164-H168 WeakPolarHBondContact O-CA 3.5Å; L164-H168 WeakPolarHBondContact O-CB 3.36Å; L164-H168 PolarHBondContact O-N 2.9Å; H168-L172 VanDerWaalsContact O-CB 3.31Å; H168-L172 WeakPolarHBondContact O-CB 3.17Å; H168-Y252 PolarHBondContact NE2-OH 3.11Å |
| 169 | F | 87.8 | Confident | 82.8 | Confident | 31 Ų | 31 | 46 Ų | 46 | 14% | 0.136 | 23% | 0.23 | C | C | . | . | I | π-helix | trans | -106.2 | -62.7 | 173.6 | -76.3 | -93.8 | 0 | 0 | 0 | 111.8 | W87 V90 S91 L164 V165 L172 F173 | W87-F169 HydrophobicContact CB-CE2 4.38Å; W87-F169 HydrophobicContact CD2-CZ 4.45Å; W87-F169 HydrophobicContact CE3-CD1 4.42Å; W87-F169 HydrophobicContact CE3-CD2 4.22Å; W87-F169 AromaticContact CE3-CE1 3.8Å; W87-F169 HydrophobicContact CE3-CE1 3.8Å; W87-F169 AromaticContact CE3-CE2 3.53Å; W87-F169 HydrophobicContact CE3-CE2 3.53Å; W87-F169 AromaticContact CE3-CZ 3.33Å; W87-F169 HydrophobicContact CE3-CZ 3.33Å; W87-F169 HydrophobicContact CZ3-CD1 4.19Å; W87-F169 AromaticContact CZ3-CE1 3.79Å; W87-F169 HydrophobicContact CZ3-CE1 3.79Å; W87-F169 HydrophobicContact CZ3-CE2 4.22Å; W87-F169 AromaticContact CZ3-CZ 3.84Å; W87-F169 HydrophobicContact CZ3-CZ 3.84Å; W87-F169 WeakPolarHBondContact O-CE2 3.49Å; W87-F169 WeakPolarHBondContact O-CZ 3.41Å; V90-F169 HydrophobicContact CB-CE1 4.4Å; V90-F169 HydrophobicContact CB-CZ 4.01Å; V90-F169 HydrophobicContact CG1-CE1 3.71Å; V90-F169 HydrophobicContact CG1-CZ 3.83Å; S91-F169 VanDerWaalsContact CB-CE2 3.44Å; L164-F169 HydrophobicContact CD2-CD2 3.88Å; L164-F169 HydrophobicContact CD2-CE2 3.71Å; V165-F169 HydrophobicContact CG1-CB 4.47Å; V165-F169 WeakPolarHBondContact O-CA 3.4Å; V165-F169 VanDerWaalsContact O-CB 3.26Å; V165-F169 WeakPolarHBondContact O-CB 3.43Å; V165-F169 PolarHBondContact O-N 3.49Å; V165-F169 VanDerWaalsContact O-N 3.15Å; F169-L172 WeakPolarHBondContact O-CB 3.44Å; F169-L172 PolarHBondContact O-N 3.18Å; F169-F173 WeakPolarHBondContact O-CD2 3.35Å; F169-F173 WeakPolarHBondContact O-CE2 3.42Å |
| 170 | L | 88.1 | Confident | 80.7 | Confident | 85 Ų | 85 | 47.3 Ų | 47.3 | 45% | 0.445 | 24% | 0.238 | S | C | . | . | I | π-helix | trans | -63.4 | -53.7 | -175 | -63.4 | 179.9 | 0 | 0 | 0 | 110.6 | V165 I166 L172 F173 F174 | V165-L170 PolarHBondContact O-N 3.34Å; I166-L170 HydrophobicContact CG1-CD1 4.37Å; I166-L170 WeakPolarHBondContact O-CB 3.48Å; L170-L172 PolarHBondContact O-N 3.45Å; L170-F173 PolarHBondContact O-N 3.44Å; L170-F174 WeakPolarHBondContact O-CD2 3.33Å; L170-F174 VanDerWaalsContact O-CE2 3.29Å; L170-F174 WeakPolarHBondContact O-CE2 3.44Å |
| 171 | Q | 87.8 | Confident | 78.8 | Confident | 0 Ų | 0 | 46.6 Ų | 46.6 | 0% | 0 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -59 | -35.2 | -180 | -174.7 | 170.4 | -59.9 | 0 | 0 | 112.7 | I166 L167 F173 F174 I175 L195 T245 | I166-Q171 VanDerWaalsContact O-CB 3.32Å; I166-Q171 WeakPolarHBondContact O-CB 3.25Å; I166-Q171 PolarHBondContact O-N 3.37Å; L167-Q171 WeakPolarHBondContact O-CB 3.4Å; Q171-F173 VanDerWaalsContact C-N 3.3Å; Q171-F173 PolarHBondContact O-N 2.96Å; Q171-F174 WeakPolarHBondContact O-CA 3.3Å; Q171-F174 WeakPolarHBondContact O-CB 3.43Å; Q171-F174 PolarHBondContact O-N 3.04Å; Q171-I175 WeakPolarHBondContact O-CG1 3.36Å; Q171-I175 PolarHBondContact O-N 3.05Å; Q171-L195 HydrophobicContact CB-CD1 3.87Å; Q171-L195 HydrophobicContact CG-CD1 3.92Å; Q171-T245 HydrophobicContact CG-CG2 4.23Å; Q171-T245 PolarHBondContact NE2-OG1 2.89Å |
| 172 | L | 85.8 | Confident | 76.8 | Confident | 20 Ų | 20 | 50.7 Ų | 50.7 | 11% | 0.105 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -58.5 | -38.6 | -179.3 | -174.2 | 70.8 | 0 | 0 | 0 | 112.7 | F95 V98 H168 F169 L170 F174 I175 | F95-L172 HydrophobicContact CD1-CD1 3.78Å; F95-L172 HydrophobicContact CD2-CD1 4.21Å; F95-L172 HydrophobicContact CE1-CD1 3.89Å; F95-L172 HydrophobicContact CE2-CD1 4.31Å; F95-L172 HydrophobicContact CG-CD1 3.95Å; F95-L172 HydrophobicContact CZ-CD1 4.15Å; V98-L172 HydrophobicContact CB-CD1 3.85Å; V98-L172 HydrophobicContact CG1-CD1 4.08Å; V98-L172 HydrophobicContact CG2-CD1 3.7Å; V98-L172 HydrophobicContact CG2-CG 4Å; H168-L172 VanDerWaalsContact O-CB 3.31Å; H168-L172 WeakPolarHBondContact O-CB 3.17Å; F169-L172 WeakPolarHBondContact O-CB 3.44Å; F169-L172 PolarHBondContact O-N 3.18Å; L170-L172 PolarHBondContact O-N 3.45Å; L172-F174 PolarHBondContact O-N 2.88Å; L172-I175 HydrophobicContact CD1-CD1 4.3Å; L172-I175 PolarHBondContact O-N 3.1Å; L172-I175 VanDerWaalsContact O-N 3.16Å |
| 173 | F | 78.4 | Confident | 75 | Confident | 140 Ų | 140 | 52.1 Ų | 52.1 | 61% | 0.614 | 27% | 0.267 | S | S | * | . | H | α-helix | trans | -61.9 | -31.2 | 175.6 | -67.5 | -72 | 0 | 0 | 0 | 112.8 | F169 L170 Q171 | F169-F173 WeakPolarHBondContact O-CD2 3.35Å; F169-F173 WeakPolarHBondContact O-CE2 3.42Å; L170-F173 PolarHBondContact O-N 3.44Å; Q171-F173 VanDerWaalsContact C-N 3.3Å; Q171-F173 PolarHBondContact O-N 2.96Å |
| 174 | F | 74.9 | Confident | 73.7 | Confident | 81 Ų | 81 | 57.6 Ų | 57.6 | 36% | 0.355 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -84.5 | -12.4 | 179.5 | -58.1 | -82.6 | 0 | 0 | 0 | 113.3 | L170 Q171 L172 L178 I181 L195 | L170-F174 WeakPolarHBondContact O-CD2 3.33Å; L170-F174 VanDerWaalsContact O-CE2 3.29Å; L170-F174 WeakPolarHBondContact O-CE2 3.44Å; Q171-F174 WeakPolarHBondContact O-CA 3.3Å; Q171-F174 WeakPolarHBondContact O-CB 3.43Å; Q171-F174 PolarHBondContact O-N 3.04Å; L172-F174 PolarHBondContact O-N 2.88Å; F174-L178 HydrophobicContact CD1-CD1 3.61Å; F174-L178 HydrophobicContact CE1-CD1 4.28Å; F174-L178 VanDerWaalsContact O-O 3.09Å; F174-I181 HydrophobicContact CB-CD1 3.48Å; F174-I181 VanDerWaalsContact CB-CD1 3.48Å; F174-I181 HydrophobicContact CB-CG1 4.44Å; F174-I181 HydrophobicContact CG-CD1 4.47Å; F174-L195 HydrophobicContact CD2-CD1 4.34Å |
| 175 | I | 72.5 | Confident | 73 | Confident | 20 Ų | 20 | 66.3 Ų | 66.3 | 10% | 0.103 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -72.7 | -39.4 | 180 | -67.6 | 173.6 | 0 | 0 | 0 | 111.4 | F95 V98 Q171 L172 T245 | F95-I175 HydrophobicContact CE1-CD1 3.95Å; V98-I175 HydrophobicContact CG1-CB 4.03Å; V98-I175 HydrophobicContact CG1-CG2 3.51Å; Q171-I175 WeakPolarHBondContact O-CG1 3.36Å; Q171-I175 PolarHBondContact O-N 3.05Å; L172-I175 HydrophobicContact CD1-CD1 4.3Å; L172-I175 PolarHBondContact O-N 3.1Å; L172-I175 VanDerWaalsContact O-N 3.16Å; I175-T245 HydrophobicContact CD1-CG2 4.17Å; I175-T245 HydrophobicContact CG1-CG2 4.22Å |
| 176 | N | 63.2 | Low | 72.7 | Confident | 91 Ų | 91 | 70.2 Ų | 70.2 | 49% | 0.487 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -100.4 | -42.7 | -175.4 | -109.2 | -0.3 | 0 | 0 | 0 | 114.6 | V98 L178 | V98-N176 HydrophobicContact CG1-CB 4.3Å; N176-L178 VanDerWaalsContact C-N 3.35Å |
| 177 | H | 55.5 | Low | 72.2 | Confident | 177 Ų | 177 | 73.7 Ų | 73.7 | 82% | 0.819 | 36% | 0.364 | S | S | * | . | S | Bend | trans | -80.1 | -16.9 | -174.3 | -86.2 | -67 | 0 | 0 | 0 | 114.3 | ||
| 178 | L | 49.7 | Very low | 71.8 | Confident | 82 Ų | 82 | 73.6 Ų | 73.6 | 43% | 0.429 | 36% | 0.363 | S | S | . | . | trans | -121.4 | 111.6 | 173.1 | -80.7 | 148.9 | 0 | 0 | 0 | 106.2 | F174 N176 V180 | F174-L178 HydrophobicContact CD1-CD1 3.61Å; F174-L178 HydrophobicContact CE1-CD1 4.28Å; F174-L178 VanDerWaalsContact O-O 3.09Å; N176-L178 VanDerWaalsContact C-N 3.35Å; L178-V180 HydrophobicContact CB-CB 4Å; L178-V180 HydrophobicContact CB-CG2 3.85Å; L178-V180 HydrophobicContact CD2-CG2 3.75Å; L178-V180 HydrophobicContact CG-CG2 4.43Å; L178-V180 PolarHBondContact O-N 3.12Å | ||
| 179 | V | 52.1 | Low | 71.7 | Confident | 133 Ų | 133 | 74.5 Ų | 74.5 | 81% | 0.806 | 37% | 0.366 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.1 | 27.2 | 167 | 178.6 | 0 | 0 | 0 | 0 | 111.6 | S183 | V179-S183 WeakPolarHBondContact O-CB 3.43Å; V179-S183 PolarHBondContact O-OG 3.33Å |
| 180 | V | 52.8 | Low | 71.8 | Confident | 28 Ų | 28 | 76.7 Ų | 76.7 | 17% | 0.17 | 38% | 0.376 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -100.6 | -50.9 | -167.6 | 179.4 | 0 | 0 | 0 | 0 | 108.7 | L178 N182 S183 L187 G188 | L178-V180 HydrophobicContact CB-CB 4Å; L178-V180 HydrophobicContact CB-CG2 3.85Å; L178-V180 HydrophobicContact CD2-CG2 3.75Å; L178-V180 HydrophobicContact CG-CG2 4.43Å; L178-V180 PolarHBondContact O-N 3.12Å; V180-N182 PolarHBondContact O-N 3.2Å; V180-S183 PolarHBondContact O-N 2.83Å; V180-S183 PolarHBondContact O-OG 3.32Å; V180-L187 HydrophobicContact CG1-CB 3.88Å; V180-L187 HydrophobicContact CG1-CD2 3.99Å; V180-L187 HydrophobicContact CG1-CG 3.73Å; V180-G188 VanDerWaalsContact C-CA 3.45Å; V180-G188 WeakPolarHBondContact O-CA 3.47Å |
