| 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 | 47.7 | Very low | 46.3 | Very low | 211 Ų | 211 | 129.3 Ų | 129.3 | 100% | 1.039 | 67% | 0.672 | S | S | * | * | 0 | -45.9 | 0 | -100.4 | -179.6 | -85.9 | 0 | 0 | 111.8 | W3 C4 Q5 | M1-W3 PolarHBondContact O-N 3.41Å; M1-C4 PolarHBondContact O-N 2.91Å; M1-Q5 PolarHBondContact O-N 3.3Å | |||
| 2 | E | 44.8 | Very low | 47.3 | Very low | 156 Ų | 156 | 126.1 Ų | 126.1 | 73% | 0.729 | 66% | 0.662 | S | S | * | * | H | α-helix | trans | -60.5 | -37.2 | 179.6 | -68.6 | 178 | 144.4 | 0 | 0 | 114.8 | C4 Q5 Q6 | E2-C4 PolarHBondContact O-N 3.12Å; E2-Q5 PolarHBondContact O-N 3.25Å; E2-Q6 PolarHBondContact O-N 3.41Å; E2-Q6 VanDerWaalsContact O-N 3.15Å |
| 3 | W | 36.7 | Very low | 48 | Very low | 225 Ų | 225 | 124.8 Ų | 124.8 | 85% | 0.852 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -64.7 | -32.7 | 177.5 | -86.2 | 73.5 | 0 | 0 | 0 | 114.3 | M1 A7 | M1-W3 PolarHBondContact O-N 3.41Å; W3-A7 WeakPolarHBondContact O-CB 3.34Å; W3-A7 PolarHBondContact O-N 3.48Å |
| 4 | C | 43.4 | Very low | 49 | Very low | 107 Ų | 107 | 123.1 Ų | 123.1 | 72% | 0.723 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -74.5 | -29 | 175.5 | -81.1 | 0 | 0 | 0 | 0 | 112.4 | M1 E2 G8 | M1-C4 PolarHBondContact O-N 2.91Å; E2-C4 PolarHBondContact O-N 3.12Å; C4-G8 PolarHBondContact O-N 3.44