| 181 | I | 56 | Low | 71.9 | Confident | 3 Ų | 3 | 74.9 Ų | 74.9 | 2% | 0.015 | 37% | 0.368 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -78.2 | -16.5 | -170.6 | -54.3 | -179 | 0 | 0 | 0 | 114.1 | F174 V191 N243 T245 | F174-I181 HydrophobicContact CB-CD1 3.48Å; F174-I181 VanDerWaalsContact CB-CD1 3.48Å; F174-I181 HydrophobicContact CB-CG1 4.44Å; F174-I181 HydrophobicContact CG-CD1 4.47Å; I181-V191 HydrophobicContact CD1-CG1 4.09Å; I181-V191 HydrophobicContact CG1-CG1 4.49Å; I181-N243 PolarHBondContact O-ND2 3.45Å; I181-T245 HydrophobicContact CG2-CG2 3.38Å |
| 182 | N | 53.2 | Low | 72 | Confident | 100 Ų | 100 | 74.9 Ų | 74.9 | 54% | 0.535 | 37% | 0.368 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -101.2 | 8.7 | 172.2 | -151.6 | 18.3 | 0 | 0 | 0 | 113.1 | V180 Q246 | V180-N182 PolarHBondContact O-N 3.2Å; N182-Q246 WeakPolarHBondContact OD1-CG 3.33Å |
| 183 | S | 59.8 | Low | 72.3 | Confident | 29 Ų | 29 | 74 Ų | 74 | 20% | 0.203 | 36% | 0.363 | C | S | . | . | S | Bend | trans | -96.8 | 151 | 177.7 | 73.1 | 0 | 0 | 0 | 0 | 111 | V179 V180 W185 | V179-S183 WeakPolarHBondContact O-CB 3.43Å; V179-S183 PolarHBondContact O-OG 3.33Å; V180-S183 PolarHBondContact O-N 2.83Å; V180-S183 PolarHBondContact O-OG 3.32Å; S183-W185 PolarHBondContact O-N 3.21Å; S183-W185 VanDerWaalsContact O-N 3.08Å; S183-W185 WeakPolarHBondContact OG-CB 3.48Å; S183-W185 PolarHBondContact OG-N 3.19Å |
| 184 | D | 67.9 | Low | 73.1 | Confident | 143 Ų | 143 | 69 Ų | 69 | 77% | 0.765 | 35% | 0.345 | S | S | * | . | S | Bend | trans | -72.2 | 7.2 | 171.8 | -58.2 | -41.4 | 0 | 0 | 0 | 112.5 | ||
| 185 | W | 79.8 | Confident | 74 | Confident | 183 Ų | 183 | 66.4 Ų | 66.4 | 69% | 0.693 | 33% | 0.334 | S | S | * | . | S | Bend | trans | -76.3 | 145.8 | 179.9 | -168.7 | -109 | 0 | 0 | 0 | 111.6 | S183 L187 G188 Y189 | S183-W185 PolarHBondContact O-N 3.21Å; S183-W185 VanDerWaalsContact O-N 3.08Å; S183-W185 WeakPolarHBondContact OG-CB 3.48Å; S183-W185 PolarHBondContact OG-N 3.19Å; W185-L187 VanDerWaalsContact C-N 3.28Å; W185-L187 PolarHBondContact O-N 3.32Å; W185-G188 WeakPolarHBondContact O-CA 3.41Å; W185-G188 PolarHBondContact O-N 2.8Å; W185-Y189 WeakPolarHBondContact O-CD1 3.36Å |
| 186 | F | 85.5 | Confident | 75.1 | Confident | 103 Ų | 103 | 67.8 Ų | 67.8 | 45% | 0.452 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -49.8 | -46.1 | -179 | 173.5 | -95.5 | 0 | 0 | 0 | 113.6 | G188 Y189 F190 I238 | F186-G188 PolarHBondContact O-N 2.98Å; F186-Y189 VanDerWaalsContact CA-CE1 3.48Å; F186-Y189 VanDerWaalsContact CA-CZ 3.45Å; F186-Y189 AromaticContact CD2-CE2 3.73Å; F186-Y189 HydrophobicContact CD2-CE2 3.73Å; F186-Y189 AromaticContact CD2-CZ 3.81Å; F186-Y189 WeakPolarHBondContact CD2-OH 3.29Å; F186-Y189 HydrophobicContact CE2-CE2 4.27Å; F186-Y189 HydrophobicContact CG-CE2 4.47Å; F186-F190 HydrophobicContact CE1-CB 4.21Å; F186-F190 HydrophobicContact CE1-CD2 4.42Å; F186-F190 HydrophobicContact CE1-CG 4.25Å; F186-F190 HydrophobicContact CZ-CB 4.27Å; F186-F190 AromaticContact CZ-CD2 3.98Å; F186-F190 HydrophobicContact CZ-CD2 3.98Å; F186-F190 HydrophobicContact CZ-CG 4.23Å; F186-F190 WeakPolarHBondContact O-CB 3.4Å; F186-F190 PolarHBondContact O-N 3.36Å; F186-I238 HydrophobicContact CE2-CG2 3.84Å |
| 187 | L | 84.5 | Confident | 76.7 | Confident | 82 Ų | 82 | 65.9 Ų | 65.9 | 43% | 0.429 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -61.8 | -29.3 | -179 | -167.1 | 64 | 0 | 0 | 0 | 112.3 | V180 W185 V191 | V180-L187 HydrophobicContact CG1-CB 3.88Å; V180-L187 HydrophobicContact CG1-CD2 3.99Å; V180-L187 HydrophobicContact CG1-CG 3.73Å; W185-L187 VanDerWaalsContact C-N 3.28Å; W185-L187 PolarHBondContact O-N 3.32Å; L187-V191 HydrophobicContact CD1-CG2 4.12Å; L187-V191 HydrophobicContact CG-CG2 4.29Å; L187-V191 WeakPolarHBondContact O-CB 3.47Å; L187-V191 VanDerWaalsContact O-CG2 3.25Å; L187-V191 WeakPolarHBondContact O-CG2 3.5Å; L187-V191 PolarHBondContact O-N 2.89Å |
| 188 | G | 83.6 | Confident | 78.7 | Confident | 0 Ų | 0 | 61 Ų | 61 | 0% | 0 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -63.5 | -65.9 | -179.1 | 0 | 0 | 0 | 0 | 0 | 113.9 | V180 W185 F186 F190 V191 G192 | V180-G188 VanDerWaalsContact C-CA 3.45Å; V180-G188 WeakPolarHBondContact O-CA 3.47Å; W185-G188 WeakPolarHBondContact O-CA 3.41Å; W185-G188 PolarHBondContact O-N 2.8Å; F186-G188 PolarHBondContact O-N 2.98Å; G188-F190 VanDerWaalsContact C-N 3.27Å; G188-F190 PolarHBondContact O-N 3.38Å; G188-V191 PolarHBondContact O-N 3.26Å; G188-G192 PolarHBondContact O-N 3.24Å |
| 189 | Y | 87 | Confident | 80.9 | Confident | 34 Ų | 34 | 57.1 Ų | 57.1 | 13% | 0.133 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -69.1 | -26.8 | 177.2 | 58.4 | -103.4 | 0 | 0 | 0 | 111.8 | W185 F186 N193 I238 | W185-Y189 WeakPolarHBondContact O-CD1 3.36Å; F186-Y189 VanDerWaalsContact CA-CE1 3.48Å; F186-Y189 VanDerWaalsContact CA-CZ 3.45Å; F186-Y189 AromaticContact CD2-CE2 3.73Å; F186-Y189 HydrophobicContact CD2-CE2 3.73Å; F186-Y189 AromaticContact CD2-CZ 3.81Å; F186-Y189 WeakPolarHBondContact CD2-OH 3.29Å; F186-Y189 HydrophobicContact CE2-CE2 4.27Å; F186-Y189 HydrophobicContact CG-CE2 4.47Å; Y189-N193 WeakPolarHBondContact O-CA 3.22Å; Y189-N193 WeakPolarHBondContact O-CB 3.25Å; Y189-N193 PolarHBondContact O-N 3.38Å; Y189-N193 PolarHBondContact O-ND2 2.99Å; Y189-N193 VanDerWaalsContact O-ND2 3.16Å; Y189-I238 HydrophobicContact CD2-CD1 3.86Å; Y189-I238 HydrophobicContact CE2-CD1 4.33Å; Y189-I238 HydrophobicContact CE2-CG2 4.3Å |
| 190 | F | 90.1 | Very high | 83.1 | Confident | 77 Ų | 77 | 53.4 Ų | 53.4 | 34% | 0.338 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -61.8 | -53.6 | 173 | 179.7 | -99.4 | 0 | 0 | 0 | 112.1 | F186 G188 T194 Y234 I238 | F186-F190 HydrophobicContact CE1-CB 4.21Å; F186-F190 HydrophobicContact CE1-CD2 4.42Å; F186-F190 HydrophobicContact CE1-CG 4.25Å; F186-F190 HydrophobicContact CZ-CB 4.27Å; F186-F190 AromaticContact CZ-CD2 3.98Å; F186-F190 HydrophobicContact CZ-CD2 3.98Å; F186-F190 HydrophobicContact CZ-CG 4.23Å; F186-F190 WeakPolarHBondContact O-CB 3.4Å; F186-F190 PolarHBondContact O-N 3.36Å; G188-F190 VanDerWaalsContact C-N 3.27Å; G188-F190 PolarHBondContact O-N 3.38Å; F190-T194 VanDerWaalsContact O-CB 3.28Å; F190-T194 WeakPolarHBondContact O-CB 3.42Å; F190-T194 PolarHBondContact O-N 3.14Å; F190-T194 PolarHBondContact O-OG1 3.37Å; F190-Y234 WeakPolarHBondContact CE2-OH 3.31Å; F190-I238 HydrophobicContact CB-CD1 4.27Å; F190-I238 HydrophobicContact CD2-CD1 4.05Å |
| 191 | V | 89.1 | Confident | 85.2 | Confident | 46 Ų | 46 | 52.5 Ų | 52.5 | 28% | 0.279 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -65.7 | -46.7 | 179.7 | 173 | 0 | 0 | 0 | 0 | 110.7 | I181 L187 G188 T194 L195 | I181-V191 HydrophobicContact CD1-CG1 4.09Å; I181-V191 HydrophobicContact CG1-CG1 4.49Å; L187-V191 HydrophobicContact CD1-CG2 4.12Å; L187-V191 HydrophobicContact CG-CG2 4.29Å; L187-V191 WeakPolarHBondContact O-CB 3.47Å; L187-V191 VanDerWaalsContact O-CG2 3.25Å; L187-V191 WeakPolarHBondContact O-CG2 3.5Å; L187-V191 PolarHBondContact O-N 2.89Å; G188-V191 PolarHBondContact O-N 3.26Å; V191-T194 PolarHBondContact O-N 2.93Å; V191-L195 PolarHBondContact O-N 3.11Å; V191-L195 VanDerWaalsContact O-N 3.09Å |
| 192 | G | 89.9 | Confident | 87.1 | Confident | 0 Ų | 0 | 56.2 Ų | 56.2 | 0% | 0 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -58.9 | -52.1 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | G188 T194 L195 W196 | G188-G192 PolarHBondContact O-N 3.24Å; G192-T194 VanDerWaalsContact C-N 3.28Å; G192-T194 PolarHBondContact O-N 3.39Å; G192-L195 PolarHBondContact O-N 2.94Å; G192-W196 VanDerWaalsContact O-CD1 3.3Å; G192-W196 PolarHBondContact O-N 2.98Å; G192-W196 VanDerWaalsContact O-N 3.1Å |
| 193 | N | 93.3 | Very high | 89.2 | Confident | 1 Ų | 1 | 52.9 Ų | 52.9 | 1% | 0.005 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -67 | -29.8 | -179.8 | -63.3 | -15.9 | 0 | 0 | 0 | 112.3 | Y189 W196 L197 Y234 S237 I238 W242 F244 | Y189-N193 WeakPolarHBondContact O-CA 3.22Å; Y189-N193 WeakPolarHBondContact O-CB 3.25Å; Y189-N193 PolarHBondContact O-N 3.38Å; Y189-N193 PolarHBondContact O-ND2 2.99Å; Y189-N193 VanDerWaalsContact O-ND2 3.16Å; N193-W196 PolarHBondContact O-N 3.19Å; N193-L197 WeakPolarHBondContact O-CB 3.48Å; N193-L197 PolarHBondContact O-N 3.43Å; N193-Y234 HydrophobicContact CB-CD2 3.99Å; N193-Y234 HydrophobicContact CB-CE2 3.86Å; N193-S237 WeakPolarHBondContact ND2-CB 3.36Å; N193-S237 PolarHBondContact ND2-OG 3.38Å; N193-I238 HydrophobicContact CB-CD1 4.17Å; N193-W242 PolarHBondContact ND2-O 3.14Å; N193-W242 PolarHBondContact OD1-O 3.27Å; N193-F244 HydrophobicContact CB-CD2 4.32Å; N193-F244 WeakPolarHBondContact OD1-CD2 3.42Å; N193-F244 PolarHBondContact OD1-N 3.27Å; N193-F244 VanDerWaalsContact OD1-N 3.15Å |
| 194 | T | 94.6 | Very high | 91 | Very high | 36 Ų | 36 | 52.8 Ų | 52.8 | 22% | 0.221 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -65.3 | -41.4 | 174 | -61.3 | 0 | 0 | 0 | 0 | 111 | F190 V191 G192 W196 L197 I198 Y234 | F190-T194 VanDerWaalsContact O-CB 3.28Å; F190-T194 WeakPolarHBondContact O-CB 3.42Å; F190-T194 PolarHBondContact O-N 3.14Å; F190-T194 PolarHBondContact O-OG1 3.37Å; V191-T194 PolarHBondContact O-N 2.93Å; G192-T194 VanDerWaalsContact C-N 3.28Å; G192-T194 PolarHBondContact O-N 3.39Å; T194-W196 VanDerWaalsContact C-N 3.35Å; T194-L197 WeakPolarHBondContact O-CB 3.19Å; T194-L197 PolarHBondContact O-N 3.45Å; T194-I198 HydrophobicContact CG2-CD1 3.89Å; T194-I198 HydrophobicContact CG2-CG1 4.45Å; T194-I198 VanDerWaalsContact O-CG1 3.25Å; T194-I198 WeakPolarHBondContact O-CG1 3.02Å; T194-I198 PolarHBondContact O-N 3.43Å; T194-Y234 PolarHBondContact OG1-OH 3.16Å; T194-Y234 VanDerWaalsContact OG1-OH 3.06Å |
| 195 | L | 94 | Very high | 92.4 | Very high | 27 Ų | 27 | 49.9 Ų | 49.9 | 14% | 0.141 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -63.2 | -41.3 | 174.5 | -68.6 | 172.3 | 0 | 0 | 0 | 111.6 | I166 Q171 F174 V191 G192 I198 A199 | I166-L195 HydrophobicContact CG2-CB 4.36Å; I166-L195 HydrophobicContact CG2-CD2 4.21Å; Q171-L195 HydrophobicContact CB-CD1 3.87Å; Q171-L195 HydrophobicContact CG-CD1 3.92Å; F174-L195 HydrophobicContact CD2-CD1 4.34Å; V191-L195 PolarHBondContact O-N 3.11Å; V191-L195 VanDerWaalsContact O-N 3.09Å; G192-L195 PolarHBondContact O-N 2.94Å; L195-I198 PolarHBondContact O-N 3.45Å; L195-A199 VanDerWaalsContact O-CB 3.25Å; L195-A199 WeakPolarHBondContact O-CB 3.39Å; L195-A199 PolarHBondContact O-N 3.35Å |
| 196 | W | 95.1 | Very high | 93.2 | Very high | 48 Ų | 48 | 41.1 Ų | 41.1 | 18% | 0.182 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -61.1 | -45.3 | 172.3 | -83.6 | 99 | 0 | 0 | 0 | 113.2 | L167 G192 N193 T194 I198 A199 I200 F244 T245 L248 | L167-W196 HydrophobicContact CD1-CD2 4.01Å; L167-W196 HydrophobicContact CD1-CE3 3.6Å; L167-W196 HydrophobicContact CD1-CH2 3.79Å; L167-W196 HydrophobicContact CD1-CZ2 4.16Å; L167-W196 HydrophobicContact CD1-CZ3 3.48Å; L167-W196 VanDerWaalsContact CD1-CZ3 3.48Å; L167-W196 HydrophobicContact CD2-CD2 3.92Å; L167-W196 HydrophobicContact CD2-CE3 4.28Å; L167-W196 HydrophobicContact CD2-CG 4.08Å; G192-W196 VanDerWaalsContact O-CD1 3.3Å; G192-W196 PolarHBondContact O-N 2.98Å; G192-W196 VanDerWaalsContact O-N 3.1Å; N193-W196 PolarHBondContact O-N 3.19Å; T194-W196 VanDerWaalsContact C-N 3.35Å; W196-I198 VanDerWaalsContact C-N 3.35Å; W196-I198 PolarHBondContact O-N 2.93Å; W196-A199 PolarHBondContact O-N 3.24Å; W196-I200 HydrophobicContact CE3-CD1 3.98Å; W196-I200 HydrophobicContact CE3-CG1 4.31Å; W196-I200 WeakPolarHBondContact O-CB 3.4Å; W196-I200 WeakPolarHBondContact O-CG1 3.48Å; W196-I200 PolarHBondContact O-N 2.94Å; W196-F244 HydrophobicContact CD2-CB 4.16Å; W196-F244 HydrophobicContact CG-CB 3.93Å; W196-T245 PolarHBondContact NE1-OG1 2.89Å; W196-L248 HydrophobicContact CH2-CD1 4.48Å; W196-L248 HydrophobicContact CZ2-CB 4.08Å; W196-L248 HydrophobicContact CZ2-CD1 4.39Å; W196-L248 HydrophobicContact CZ2-CD2 3.92Å; W196-L248 HydrophobicContact CZ2-CG 4.35Å |
| 197 | L | 97.2 | Very high | 93.8 | Very high | 51 Ų | 51 | 36.7 Ų | 36.7 | 27% | 0.267 | 18% | 0.177 | S | C | . | . | H | α-helix | trans | -57.4 | -48.4 | 175.2 | 173.5 | 64.3 | 0 | 0 | 0 | 110.8 | N193 T194 G201 L230 Y234 | N193-L197 WeakPolarHBondContact O-CB 3.48Å; N193-L197 PolarHBondContact O-N 3.43Å; T194-L197 WeakPolarHBondContact O-CB 3.19Å; T194-L197 PolarHBondContact O-N 3.45Å; L197-G201 WeakPolarHBondContact O-CA 3.48Å; L197-G201 PolarHBondContact O-N 3Å; L197-L230 HydrophobicContact CD1-CD1 4.25Å; L197-L230 HydrophobicContact CD1-CD2 3.8Å; L197-L230 HydrophobicContact CD1-CG 3.6Å; L197-Y234 HydrophobicContact CB-CD2 3.94Å; L197-Y234 HydrophobicContact CB-CE2 4.38Å; L197-Y234 HydrophobicContact CB-CG 4.4Å; L197-Y234 HydrophobicContact CD1-CG 4.47Å; L197-Y234 HydrophobicContact CD2-CD1 3.89Å; L197-Y234 HydrophobicContact CD2-CD2 3.96Å; L197-Y234 HydrophobicContact CD2-CE1 4.08Å; L197-Y234 HydrophobicContact CD2-CE2 4.16Å; L197-Y234 HydrophobicContact CD2-CG 3.83Å; L197-Y234 HydrophobicContact CG-CD2 4.44Å; L197-Y234 HydrophobicContact CG-CG 4.45Å |
| 198 | I | 96.8 | Very high | 94.4 | Very high | 76 Ų | 76 | 34 Ų | 34 | 39% | 0.39 | 16% | 0.162 | S | C | . | . | H | α-helix | trans | -64.6 | -45.5 | 179.2 | -65.7 | 166.4 | 0 | 0 | 0 | 110.4 | I166 T194 L195 W196 G201 Y202 | I166-I198 HydrophobicContact CD1-CG2 4.1Å; T194-I198 HydrophobicContact CG2-CD1 3.89Å; T194-I198 HydrophobicContact CG2-CG1 4.45Å; T194-I198 VanDerWaalsContact O-CG1 3.25Å; T194-I198 WeakPolarHBondContact O-CG1 3.02Å; T194-I198 PolarHBondContact O-N 3.43Å; L195-I198 PolarHBondContact O-N 3.45Å; W196-I198 VanDerWaalsContact C-N 3.35Å; W196-I198 PolarHBondContact O-N 2.93Å; I198-G201 PolarHBondContact O-N 3.21Å; I198-Y202 HydrophobicContact CG2-CD2 3.85Å; I198-Y202 HydrophobicContact CG2-CE2 4.09Å; I198-Y202 WeakPolarHBondContact O-CB 3.18Å; I198-Y202 WeakPolarHBondContact O-CD2 3.36Å; I198-Y202 PolarHBondContact O-N 3.45Å |
| 199 | A | 96.9 | Very high | 94.9 | Very high | 0 Ų | 0 | 34.8 Ų | 34.8 | 0% | 0 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -63.6 | -49.2 | -178 | 0 | 0 | 0 | 0 | 0 | 112.6 | L163 I166 L167 L195 W196 G201 Y202 Y203 | L163-A199 HydrophobicContact CG-CB 4.2Å; I166-A199 HydrophobicContact CB-CB 4.05Å; I166-A199 HydrophobicContact CD1-CB 4.31Å; I166-A199 HydrophobicContact CG2-CB 3.88Å; L167-A199 HydrophobicContact CD1-CB 3.94Å; L167-A199 HydrophobicContact CD2-CB 3.7Å; L167-A199 HydrophobicContact CG-CB 3.61Å; L195-A199 VanDerWaalsContact O-CB 3.25Å; L195-A199 WeakPolarHBondContact O-CB 3.39Å; L195-A199 PolarHBondContact O-N 3.35Å; W196-A199 PolarHBondContact O-N 3.24Å; A199-G201 VanDerWaalsContact C-N 3.33Å; A199-Y202 PolarHBondContact O-N 3.26Å; A199-Y203 PolarHBondContact O-N 3.48Å |
| 200 | I | 97.6 | Very high | 95.3 | Very high | 55 Ų | 55 | 33.2 Ų | 33.2 | 28% | 0.282 | 16% | 0.16 | S | C | . | . | H | α-helix | trans | -67.6 | -37.6 | 176.9 | -60.8 | 171.7 | 0 | 0 | 0 | 110 | W196 Y202 Y203 L204 L230 | W196-I200 HydrophobicContact CE3-CD1 3.98Å; W196-I200 HydrophobicContact CE3-CG1 4.31Å; W196-I200 WeakPolarHBondContact O-CB 3.4Å; W196-I200 WeakPolarHBondContact O-CG1 3.48Å; W196-I200 PolarHBondContact O-N 2.94Å; I200-Y202 PolarHBondContact O-N 3.23Å; I200-Y203 WeakPolarHBondContact O-CB 3.44Å; I200-Y203 PolarHBondContact O-N 3.42Å; I200-L204 HydrophobicContact CG2-CD1 4.29Å; I200-L204 HydrophobicContact CG2-CG 4.33Å; I200-L204 WeakPolarHBondContact O-CG 3.4Å; I200-L204 PolarHBondContact O-N 2.67Å; I200-L230 HydrophobicContact CB-CD1 3.94Å; I200-L230 HydrophobicContact CB-CD2 3.97Å; I200-L230 HydrophobicContact CD1-CD1 3.99Å; I200-L230 HydrophobicContact CG2-CD1 3.86Å; I200-L230 HydrophobicContact CG2-CD2 3.83Å; I200-L230 HydrophobicContact CG2-CG 4.42Å |
| 201 | G | 97.8 | Very high | 95.6 | Very high | 9 Ų | 9 | 29.7 Ų | 29.7 | 9% | 0.093 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -58.5 | -46.8 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | L197 I198 A199 Y203 L204 Y205 F227 | L197-G201 WeakPolarHBondContact O-CA 3.48Å; L197-G201 PolarHBondContact O-N 3Å; I198-G201 PolarHBondContact O-N 3.21Å; A199-G201 VanDerWaalsContact C-N 3.33Å; G201-Y203 VanDerWaalsContact C-N 3.32Å; G201-Y203 PolarHBondContact O-N 2.94Å; G201-L204 PolarHBondContact O-N 3.42Å; G201-Y205 WeakPolarHBondContact O-CB 3.28Å; G201-Y205 PolarHBondContact O-N 2.77Å; G201-F227 WeakPolarHBondContact O-CZ 3.37Å |
| 202 | Y | 96.2 | Very high | 95.8 | Very high | 81 Ų | 81 | 31.2 Ų | 31.2 | 32% | 0.318 | 15% | 0.151 | S | C | . | . | H | α-helix | trans | -58.9 | -44.4 | 173.5 | -102.4 | -84.8 | 0 | 0 | 0 | 112 | P162 I166 I198 A199 I200 L204 Y205 I206 | P162-Y202 HydrophobicContact CB-CD1 4.3Å; I166-Y202 HydrophobicContact CD1-CD2 4.1Å; I166-Y202 HydrophobicContact CD1-CG 4.45Å; I198-Y202 HydrophobicContact CG2-CD2 3.85Å; I198-Y202 HydrophobicContact CG2-CE2 4.09Å; I198-Y202 WeakPolarHBondContact O-CB 3.18Å; I198-Y202 WeakPolarHBondContact O-CD2 3.36Å; I198-Y202 PolarHBondContact O-N 3.45Å; A199-Y202 PolarHBondContact O-N 3.26Å; I200-Y202 PolarHBondContact O-N 3.23Å; Y202-L204 PolarHBondContact O-N 3.49Å; Y202-Y205 PolarHBondContact O-N 3.28Å; Y202-I206 HydrophobicContact CD1-CD1 4.08Å; Y202-I206 WeakPolarHBondContact O-CB 3.19Å; Y202-I206 WeakPolarHBondContact O-CG1 3.45Å; Y202-I206 PolarHBondContact O-N 2.75Å |
| 203 | Y | 97.5 | Very high | 96 | Very high | 30 Ų | 30 | 31.9 Ų | 31.9 | 12% | 0.118 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -58.9 | -48.2 | 178.3 | -175.5 | -78.6 | 0 | 0 | 0 | 111.5 | I125 H156 A159 F160 L163 A199 I200 G201 T207 | I125-Y203 WeakPolarHBondContact CD1-OH 3.49Å; H156-Y203 AromaticContact ND1-CE2 3.88Å; H156-Y203 AromaticContact ND1-CZ 3.74Å; H156-Y203 PolarHBondContact ND1-OH 3.01Å; A159-Y203 VanDerWaalsContact C-CD2 3.43Å; A159-Y203 HydrophobicContact CB-CD1 4.31Å; A159-Y203 HydrophobicContact CB-CD2 3.53Å; A159-Y203 HydrophobicContact CB-CE1 4.39Å; A159-Y203 HydrophobicContact CB-CE2 3.63Å; A159-Y203 HydrophobicContact CB-CG 3.86Å; A159-Y203 WeakPolarHBondContact CB-O 3.37Å; A159-Y203 WeakPolarHBondContact O-CD2 3.45Å; F160-Y203 HydrophobicContact CB-CE2 4.34Å; L163-Y203 HydrophobicContact CD1-CD2 3.96Å; L163-Y203 HydrophobicContact CD1-CG 4.22Å; A199-Y203 PolarHBondContact O-N 3.48Å; I200-Y203 WeakPolarHBondContact O-CB 3.44Å; I200-Y203 PolarHBondContact O-N 3.42Å; G201-Y203 VanDerWaalsContact C-N 3.32Å; G201-Y203 PolarHBondContact O-N 2.94Å; Y203-T207 VanDerWaalsContact O-CB 3.31Å; Y203-T207 WeakPolarHBondContact O-CB 3.46Å; Y203-T207 PolarHBondContact O-N 3.44Å; Y203-T207 PolarHBondContact O-OG1 3.44Å |
| 204 | L | 97.7 | Very high | 95.9 | Very high | 26 Ų | 26 | 32 Ų | 32 | 14% | 0.136 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -63.4 | -44.6 | 177.7 | -68.8 | 176.8 | 0 | 0 | 0 | 112 | I200 G201 Y202 T207 F208 P226 F227 L230 | I200-L204 HydrophobicContact CG2-CD1 4.29Å; I200-L204 HydrophobicContact CG2-CG 4.33Å; I200-L204 WeakPolarHBondContact O-CG 3.4Å; I200-L204 PolarHBondContact O-N 2.67Å; G201-L204 PolarHBondContact O-N 3.42Å; Y202-L204 PolarHBondContact O-N 3.49Å; L204-T207 PolarHBondContact O-N 3.13Å; L204-F208 WeakPolarHBondContact O-CB 3.44Å; L204-F208 PolarHBondContact O-N 3.05Å; L204-P226 HydrophobicContact CD1-CB 3.86Å; L204-P226 HydrophobicContact CD2-CB 3.82Å; L204-P226 HydrophobicContact CD2-CG 4.28Å; L204-F227 HydrophobicContact CB-CD2 4.02Å; L204-F227 HydrophobicContact CB-CE2 3.53Å; L204-F227 HydrophobicContact CB-CZ 3.97Å; L204-F227 HydrophobicContact CD1-CD2 4.03Å; L204-F227 HydrophobicContact CD1-CE2 4.28Å; L204-F227 HydrophobicContact CD1-CG 4.16Å; L204-L230 HydrophobicContact CD1-CD2 4.21Å |
| 205 | Y | 96.8 | Very high | 95.7 | Very high | 82 Ų | 82 | 34.1 Ų | 34.1 | 32% | 0.322 | 17% | 0.171 | S | C | . | . | H | α-helix | trans | -64.1 | -45.6 | 179.9 | 177.1 | -116.4 | 0 | 0 | 0 | 112.5 | P56 G201 Y202 T207 F208 L209 | P56-Y205 HydrophobicContact CG-CE1 3.86Å; G201-Y205 WeakPolarHBondContact O-CB 3.28Å; G201-Y205 PolarHBondContact O-N 2.77Å; Y202-Y205 PolarHBondContact O-N 3.28Å; Y205-T207 VanDerWaalsContact C-N 3.31Å; Y205-T207 PolarHBondContact O-N 3.16Å; Y205-F208 HydrophobicContact CD2-CD1 4.42Å; Y205-F208 PolarHBondContact O-N 2.86Å; Y205-L209 WeakPolarHBondContact O-CB 3.48Å; Y205-L209 PolarHBondContact O-N 3.1Å |
| 206 | I | 96.7 | Very high | 95.5 | Very high | 0 Ų | 0 | 34.2 Ų | 34.2 | 0% | 0 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -66.9 | -36.8 | 178.2 | -69 | 171.4 | 0 | 0 | 0 | 110.8 | L52 P56 Y60 N158 A159 P162 Y202 L209 G210 | L52-I206 HydrophobicContact CD2-CD1 4.2Å; L52-I206 HydrophobicContact CD2-CG2 4.16Å; P56-I206 HydrophobicContact CB-CG1 4.36Å; Y60-I206 HydrophobicContact CE2-CG2 4.21Å; Y60-I206 VanDerWaalsContact OH-CG2 3.25Å; Y60-I206 WeakPolarHBondContact OH-CG2 3.41Å; Y60-I206 PolarHBondContact OH-O 2.73Å; N158-I206 HydrophobicContact CB-CG2 3.99Å; A159-I206 HydrophobicContact CB-CB 4.1Å; A159-I206 HydrophobicContact CB-CG2 3.96Å; P162-I206 HydrophobicContact CB-CD1 4.28Å; P162-I206 HydrophobicContact CG-CD1 3.59Å; Y202-I206 HydrophobicContact CD1-CD1 4.08Å; Y202-I206 WeakPolarHBondContact O-CB 3.19Å; Y202-I206 WeakPolarHBondContact O-CG1 3.45Å; Y202-I206 PolarHBondContact O-N 2.75Å; I206-L209 PolarHBondContact O-N 2.9Å; I206-G210 PolarHBondContact O-N 2.95Å |
| 207 | T | 97.1 | Very high | 95.4 | Very high | 10 Ų | 10 | 32.3 Ų | 32.3 | 6% | 0.061 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -60.2 | -52.9 | 173.5 | -60.3 | 0 | 0 | 0 | 0 | 110.4 | V155 Y203 L204 Y205 L209 G210 Y211 | V155-T207 HydrophobicContact CG1-CG2 4.24Å; Y203-T207 VanDerWaalsContact O-CB 3.31Å; Y203-T207 WeakPolarHBondContact O-CB 3.46Å; Y203-T207 PolarHBondContact O-N 3.44Å; Y203-T207 PolarHBondContact O-OG1 3.44Å; L204-T207 PolarHBondContact O-N 3.13Å; Y205-T207 VanDerWaalsContact C-N 3.31Å; Y205-T207 PolarHBondContact O-N 3.16Å; T207-L209 VanDerWaalsContact C-N 3.31Å; T207-L209 PolarHBondContact O-N 2.78Å; T207-G210 PolarHBondContact O-N 3.18Å; T207-Y211 HydrophobicContact CG2-CD2 4Å; T207-Y211 HydrophobicContact CG2-CE2 3.8Å; T207-Y211 VanDerWaalsContact O-CD2 3.22Å; T207-Y211 WeakPolarHBondContact O-CD2 3.48Å; T207-Y211 PolarHBondContact O-N 3.48Å |
| 208 | F | 96.8 | Very high | 95.2 | Very high | 26 Ų | 26 | 31.3 Ų | 31.3 | 11% | 0.114 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -53.2 | -48.9 | 175 | 161.7 | -104.8 | 0 | 0 | 0 | 111.6 | L204 Y205 G210 Y211 N212 T220 V221 L223 L224 | L204-F208 WeakPolarHBondContact O-CB 3.44Å; L204-F208 PolarHBondContact O-N 3.05Å; Y205-F208 HydrophobicContact CD2-CD1 4.42Å; Y205-F208 PolarHBondContact O-N 2.86Å; F208-G210 VanDerWaalsContact C-N 3.27Å; F208-G210 PolarHBondContact O-N 2.69Å; F208-Y211 PolarHBondContact O-N 3.21Å; F208-N212 HydrophobicContact CD2-CB 4.46Å; F208-N212 HydrophobicContact CE1-CB 4.46Å; F208-N212 HydrophobicContact CE2-CB 4.07Å; F208-N212 HydrophobicContact CZ-CB 4.07Å; F208-N212 WeakPolarHBondContact O-CB 3.43Å; F208-N212 PolarHBondContact O-N 3.45Å; F208-T220 WeakPolarHBondContact CD2-O 3.45Å; F208-V221 HydrophobicContact CE2-CG2 4.44Å; F208-L223 HydrophobicContact CB-CB 4.42Å; F208-L224 HydrophobicContact CB-CD2 3.6Å; F208-L224 HydrophobicContact CB-CG 4.06Å; F208-L224 HydrophobicContact CD1-CD1 4.13Å; F208-L224 HydrophobicContact CD1-CD2 3.97Å; F208-L224 HydrophobicContact CD1-CG 4.23Å; F208-L224 HydrophobicContact CD2-CD1 4.08Å; F208-L224 HydrophobicContact CD2-CD2 4.29Å; F208-L224 HydrophobicContact CD2-CG 3.86Å; F208-L224 HydrophobicContact CE1-CD1 4.18Å; F208-L224 HydrophobicContact CE2-CD1 4.14Å; F208-L224 HydrophobicContact CE2-CG 4.39Å; F208-L224 HydrophobicContact CG-CD1 4.08Å; F208-L224 HydrophobicContact CG-CD2 3.68Å; F208-L224 HydrophobicContact CG-CG 3.76Å; F208-L224 HydrophobicContact CZ-CD1 4.18Å |
| 209 | L | 95.6 | Very high | 94.9 | Very high | 16 Ų | 16 | 33.4 Ų | 33.4 | 8% | 0.084 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -63.5 | -34 | -176.8 | -173.1 | 62.3 | 0 | 0 | 0 | 112.7 | P56 Q57 Y60 Y205 I206 T207 A213 | P56-L209 HydrophobicContact CB-CD2 3.84Å; P56-L209 HydrophobicContact CG-CD2 4.07Å; Q57-L209 HydrophobicContact CB-CD2 4.42Å; Q57-L209 HydrophobicContact CG-CD1 4Å; Q57-L209 HydrophobicContact CG-CD2 3.85Å; Y60-L209 HydrophobicContact CD2-CB 4.11Å; Y60-L209 HydrophobicContact CD2-CD2 3.6Å; Y60-L209 HydrophobicContact CD2-CG 3.47Å; Y60-L209 VanDerWaalsContact CD2-CG 3.47Å; Y60-L209 HydrophobicContact CE2-CB 3.87Å; Y60-L209 HydrophobicContact CE2-CD2 3.85Å; Y60-L209 HydrophobicContact CE2-CG 3.76Å; Y60-L209 HydrophobicContact CG-CG 4.39Å; Y205-L209 WeakPolarHBondContact O-CB 3.48Å; Y205-L209 PolarHBondContact O-N 3.1Å; I206-L209 PolarHBondContact O-N 2.9Å; T207-L209 VanDerWaalsContact C-N 3.31Å; T207-L209 PolarHBondContact O-N 2.78Å; L209-A213 PolarHBondContact O-N 2.87Å |
| 210 | G | 95.4 | Very high | 94.8 | Very high | 0 Ų | 0 | 33.8 Ų | 33.8 | 0% | 0 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -60.3 | -62.4 | 171.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | Y151 I206 T207 F208 N212 A213 | Y151-G210 PolarHBondContact OH-O 2.96Å; I206-G210 PolarHBondContact O-N 2.95Å; T207-G210 PolarHBondContact O-N 3.18Å; F208-G210 VanDerWaalsContact C-N 3.27Å; F208-G210 PolarHBondContact O-N 2.69Å; G210-N212 PolarHBondContact O-N 3.33Å; G210-A213 VanDerWaalsContact O-CB 3.26Å; G210-A213 WeakPolarHBondContact O-CB 3.1Å; G210-A213 PolarHBondContact O-N 3.49Å |
| 211 | Y | 95.4 | Very high | 94.6 | Very high | 3 Ų | 3 | 35.2 Ų | 35.2 | 1% | 0.012 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -61.6 | -32.4 | -179.3 | -67.9 | -77.3 | 0 | 0 | 0 | 113 | M129 V147 A152 V155 T207 F208 A213 L214 L217 L223 | M129-Y211 HydrophobicContact CB-CE2 4.16Å; M129-Y211 WeakPolarHBondContact CB-OH 3.24Å; M129-Y211 HydrophobicContact CG-CE2 4.45Å; V147-Y211 HydrophobicContact CG1-CE1 4.2Å; A152-Y211 WeakPolarHBondContact CA-OH 3.48Å; A152-Y211 VanDerWaalsContact CB-OH 3.3Å; A152-Y211 WeakPolarHBondContact CB-OH 3.46Å; V155-Y211 HydrophobicContact CB-CE2 4.41Å; V155-Y211 HydrophobicContact CG1-CD2 4.28Å; V155-Y211 HydrophobicContact CG1-CE2 3.81Å; T207-Y211 HydrophobicContact CG2-CD2 4Å; T207-Y211 HydrophobicContact CG2-CE2 3.8Å; T207-Y211 VanDerWaalsContact O-CD2 3.22Å; T207-Y211 WeakPolarHBondContact O-CD2 3.48Å; T207-Y211 PolarHBondContact O-N 3.48Å; F208-Y211 PolarHBondContact O-N 3.21Å; Y211-A213 PolarHBondContact O-N 3.29Å; Y211-L214 WeakPolarHBondContact O-CB 3.26Å; Y211-L214 PolarHBondContact O-N 2.91Å; Y211-L214 VanDerWaalsContact O-N 3.12Å; Y211-L217 HydrophobicContact CD1-CD1 3.88Å; Y211-L217 HydrophobicContact CG-CD1 4.45Å; Y211-L223 HydrophobicContact CD2-CD1 3.58Å; Y211-L223 HydrophobicContact CG-CD1 3.75Å |
| 212 | N | 94.6 | Very high | 94.5 | Very high | 79 Ų | 79 | 38 Ų | 38 | 42% | 0.422 | 20% | 0.201 | S | C | . | . | H | α-helix | trans | -67.3 | -21.1 | 175.5 | -166.6 | 63.5 | 0 | 0 | 0 | 113.8 | F208 G210 L214 T220 | F208-N212 HydrophobicContact CD2-CB 4.46Å; F208-N212 HydrophobicContact CE1-CB 4.46Å; F208-N212 HydrophobicContact CE2-CB 4.07Å; F208-N212 HydrophobicContact CZ-CB 4.07Å; F208-N212 WeakPolarHBondContact O-CB 3.43Å; F208-N212 PolarHBondContact O-N 3.45Å; G210-N212 PolarHBondContact O-N 3.33Å; N212-L214 PolarHBondContact O-N 3.45Å; N212-T220 PolarHBondContact OD1-OG1 3.42Å |
| 213 | A | 92.3 | Very high | 94.4 | Very high | 13 Ų | 13 | 35 Ų | 35 | 11% | 0.107 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -71.2 | -18.5 | 173.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | Y60 H64 L209 G210 Y211 P215 | Y60-A213 HydrophobicContact CD1-CB 4.49Å; Y60-A213 HydrophobicContact CG-CB 4.46Å; H64-A213 PolarHBondContact CE1-O 3.48Å; H64-A213 PolarHBondContact NE2-O 3.4Å; L209-A213 PolarHBondContact O-N 2.87Å; G210-A213 VanDerWaalsContact O-CB 3.26Å; G210-A213 WeakPolarHBondContact O-CB 3.1Å; G210-A213 PolarHBondContact O-N 3.49Å; Y211-A213 PolarHBondContact O-N 3.29Å; A213-P215 WeakPolarHBondContact O-CD 3.33Å |
| 214 | L | 92.4 | Very high | 94.3 | Very high | 3 Ų | 3 | 35.9 Ų | 35.9 | 2% | 0.016 | 20% | 0.197 | C | C | . | . | trans | -81.5 | 113.7 | 179.7 | -62 | 177.5 | 0 | 0 | 0 | 110.3 | W73 V147 Y151 Y211 N212 F216 L217 | W73-L214 HydrophobicContact CD2-CD2 3.48Å; W73-L214 VanDerWaalsContact CD2-CD2 3.48Å; W73-L214 HydrophobicContact CE3-CD2 3.68Å; W73-L214 HydrophobicContact CG-CD2 4.02Å; W73-L214 HydrophobicContact CH2-CD2 3.92Å; W73-L214 HydrophobicContact CZ2-CD2 3.73Å; W73-L214 HydrophobicContact CZ3-CD2 3.9Å; V147-L214 HydrophobicContact CG1-CD1 4.09Å; V147-L214 HydrophobicContact CG2-CD1 3.88Å; Y151-L214 HydrophobicContact CD1-CD1 3.98Å; Y151-L214 HydrophobicContact CE1-CD1 3.53Å; Y151-L214 HydrophobicContact CE1-CD2 4.04Å; Y151-L214 HydrophobicContact CE1-CG 3.87Å; Y211-L214 WeakPolarHBondContact O-CB 3.26Å; Y211-L214 PolarHBondContact O-N 2.91Å; Y211-L214 VanDerWaalsContact O-N 3.12Å; N212-L214 PolarHBondContact O-N 3.45Å; L214-F216 HydrophobicContact CB-CD1 4.4Å; L214-F216 HydrophobicContact CB-CE1 3.95Å; L214-F216 HydrophobicContact CB-CE2 4.3Å; L214-F216 HydrophobicContact CB-CZ 3.91Å; L214-F216 HydrophobicContact CD1-CE2 4.23Å; L214-F216 HydrophobicContact CD1-CZ 3.83Å; L214-F216 HydrophobicContact CD2-CE1 3.9Å; L214-F216 HydrophobicContact CD2-CZ 3.89Å; L214-F216 HydrophobicContact CG-CE1 4.36Å; L214-F216 HydrophobicContact CG-CZ 4.1Å; L214-F216 PolarHBondContact O-N 3.25Å; L214-F216 VanDerWaalsContact O-N 3.16Å; L214-L217 HydrophobicContact CB-CB 4.4Å; L214-L217 HydrophobicContact CB-CD1 3.95Å; L214-L217 HydrophobicContact CB-CG 3.88Å; L214-L217 HydrophobicContact CD1-CD1 3.68Å; L214-L217 HydrophobicContact CD1-CG 4.24Å; L214-L217 HydrophobicContact CG-CD1 4.38Å; L214-L217 PolarHBondContact O-N 3.1Å; L214-L217 VanDerWaalsContact O-N 3.13Å | ||
| 215 | P | 90.1 | Very high | 94.2 | Very high | 81 Ų | 81 | 42 Ų | 42 | 53% | 0.526 | 22% | 0.22 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -68.7 | -20.6 | -171.6 | 27.9 | -35.4 | 0 | 0 | 0 | 113.5 | K139 A213 | K139-P215 PolarHBondContact NZ-O 3.03Å; A213-P215 WeakPolarHBondContact O-CD 3.33Å |
| 216 | F | 90.7 | Very high | 94.2 | Very high | 30 Ų | 30 | 40.9 Ų | 40.9 | 13% | 0.132 | 22% | 0.222 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -87.2 | -6 | 179.8 | 55.9 | -94.2 | 0 | 0 | 0 | 113.4 | W73 L138 K139 F145 V147 L214 | W73-F216 HydrophobicContact CZ2-CE1 4.13Å; W73-F216 AromaticContact NE1-CE1 3.73Å; L138-F216 HydrophobicContact CD2-CD2 3.65Å; L138-F216 HydrophobicContact CD2-CE2 4.11Å; K139-F216 WeakPolarHBondContact CB-O 3.31Å; K139-F216 PolarHBondContact N-O 3.13Å; F145-F216 HydrophobicContact CB-CB 4.38Å; F145-F216 HydrophobicContact CB-CD2 4.39Å; F145-F216 HydrophobicContact CB-CG 4.25Å; V147-F216 HydrophobicContact CG2-CE2 3.82Å; V147-F216 HydrophobicContact CG2-CZ 4.37Å; L214-F216 HydrophobicContact CB-CD1 4.4Å; L214-F216 HydrophobicContact CB-CE1 3.95Å; L214-F216 HydrophobicContact CB-CE2 4.3Å; L214-F216 HydrophobicContact CB-CZ 3.91Å; L214-F216 HydrophobicContact CD1-CE2 4.23Å; L214-F216 HydrophobicContact CD1-CZ 3.83Å; L214-F216 HydrophobicContact CD2-CE1 3.9Å; L214-F216 HydrophobicContact CD2-CZ 3.89Å; L214-F216 HydrophobicContact CG-CE1 4.36Å; L214-F216 HydrophobicContact CG-CZ 4.1Å; L214-F216 PolarHBondContact O-N 3.25Å; L214-F216 VanDerWaalsContact O-N 3.16Å |
| 217 | L | 92.3 | Very high | 94.1 | Very high | 8 Ų | 8 | 44.6 Ų | 44.6 | 4% | 0.042 | 24% | 0.238 | C | C | . | . | B | Isolated β-bridge | trans | -88.4 | 147.7 | 170.1 | -62.4 | -173.8 | 0 | 0 | 0 | 111 | L137 L138 K139 V147 Y211 L214 T220 | L137-L217 HydrophobicContact CB-CD2 3.97Å; L137-L217 CarbonylContact O-C 3.53Å; L137-L217 WeakPolarHBondContact O-CA 3.29Å; L138-L217 HydrophobicContact CD2-CD2 3.92Å; L138-L217 HydrophobicContact CG-CD2 4.43Å; K139-L217 WeakPolarHBondContact CE-O 3.44Å; K139-L217 PolarHBondContact NZ-O 3.49Å; V147-L217 HydrophobicContact CG2-CD1 4.1Å; V147-L217 HydrophobicContact CG2-CD2 3.98Å; V147-L217 HydrophobicContact CG2-CG 4.41Å; Y211-L217 HydrophobicContact CD1-CD1 3.88Å; Y211-L217 HydrophobicContact CG-CD1 4.45Å; L214-L217 HydrophobicContact CB-CB 4.4Å; L214-L217 HydrophobicContact CB-CD1 3.95Å; L214-L217 HydrophobicContact CB-CG 3.88Å; L214-L217 HydrophobicContact CD1-CD1 3.68Å; L214-L217 HydrophobicContact CD1-CG 4.24Å; L214-L217 HydrophobicContact CG-CD1 4.38Å; L214-L217 PolarHBondContact O-N 3.1Å; L214-L217 VanDerWaalsContact O-N 3.13Å; L217-T220 HydrophobicContact CB-CG2 3.82Å; L217-T220 HydrophobicContact CD1-CG2 4.49Å |
| 218 | S | 91.7 | Very high | 94.1 | Very high | 29 Ų | 29 | 47.8 Ų | 47.8 | 20% | 0.203 | 27% | 0.266 | C | S | . | . | trans | -127.2 | 161.3 | 173.5 | 51.4 | 0 | 0 | 0 | 0 | 110.3 | L137 K139 T220 | L137-S218 PolarHBondContact O-N 2.95Å; L137-S218 PolarHBondContact O-OG 3.46Å; K139-S218 VanDerWaalsContact CG-CB 3.44Å; S218-T220 PolarHBondContact O-N 2.85Å | ||
| 219 | N | 91.8 | Very high | 94.1 | Very high | 121 Ų | 121 | 51.5 Ų | 51.5 | 65% | 0.647 | 29% | 0.287 | S | S | * | . | trans | 53.3 | 31 | 175.8 | -58.1 | -37 | 0 | 0 | 0 | 113.8 | V221 V222 | N219-V221 PolarHBondContact O-N 3.42Å; N219-V221 VanDerWaalsContact O-N 3.08Å; N219-V222 WeakPolarHBondContact O-CG2 3.45Å; N219-V222 PolarHBondContact O-N 3.05Å; N219-V222 VanDerWaalsContact O-N 3.13Å | ||
| 220 | T | 94 | Very high | 94.1 | Very high | 7 Ų | 7 | 51.5 Ų | 51.5 | 4% | 0.043 | 29% | 0.287 | C | S | . | . | G | 310 helix | trans | -60.1 | -20.2 | 177.1 | 50.8 | 0 | 0 | 0 | 0 | 112.4 | F208 N212 L217 S218 V222 L223 | F208-T220 WeakPolarHBondContact CD2-O 3.45Å; N212-T220 PolarHBondContact OD1-OG1 3.42Å; L217-T220 HydrophobicContact CB-CG2 3.82Å; L217-T220 HydrophobicContact CD1-CG2 4.49Å; S218-T220 PolarHBondContact O-N 2.85Å; T220-V222 PolarHBondContact O-N 3.34Å; T220-V222 VanDerWaalsContact O-N 3.12Å; T220-L223 VanDerWaalsContact O-CB 3.26Å; T220-L223 WeakPolarHBondContact O-CB 3.48Å; T220-L223 WeakPolarHBondContact O-CG 3.34Å; T220-L223 PolarHBondContact O-N 2.88Å |
| 221 | V | 94.5 | Very high | 94.2 | Very high | 86 Ų | 86 | 52.9 Ų | 52.9 | 52% | 0.521 | 30% | 0.301 | S | S | . | . | G | 310 helix | trans | -53.5 | -28.2 | 173.5 | -178.4 | 0 | 0 | 0 | 0 | 112.5 | F208 N219 L223 L224 | F208-V221 HydrophobicContact CE2-CG2 4.44Å; N219-V221 PolarHBondContact O-N 3.42Å; N219-V221 VanDerWaalsContact O-N 3.08Å; V221-L223 PolarHBondContact O-N 3.49Å; V221-L223 VanDerWaalsContact O-N 3.16Å; V221-L224 WeakPolarHBondContact O-CB 3.37Å; V221-L224 PolarHBondContact O-N 3.34Å |
| 222 | V | 94.7 | Very high | 94.3 | Very high | 66 Ų | 66 | 57.4 Ų | 57.4 | 40% | 0.4 | 33% | 0.325 | S | S | . | . | G | 310 helix | trans | -57.8 | -29.2 | 175.1 | 175.4 | 0 | 0 | 0 | 0 | 111.9 | N219 T220 L224 Y225 | N219-V222 WeakPolarHBondContact O-CG2 3.45Å; N219-V222 PolarHBondContact O-N 3.05Å; N219-V222 VanDerWaalsContact O-N 3.13Å; T220-V222 PolarHBondContact O-N 3.34Å; T220-V222 VanDerWaalsContact O-N 3.12Å; V222-L224 PolarHBondContact O-N 2.94Å; V222-L224 VanDerWaalsContact O-N 3.15Å; V222-Y225 HydrophobicContact CB-CE2 4.43Å; V222-Y225 HydrophobicContact CG1-CD2 4.02Å; V222-Y225 HydrophobicContact CG1-CE2 4.15Å; V222-Y225 HydrophobicContact CG2-CE2 4.16Å; V222-Y225 WeakPolarHBondContact O-CB 3.43Å; V222-Y225 PolarHBondContact O-N 3.05Å |
| 223 | L | 94.9 | Very high | 94.4 | Very high | 20 Ų | 20 | 57 Ų | 57 | 11% | 0.105 | 32% | 0.322 | C | S | . | . | G | 310 helix | trans | -66.3 | -13.3 | 176.2 | -59.3 | 177.5 | 0 | 0 | 0 | 113.3 | M129 L137 F208 Y211 T220 V221 P226 | M129-L223 HydrophobicContact SD-CD2 4.11Å; L137-L223 HydrophobicContact CD1-CD1 4.35Å; L137-L223 HydrophobicContact CD1-CD2 4.36Å; L137-L223 HydrophobicContact CD1-CG 4.37Å; F208-L223 HydrophobicContact CB-CB 4.42Å; Y211-L223 HydrophobicContact CD2-CD1 3.58Å; Y211-L223 HydrophobicContact CG-CD1 3.75Å; T220-L223 VanDerWaalsContact O-CB 3.26Å; T220-L223 WeakPolarHBondContact O-CB 3.48Å; T220-L223 WeakPolarHBondContact O-CG 3.34Å; T220-L223 PolarHBondContact O-N 2.88Å; V221-L223 PolarHBondContact O-N 3.49Å; V221-L223 VanDerWaalsContact O-N 3.16Å; L223-P226 WeakPolarHBondContact O-CD 3.16Å |
| 224 | L | 95.8 | Very high | 94.6 | Very high | 48 Ų | 48 | 58.3 Ų | 58.3 | 25% | 0.251 | 33% | 0.325 | S | S | . | . | G | 310 helix | trans | -88.1 | -12.1 | 173.5 | -63 | 173.1 | 0 | 0 | 0 | 112.9 | F208 V221 V222 P226 F227 | F208-L224 HydrophobicContact CB-CD2 3.6Å; F208-L224 HydrophobicContact CB-CG 4.06Å; F208-L224 HydrophobicContact CD1-CD1 4.13Å; F208-L224 HydrophobicContact CD1-CD2 3.97Å; F208-L224 HydrophobicContact CD1-CG 4.23Å; F208-L224 HydrophobicContact CD2-CD1 4.08Å; F208-L224 HydrophobicContact CD2-CD2 4.29Å; F208-L224 HydrophobicContact CD2-CG 3.86Å; F208-L224 HydrophobicContact CE1-CD1 4.18Å; F208-L224 HydrophobicContact CE2-CD1 4.14Å; F208-L224 HydrophobicContact CE2-CG 4.39Å; F208-L224 HydrophobicContact CG-CD1 4.08Å; F208-L224 HydrophobicContact CG-CD2 3.68Å; F208-L224 HydrophobicContact CG-CG 3.76Å; F208-L224 HydrophobicContact CZ-CD1 4.18Å; V221-L224 WeakPolarHBondContact O-CB 3.37Å; V221-L224 PolarHBondContact O-N 3.34Å; V222-L224 PolarHBondContact O-N 2.94Å; V222-L224 VanDerWaalsContact O-N 3.15Å; L224-P226 VanDerWaalsContact C-N 3.3Å; L224-F227 HydrophobicContact CB-CD2 4.28Å; L224-F227 HydrophobicContact CD2-CD2 3.87Å; L224-F227 HydrophobicContact CD2-CE2 3.62Å; L224-F227 VanDerWaalsContact O-CB 3.27Å; L224-F227 WeakPolarHBondContact O-CB 3.4Å; L224-F227 WeakPolarHBondContact O-CD2 3.32Å; L224-F227 PolarHBondContact O-N 3.21Å |
| 225 | Y | 95.3 | Very high | 94.9 | Very high | 155 Ų | 155 | 63.5 Ų | 63.5 | 61% | 0.608 | 35% | 0.352 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.8 | -34.4 | -179.7 | -69.3 | 1.4 | 0 | 0 | 0 | 114.4 | V222 F227 A228 | V222-Y225 HydrophobicContact CB-CE2 4.43Å; V222-Y225 HydrophobicContact CG1-CD2 4.02Å; V222-Y225 HydrophobicContact CG1-CE2 4.15Å; V222-Y225 HydrophobicContact CG2-CE2 4.16Å; V222-Y225 WeakPolarHBondContact O-CB 3.43Å; V222-Y225 PolarHBondContact O-N 3.05Å; Y225-F227 PolarHBondContact O-N 3.22Å; Y225-A228 PolarHBondContact O-N 3.23Å |
| 226 | P | 96.1 | Very high | 95.2 | Very high | 58 Ų | 58 | 63.1 Ų | 63.1 | 38% | 0.377 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -57.8 | -17.8 | 172.6 | -26.5 | 36.4 | 0 | 0 | 0 | 115 | L204 L223 L224 A228 L229 L230 | L204-P226 HydrophobicContact CD1-CB 3.86Å; L204-P226 HydrophobicContact CD2-CB 3.82Å; L204-P226 HydrophobicContact CD2-CG 4.28Å; L223-P226 WeakPolarHBondContact O-CD 3.16Å; L224-P226 VanDerWaalsContact C-N 3.3Å; P226-A228 VanDerWaalsContact C-N 3.28Å; P226-A228 PolarHBondContact O-N 3.36Å; P226-L229 PolarHBondContact O-N 3.34Å; P226-L230 WeakPolarHBondContact O-CB 3.38Å; P226-L230 PolarHBondContact O-N 3.31Å |
| 227 | F | 95.6 | Very high | 95.4 | Very high | 77 Ų | 77 | 61.7 Ų | 61.7 | 34% | 0.338 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -61 | -36.1 | 172 | -89.5 | -82.3 | 0 | 0 | 0 | 112.7 | G201 L204 L224 Y225 L230 G231 | G201-F227 WeakPolarHBondContact O-CZ 3.37Å; L204-F227 HydrophobicContact CB-CD2 4.02Å; L204-F227 HydrophobicContact CB-CE2 3.53Å; L204-F227 HydrophobicContact CB-CZ 3.97Å; L204-F227 HydrophobicContact CD1-CD2 4.03Å; L204-F227 HydrophobicContact CD1-CE2 4.28Å; L204-F227 HydrophobicContact CD1-CG 4.16Å; L224-F227 HydrophobicContact CB-CD2 4.28Å; L224-F227 HydrophobicContact CD2-CD2 3.87Å; L224-F227 HydrophobicContact CD2-CE2 3.62Å; L224-F227 VanDerWaalsContact O-CB 3.27Å; L224-F227 WeakPolarHBondContact O-CB 3.4Å; L224-F227 WeakPolarHBondContact O-CD2 3.32Å; L224-F227 PolarHBondContact O-N 3.21Å; Y225-F227 PolarHBondContact O-N 3.22Å; F227-L230 HydrophobicContact CD1-CD2 4.44Å; F227-L230 PolarHBondContact O-N 3.07Å; F227-G231 PolarHBondContact O-N 3.49Å |
| 228 | A | 95.8 | Very high | 95.4 | Very high | 78 Ų | 78 | 62.8 Ų | 62.8 | 65% | 0.645 | 35% | 0.345 | S | S | * | . | H | α-helix | trans | -65.4 | -44.2 | 178.4 | 0 | 0 | 0 | 0 | 0 | 110.8 | Y225 P226 L230 G231 L232 | Y225-A228 PolarHBondContact O-N 3.23Å; P226-A228 VanDerWaalsContact C-N 3.28Å; P226-A228 PolarHBondContact O-N 3.36Å; A228-L230 VanDerWaalsContact C-N 3.34Å; A228-G231 PolarHBondContact O-N 3.14Å; A228-L232 PolarHBondContact O-N 3.12Å |
| 229 | L | 96.4 | Very high | 95.6 | Very high | 103 Ų | 103 | 66.2 Ų | 66.2 | 54% | 0.539 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -62.5 | -42.1 | 173.8 | 179.2 | 61.6 | 0 | 0 | 0 | 111.3 | P226 G231 L232 L233 | P226-L229 PolarHBondContact O-N 3.34Å; L229-G231 PolarHBondContact O-N 3.1Å; L229-L232 PolarHBondContact O-N 3.44Å; L229-L233 HydrophobicContact CD1-CD1 4.3Å; L229-L233 HydrophobicContact CD1-CG 4.19Å; L229-L233 HydrophobicContact CG-CD1 4.05Å; L229-L233 HydrophobicContact CG-CG 4.37Å; L229-L233 WeakPolarHBondContact O-CB 3.48Å; L229-L233 WeakPolarHBondContact O-CG 3.48Å; L229-L233 PolarHBondContact O-N 3.45Å |
| 230 | L | 97.3 | Very high | 95.7 | Very high | 17 Ų | 17 | 65.3 Ų | 65.3 | 9% | 0.089 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -60.7 | -44.5 | 177.2 | 179.9 | 63.4 | 0 | 0 | 0 | 111.9 | L197 I200 L204 P226 F227 A228 L233 Y234 | L197-L230 HydrophobicContact CD1-CD1 4.25Å; L197-L230 HydrophobicContact CD1-CD2 3.8Å; L197-L230 HydrophobicContact CD1-CG 3.6Å; I200-L230 HydrophobicContact CB-CD1 3.94Å; I200-L230 HydrophobicContact CB-CD2 3.97Å; I200-L230 HydrophobicContact CD1-CD1 3.99Å; I200-L230 HydrophobicContact CG2-CD1 3.86Å; I200-L230 HydrophobicContact CG2-CD2 3.83Å; I200-L230 HydrophobicContact CG2-CG 4.42Å; L204-L230 HydrophobicContact CD1-CD2 4.21Å; P226-L230 WeakPolarHBondContact O-CB 3.38Å; P226-L230 PolarHBondContact O-N 3.31Å; F227-L230 HydrophobicContact CD1-CD2 4.44Å; F227-L230 PolarHBondContact O-N 3.07Å; A228-L230 VanDerWaalsContact C-N 3.34Å; L230-L233 PolarHBondContact O-N 3.45Å; L230-Y234 WeakPolarHBondContact O-CB 3.29Å; L230-Y234 PolarHBondContact O-N 3.23Å |
| 231 | G | 97.1 | Very high | 95.5 | Very high | 29 Ų | 29 | 66.5 Ų | 66.5 | 30% | 0.299 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -62.6 | -42.4 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | F227 A228 L229 Y234 L235 | F227-G231 PolarHBondContact O-N 3.49Å; A228-G231 PolarHBondContact O-N 3.14Å; L229-G231 PolarHBondContact O-N 3.1Å; G231-Y234 PolarHBondContact O-N 2.9Å; G231-L235 WeakPolarHBondContact O-CG 3.34Å; G231-L235 PolarHBondContact O-N 3.17Å |
| 232 | L | 97.2 | Very high | 95.4 | Very high | 97 Ų | 97 | 69 Ų | 69 | 51% | 0.508 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -61.5 | -48.4 | 174.8 | 178.8 | 65.7 | 0 | 0 | 0 | 111.8 | A228 L229 Y234 L235 L236 | A228-L232 PolarHBondContact O-N 3.12Å; L229-L232 PolarHBondContact O-N 3.44Å; L232-Y234 VanDerWaalsContact C-N 3.3Å; L232-Y234 PolarHBondContact O-N 3.29Å; L232-L235 PolarHBondContact O-N 2.92Å; L232-L236 HydrophobicContact CD1-CD1 4.33Å; L232-L236 HydrophobicContact CD1-CG 4.44Å; L232-L236 HydrophobicContact CG-CD1 4.1Å; L232-L236 WeakPolarHBondContact O-CG 3.48Å; L232-L236 PolarHBondContact O-N 3.09Å |
| 233 | L | 96.8 | Very high | 95.2 | Very high | 72 Ų | 72 | 66.5 Ų | 66.5 | 38% | 0.377 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -61.8 | -37.9 | 178.7 | -73.8 | 174.2 | 0 | 0 | 0 | 112.1 | L229 L230 S237 | L229-L233 HydrophobicContact CD1-CD1 4.3Å; L229-L233 HydrophobicContact CD1-CG 4.19Å; L229-L233 HydrophobicContact CG-CD1 4.05Å; L229-L233 HydrophobicContact CG-CG 4.37Å; L229-L233 WeakPolarHBondContact O-CB 3.48Å; L229-L233 WeakPolarHBondContact O-CG 3.48Å; L229-L233 PolarHBondContact O-N 3.45Å; L230-L233 PolarHBondContact O-N 3.45Å; L233-S237 WeakPolarHBondContact O-CB 3.49Å; L233-S237 PolarHBondContact O-N 2.97Å; L233-S237 PolarHBondContact O-OG 2.76Å |
| 234 | Y | 96.8 | Very high | 94.9 | Very high | 39 Ų | 39 | 69.3 Ų | 69.3 | 15% | 0.153 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -64.6 | -46.2 | 175 | 175.2 | -102.2 | 0 | 0 | 0 | 112.1 | F190 N193 T194 L197 L230 G231 L232 L236 S237 I238 | F190-Y234 WeakPolarHBondContact CE2-OH 3.31Å; N193-Y234 HydrophobicContact CB-CD2 3.99Å; N193-Y234 HydrophobicContact CB-CE2 3.86Å; T194-Y234 PolarHBondContact OG1-OH 3.16Å; T194-Y234 VanDerWaalsContact OG1-OH 3.06Å; L197-Y234 HydrophobicContact CB-CD2 3.94Å; L197-Y234 HydrophobicContact CB-CE2 4.38Å; L197-Y234 HydrophobicContact CB-CG 4.4Å; L197-Y234 HydrophobicContact CD1-CG 4.47Å; L197-Y234 HydrophobicContact CD2-CD1 3.89Å; L197-Y234 HydrophobicContact CD2-CD2 3.96Å; L197-Y234 HydrophobicContact CD2-CE1 4.08Å; L197-Y234 HydrophobicContact CD2-CE2 4.16Å; L197-Y234 HydrophobicContact CD2-CG 3.83Å; L197-Y234 HydrophobicContact CG-CD2 4.44Å; L197-Y234 HydrophobicContact CG-CG 4.45Å; L230-Y234 WeakPolarHBondContact O-CB 3.29Å; L230-Y234 PolarHBondContact O-N 3.23Å; G231-Y234 PolarHBondContact O-N 2.9Å; L232-Y234 VanDerWaalsContact C-N 3.3Å; L232-Y234 PolarHBondContact O-N 3.29Å; Y234-L236 VanDerWaalsContact C-N 3.35Å; Y234-L236 PolarHBondContact O-N 2.94Å; Y234-S237 PolarHBondContact O-N 3.27Å; Y234-S237 PolarHBondContact O-OG 3.39Å; Y234-I238 HydrophobicContact CE1-CG1 4.28Å; Y234-I238 HydrophobicContact CE2-CD1 4.14Å; Y234-I238 HydrophobicContact CE2-CG1 4.09Å; Y234-I238 WeakPolarHBondContact O-CG1 3.24Å; Y234-I238 PolarHBondContact O-N 3.49Å; Y234-I238 VanDerWaalsContact O-N 3.08Å |
| 235 | L | 97.1 | Very high | 94.6 | Very high | 113 Ų | 113 | 67.1 Ų | 67.1 | 59% | 0.592 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -61 | -45.6 | 176.7 | -69.2 | 174 | 0 | 0 | 0 | 111.4 | G231 L232 S237 I238 S239 | G231-L235 WeakPolarHBondContact O-CG 3.34Å; G231-L235 PolarHBondContact O-N 3.17Å; L232-L235 PolarHBondContact O-N 2.92Å; L235-S237 VanDerWaalsContact C-N 3.34Å; L235-S237 PolarHBondContact O-N 3.16Å; L235-I238 PolarHBondContact O-N 2.96Å; L235-S239 PolarHBondContact O-N 2.86Å; L235-S239 PolarHBondContact O-OG 3.22Å; L235-S239 VanDerWaalsContact O-OG 3.08Å |
| 236 | L | 96.6 | Very high | 94.2 | Very high | 73 Ų | 73 | 63 Ų | 63 | 38% | 0.382 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -60.7 | -42.4 | 175.9 | -71.3 | 173.2 | 0 | 0 | 0 | 111.8 | L232 Y234 I238 S239 L240 | L232-L236 HydrophobicContact CD1-CD1 4.33Å; L232-L236 HydrophobicContact CD1-CG 4.44Å; L232-L236 HydrophobicContact CG-CD1 4.1Å; L232-L236 WeakPolarHBondContact O-CG 3.48Å; L232-L236 PolarHBondContact O-N 3.09Å; Y234-L236 VanDerWaalsContact C-N 3.35Å; Y234-L236 PolarHBondContact O-N 2.94Å; L236-I238 VanDerWaalsContact C-N 3.33Å; L236-I238 PolarHBondContact O-N 2.68Å; L236-S239 PolarHBondContact O-N 3Å; L236-L240 VanDerWaalsContact O-CB 3.31Å; L236-L240 WeakPolarHBondContact O-CB 3.44Å; L236-L240 VanDerWaalsContact O-CG 3.29Å; L236-L240 WeakPolarHBondContact O-CG 3.44Å; L236-L240 PolarHBondContact O-N 3.38Å |
| 237 | S | 94.8 | Very high | 93.9 | Very high | 0 Ų | 0 | 62.1 Ų | 62.1 | 0% | 0 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -65.6 | -37.2 | -178.6 | 77.2 | 0 | 0 | 0 | 0 | 112 | N193 L233 Y234 L235 G241 W242 | N193-S237 WeakPolarHBondContact ND2-CB 3.36Å; N193-S237 PolarHBondContact ND2-OG 3.38Å; L233-S237 WeakPolarHBondContact O-CB 3.49Å; L233-S237 PolarHBondContact O-N 2.97Å; L233-S237 PolarHBondContact O-OG 2.76Å; Y234-S237 PolarHBondContact O-N 3.27Å; Y234-S237 PolarHBondContact O-OG 3.39Å; L235-S237 VanDerWaalsContact C-N 3.34Å; L235-S237 PolarHBondContact O-N 3.16Å; S237-G241 CarbonylContact O-C 2.92Å; S237-G241 PolarHBondContact O-N 3.38Å; S237-G241 VanDerWaalsContact O-N 3.11Å; S237-W242 PolarHBondContact O-N 3.35Å |
| 238 | I | 94.1 | Very high | 93.5 | Very high | 31 Ų | 31 | 59.6 Ų | 59.6 | 16% | 0.159 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -68.6 | -45.3 | 173.3 | -60.4 | -56.2 | 0 | 0 | 0 | 111.4 | F186 Y189 F190 N193 Y234 L235 L236 L240 G241 | F186-I238 HydrophobicContact CE2-CG2 3.84Å; Y189-I238 HydrophobicContact CD2-CD1 3.86Å; Y189-I238 HydrophobicContact CE2-CD1 4.33Å; Y189-I238 HydrophobicContact CE2-CG2 4.3Å; F190-I238 HydrophobicContact CB-CD1 4.27Å; F190-I238 HydrophobicContact CD2-CD1 4.05Å; N193-I238 HydrophobicContact CB-CD1 4.17Å; Y234-I238 HydrophobicContact CE1-CG1 4.28Å; Y234-I238 HydrophobicContact CE2-CD1 4.14Å; Y234-I238 HydrophobicContact CE2-CG1 4.09Å; Y234-I238 WeakPolarHBondContact O-CG1 3.24Å; Y234-I238 PolarHBondContact O-N 3.49Å; Y234-I238 VanDerWaalsContact O-N 3.08Å; L235-I238 PolarHBondContact O-N 2.96Å; L236-I238 VanDerWaalsContact C-N 3.33Å; L236-I238 PolarHBondContact O-N 2.68Å; I238-L240 VanDerWaalsContact C-N 3.33Å; I238-L240 PolarHBondContact O-N 3.45Å; I238-G241 PolarHBondContact O-N 3.1Å |
| 239 | S | 94.3 | Very high | 93.2 | Very high | 101 Ų | 101 | 56.4 Ų | 56.4 | 71% | 0.706 | 31% | 0.312 | S | S | * | . | H | α-helix | trans | -65.8 | -34.2 | -178.8 | -61.5 | 0 | 0 | 0 | 0 | 113.5 | L235 L236 | L235-S239 PolarHBondContact O-N 2.86Å; L235-S239 PolarHBondContact O-OG 3.22Å; L235-S239 VanDerWaalsContact O-OG 3.08Å; L236-S239 PolarHBondContact O-N 3Å |
| 240 | L | 94.1 | Very high | 92.7 | Very high | 101 Ų | 101 | 60 Ų | 60 | 53% | 0.529 | 32% | 0.319 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -93.1 | -2.4 | -179.3 | -60.7 | 174.9 | 0 | 0 | 0 | 113.2 | L236 I238 W242 | L236-L240 VanDerWaalsContact O-CB 3.31Å; L236-L240 WeakPolarHBondContact O-CB 3.44Å; L236-L240 VanDerWaalsContact O-CG 3.29Å; L236-L240 WeakPolarHBondContact O-CG 3.44Å; L236-L240 PolarHBondContact O-N 3.38Å; I238-L240 VanDerWaalsContact C-N 3.33Å; I238-L240 PolarHBondContact O-N 3.45Å; L240-W242 VanDerWaalsContact C-N 3.28Å; L240-W242 HydrophobicContact CB-CD2 4.18Å; L240-W242 HydrophobicContact CB-CG 4.18Å; L240-W242 HydrophobicContact CD1-CD2 4.21Å; L240-W242 HydrophobicContact CD1-CE3 4.43Å; L240-W242 HydrophobicContact CD1-CH2 3.74Å; L240-W242 HydrophobicContact CD1-CZ2 3.45Å; L240-W242 VanDerWaalsContact CD1-CZ2 3.45Å; L240-W242 HydrophobicContact CD1-CZ3 4.22Å; L240-W242 PolarHBondContact O-N 3.31Å |
| 241 | G | 90.1 | Very high | 92.4 | Very high | 33 Ų | 33 | 62.7 Ų | 62.7 | 34% | 0.34 | 33% | 0.33 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 67.2 | 24.1 | -177.1 | 0 | 0 | 0 | 0 | 0 | 114.2 | S237 I238 | S237-G241 CarbonylContact O-C 2.92Å; S237-G241 PolarHBondContact O-N 3.38Å; S237-G241 VanDerWaalsContact O-N 3.11Å; I238-G241 PolarHBondContact O-N 3.1Å |
| 242 | W | 91.8 | Very high | 91.9 | Very high | 137 Ų | 137 | 61.6 Ų | 61.6 | 52% | 0.519 | 32% | 0.317 | S | S | . | . | trans | -74.1 | 134.5 | 177.8 | -66.9 | -10.4 | 0 | 0 | 0 | 111.3 | N193 S237 L240 | N193-W242 PolarHBondContact ND2-O 3.14Å; N193-W242 PolarHBondContact OD1-O 3.27Å; S237-W242 PolarHBondContact O-N 3.35Å; L240-W242 VanDerWaalsContact C-N 3.28Å; L240-W242 HydrophobicContact CB-CD2 4.18Å; L240-W242 HydrophobicContact CB-CG 4.18Å; L240-W242 HydrophobicContact CD1-CD2 4.21Å; L240-W242 HydrophobicContact CD1-CE3 4.43Å; L240-W242 HydrophobicContact CD1-CH2 3.74Å; L240-W242 HydrophobicContact CD1-CZ2 3.45Å; L240-W242 VanDerWaalsContact CD1-CZ2 3.45Å; L240-W242 HydrophobicContact CD1-CZ3 4.22Å; L240-W242 PolarHBondContact O-N 3.31Å | ||
| 243 | N | 90.3 | Very high | 91.4 | Very high | 15 Ų | 15 | 61.1 Ų | 61.1 | 8% | 0.08 | 31% | 0.311 | C | S | . | . | trans | -116.6 | 101.2 | -179.3 | -168.7 | -31.7 | 0 | 0 | 0 | 111.3 | I181 T245 Q246 G247 | I181-N243 PolarHBondContact O-ND2 3.45Å; N243-T245 VanDerWaalsContact C-N 3.28Å; N243-T245 PolarHBondContact O-N 3.47Å; N243-T245 PolarHBondContact OD1-N 3.2Å; N243-Q246 HydrophobicContact CB-CB 3.88Å; N243-Q246 PolarHBondContact O-N 3.32Å; N243-Q246 PolarHBondContact OD1-N 2.94Å; N243-Q246 VanDerWaalsContact OD1-N 3.08Å; N243-G247 PolarHBondContact O-N 3.03Å; N243-G247 VanDerWaalsContact O-N 3.09Å | ||
| 244 | F | 90.4 | Very high | 91 | Very high | 78 Ų | 78 | 64.6 Ų | 64.6 | 34% | 0.342 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -65.1 | -32.1 | -177.6 | -66.9 | -56.1 | 0 | 0 | 0 | 113 | N193 W196 G247 L248 | N193-F244 HydrophobicContact CB-CD2 4.32Å; N193-F244 WeakPolarHBondContact OD1-CD2 3.42Å; N193-F244 PolarHBondContact OD1-N 3.27Å; N193-F244 VanDerWaalsContact OD1-N 3.15Å; W196-F244 HydrophobicContact CD2-CB 4.16Å; W196-F244 HydrophobicContact CG-CB 3.93Å; F244-G247 PolarHBondContact O-N 2.96Å; F244-L248 PolarHBondContact O-N 3.11Å |
| 245 | T | 89.4 | Confident | 90.3 | Very high | 3 Ų | 3 | 68.4 Ų | 68.4 | 2% | 0.018 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -70.1 | -41.9 | 178.8 | -57.8 | 0 | 0 | 0 | 0 | 111.8 | Q171 I175 I181 W196 N243 G247 L248 C249 | Q171-T245 HydrophobicContact CG-CG2 4.23Å; Q171-T245 PolarHBondContact NE2-OG1 2.89Å; I175-T245 HydrophobicContact CD1-CG2 4.17Å; I175-T245 HydrophobicContact CG1-CG2 4.22Å; I181-T245 HydrophobicContact CG2-CG2 3.38Å; W196-T245 PolarHBondContact NE1-OG1 2.89Å; N243-T245 VanDerWaalsContact C-N 3.28Å; N243-T245 PolarHBondContact O-N 3.47Å; N243-T245 PolarHBondContact OD1-N 3.2Å; T245-G247 VanDerWaalsContact C-N 3.31Å; T245-G247 PolarHBondContact O-N 3.02Å; T245-L248 WeakPolarHBondContact O-CB 3.49Å; T245-L248 PolarHBondContact O-N 2.8Å; T245-C249 PolarHBondContact O-N 3.26Å; T245-C249 PolarHBondContact O-SG 3.33Å; T245-C249 VanDerWaalsContact O-SG 3.38Å |
| 246 | Q | 87.1 | Confident | 89.7 | Confident | 68 Ų | 68 | 63.2 Ų | 63.2 | 32% | 0.318 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -60.1 | -43.8 | 172 | 180 | 176.5 | 26.6 | 0 | 0 | 111.1 | N182 N243 L248 C249 W250 | N182-Q246 WeakPolarHBondContact OD1-CG 3.33Å; N243-Q246 HydrophobicContact CB-CB 3.88Å; N243-Q246 PolarHBondContact O-N 3.32Å; N243-Q246 PolarHBondContact OD1-N 2.94Å; N243-Q246 VanDerWaalsContact OD1-N 3.08Å; Q246-L248 VanDerWaalsContact C-N 3.33Å; Q246-L248 PolarHBondContact O-N 3.09Å; Q246-C249 PolarHBondContact O-N 3.43Å; Q246-W250 WeakPolarHBondContact O-CB 3.35Å; Q246-W250 PolarHBondContact O-N 3.25Å |
| 247 | G | 88.1 | Confident | 88.6 | Confident | 39 Ų | 39 | 68 Ų | 68 | 40% | 0.402 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -57.5 | -42.8 | 174.3 | 0 | 0 | 0 | 0 | 0 | 113 | N243 F244 T245 W250 F251 | N243-G247 PolarHBondContact O-N 3.03Å; N243-G247 VanDerWaalsContact O-N 3.09Å; F244-G247 PolarHBondContact O-N 2.96Å; T245-G247 VanDerWaalsContact C-N 3.31Å; T245-G247 PolarHBondContact O-N 3.02Å; G247-W250 PolarHBondContact O-N 3.1Å; G247-F251 WeakPolarHBondContact O-CB 3.36Å; G247-F251 PolarHBondContact O-N 3.17Å |
| 248 | L | 88.9 | Confident | 88.3 | Confident | 25 Ų | 25 | 71.5 Ų | 71.5 | 13% | 0.131 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -63.2 | -48.4 | 175.6 | -176.9 | 72.1 | 0 | 0 | 0 | 112.1 | W196 F244 T245 Q246 W250 F251 Y252 | W196-L248 HydrophobicContact CH2-CD1 4.48Å; W196-L248 HydrophobicContact CZ2-CB 4.08Å; W196-L248 HydrophobicContact CZ2-CD1 4.39Å; W196-L248 HydrophobicContact CZ2-CD2 3.92Å; W196-L248 HydrophobicContact CZ2-CG 4.35Å; F244-L248 PolarHBondContact O-N 3.11Å; T245-L248 WeakPolarHBondContact O-CB 3.49Å; T245-L248 PolarHBondContact O-N 2.8Å; Q246-L248 VanDerWaalsContact C-N 3.33Å; Q246-L248 PolarHBondContact O-N 3.09Å; L248-W250 VanDerWaalsContact C-N 3.3Å; L248-W250 PolarHBondContact O-N 2.82Å; L248-F251 WeakPolarHBondContact O-CB 3.35Å; L248-F251 PolarHBondContact O-N 3.38Å; L248-Y252 HydrophobicContact CD1-CD1 4.38Å; L248-Y252 HydrophobicContact CD1-CE1 3.76Å; L248-Y252 HydrophobicContact CD1-CE2 4.26Å; L248-Y252 HydrophobicContact CD2-CE2 4.24Å; L248-Y252 HydrophobicContact CG-CD2 4.47Å; L248-Y252 HydrophobicContact CG-CE1 4.39Å; L248-Y252 HydrophobicContact CG-CE2 4.09Å; L248-Y252 PolarHBondContact O-N 2.82Å |
| 249 | C | 87.8 | Confident | 88 | Confident | 11 Ų | 11 | 73.6 Ų | 73.6 | 7% | 0.074 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -60.7 | -41.4 | 178.7 | -69.6 | 0 | 0 | 0 | 0 | 111.5 | L99 T245 Q246 Y252 K253 | L99-C249 HydrophobicContact CD2-CB 4.17Å; T245-C249 PolarHBondContact O-N 3.26Å; T245-C249 PolarHBondContact O-SG 3.33Å; T245-C249 VanDerWaalsContact O-SG 3.38Å; Q246-C249 PolarHBondContact O-N 3.43Å; C249-Y252 PolarHBondContact O-N 3.24Å; C249-K253 WeakPolarHBondContact O-CG 3.32Å; C249-K253 PolarHBondContact O-N 3.08Å |
| 250 | W | 87.4 | Confident | 87.7 | Confident | 178 Ų | 178 | 72.1 Ų | 72.1 | 67% | 0.674 | 33% | 0.334 | S | S | * | . | H | α-helix | trans | -64.1 | -44.4 | 175.3 | -176.2 | 72.8 | 0 | 0 | 0 | 111.7 | Q246 G247 L248 Y252 K253 Y254 | Q246-W250 WeakPolarHBondContact O-CB 3.35Å; Q246-W250 PolarHBondContact O-N 3.25Å; G247-W250 PolarHBondContact O-N 3.1Å; L248-W250 VanDerWaalsContact C-N 3.3Å; L248-W250 PolarHBondContact O-N 2.82Å; W250-Y252 PolarHBondContact O-N 3.05Å; W250-K253 PolarHBondContact O-N 3.39Å; W250-Y254 WeakPolarHBondContact O-CB 3.4Å; W250-Y254 PolarHBondContact O-N 3.36Å |
| 251 | F | 89.2 | Confident | 87.3 | Confident | 74 Ų | 74 | 70.4 Ų | 70.4 | 33% | 0.325 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -58.1 | -46.7 | 175.4 | 175.3 | -103.1 | 0 | 0 | 0 | 111.9 | W112 G247 L248 Y254 R255 | W112-F251 HydrophobicContact CZ2-CZ 4.36Å; G247-F251 WeakPolarHBondContact O-CB 3.36Å; G247-F251 PolarHBondContact O-N 3.17Å; L248-F251 WeakPolarHBondContact O-CB 3.35Å; L248-F251 PolarHBondContact O-N 3.38Å; F251-Y254 PolarHBondContact O-N 3.4Å; F251-R255 HydrophobicContact CD2-CG 4.22Å; F251-R255 HydrophobicContact CE1-CG 4.28Å; F251-R255 HydrophobicContact CE2-CG 3.88Å; F251-R255 HydrophobicContact CZ-CG 3.91Å; F251-R255 WeakPolarHBondContact O-CB 3.44Å; F251-R255 VanDerWaalsContact O-CG 3.24Å; F251-R255 WeakPolarHBondContact O-CG 3.19Å; F251-R255 PolarHBondContact O-N 3.3Å; F251-R255 VanDerWaalsContact O-N 3.11Å |
| 252 | Y | 88.6 | Confident | 87.1 | Confident | 5 Ų | 5 | 72.7 Ų | 72.7 | 2% | 0.02 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -62.8 | -45.2 | 177.7 | -73 | -6.8 | 0 | 0 | 0 | 112.5 | F95 L109 H168 L248 C249 W250 R255 V256 | F95-Y252 HydrophobicContact CD1-CD2 4.12Å; F95-Y252 HydrophobicContact CD1-CE2 4.22Å; F95-Y252 HydrophobicContact CD2-CE2 4.38Å; F95-Y252 HydrophobicContact CE1-CD2 4.32Å; F95-Y252 HydrophobicContact CE1-CE2 4.15Å; F95-Y252 HydrophobicContact CE2-CE2 4.31Å; F95-Y252 HydrophobicContact CG-CD2 4.43Å; F95-Y252 HydrophobicContact CG-CE2 4.33Å; F95-Y252 HydrophobicContact CZ-CE2 4.2Å; L109-Y252 HydrophobicContact CD1-CD1 3.82Å; L109-Y252 HydrophobicContact CD1-CD2 4.16Å; L109-Y252 HydrophobicContact CD1-CE1 4.26Å; L109-Y252 HydrophobicContact CD1-CG 3.77Å; L109-Y252 HydrophobicContact CD2-CD2 4.28Å; H168-Y252 PolarHBondContact NE2-OH 3.11Å; L248-Y252 HydrophobicContact CD1-CD1 4.38Å; L248-Y252 HydrophobicContact CD1-CE1 3.76Å; L248-Y252 HydrophobicContact CD1-CE2 4.26Å; L248-Y252 HydrophobicContact CD2-CE2 4.24Å; L248-Y252 HydrophobicContact CG-CD2 4.47Å; L248-Y252 HydrophobicContact CG-CE1 4.39Å; L248-Y252 HydrophobicContact CG-CE2 4.09Å; L248-Y252 PolarHBondContact O-N 2.82Å; C249-Y252 PolarHBondContact O-N 3.24Å; W250-Y252 PolarHBondContact O-N 3.05Å; Y252-R255 PolarHBondContact O-N 2.64Å; Y252-V256 WeakPolarHBondContact O-CG2 3.5Å; Y252-V256 PolarHBondContact O-N 3.06Å |
| 253 | K | 84.9 | Confident | 86.8 | Confident | 88 Ų | 88 | 68.4 Ų | 68.4 | 38% | 0.383 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -62.6 | -43.5 | 177 | -74.9 | -170.1 | 174.3 | -168.4 | 0 | 112.3 | C249 W250 R255 V256 Q257 | C249-K253 WeakPolarHBondContact O-CG 3.32Å; C249-K253 PolarHBondContact O-N 3.08Å; W250-K253 PolarHBondContact O-N 3.39Å; K253-R255 VanDerWaalsContact C-N 3.29Å; K253-R255 PolarHBondContact O-N 2.87Å; K253-V256 WeakPolarHBondContact O-CG2 3.46Å; K253-Q257 VanDerWaalsContact O-CG 3.24Å; K253-Q257 WeakPolarHBondContact O-CG 3.46Å; K253-Q257 PolarHBondContact O-N 3.4Å |
| 254 | Y | 88.4 | Confident | 86.6 | Confident | 144 Ų | 144 | 72.2 Ų | 72.2 | 57% | 0.565 | 33% | 0.325 | S | S | * | . | H | α-helix | trans | -65.4 | -32.3 | -179.6 | -179.6 | -102.7 | 0 | 0 | 0 | 112.9 | W250 F251 | W250-Y254 WeakPolarHBondContact O-CB 3.4Å; W250-Y254 PolarHBondContact O-N 3.36Å; F251-Y254 PolarHBondContact O-N 3.4Å |
| 255 | R | 83.4 | Confident | 86.3 | Confident | 119 Ų | 119 | 71.8 Ų | 71.8 | 45% | 0.449 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -77.5 | -24.9 | -176.2 | -75.2 | -60.2 | -129.5 | -167.9 | -0.2 | 114.9 | F251 Y252 K253 | F251-R255 HydrophobicContact CD2-CG 4.22Å; F251-R255 HydrophobicContact CE1-CG 4.28Å; F251-R255 HydrophobicContact CE2-CG 3.88Å; F251-R255 HydrophobicContact CZ-CG 3.91Å; F251-R255 WeakPolarHBondContact O-CB 3.44Å; F251-R255 VanDerWaalsContact O-CG 3.24Å; F251-R255 WeakPolarHBondContact O-CG 3.19Å; F251-R255 PolarHBondContact O-N 3.3Å; F251-R255 VanDerWaalsContact O-N 3.11Å; Y252-R255 PolarHBondContact O-N 2.64Å; K253-R255 VanDerWaalsContact C-N 3.29Å; K253-R255 PolarHBondContact O-N 2.87Å |
| 256 | V | 84.4 | Confident | 86 | Confident | 5 Ų | 5 | 77.5 Ų | 77.5 | 3% | 0.03 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -102 | -22.1 | -170.6 | -63.7 | 0 | 0 | 0 | 0 | 113.7 | M101 E105 K108 L109 Y252 K253 | M101-V256 HydrophobicContact CE-CB 3.91Å; M101-V256 HydrophobicContact CE-CG1 3.9Å; M101-V256 HydrophobicContact CE-CG2 3.37Å; M101-V256 HydrophobicContact SD-CG2 4.44Å; E105-V256 HydrophobicContact CB-CB 3.98Å; E105-V256 HydrophobicContact CB-CG2 4.08Å; E105-V256 HydrophobicContact CG-CB 4.44Å; E105-V256 HydrophobicContact CG-CG2 4.48Å; K108-V256 HydrophobicContact CB-CG1 4.21Å; K108-V256 WeakPolarHBondContact CD-O 3.37Å; K108-V256 PolarHBondContact NZ-O 2.84Å; L109-V256 HydrophobicContact CB-CG1 3.92Å; L109-V256 HydrophobicContact CD1-CG1 4.32Å; Y252-V256 WeakPolarHBondContact O-CG2 3.5Å; Y252-V256 PolarHBondContact O-N 3.06Å; K253-V256 WeakPolarHBondContact O-CG2 3.46Å |
| 257 | Q | 74.1 | Confident | 85.9 | Confident | 174 Ų | 174 | 78.4 Ų | 78.4 | 81% | 0.813 | 35% | 0.351 | S | S | * | . | trans | -56.6 | 0 | 164.5 | -73.3 | 173 | 1.8 | 0 | 0 | 109.8 | K253 | K253-Q257 VanDerWaalsContact O-CG 3.24Å; K253-Q257 WeakPolarHBondContact O-CG 3.46Å; K253-Q257 PolarHBondContact O-N 3.4Å |
Retrieved 257 of 257 residues in 132 ms
(Link to these results)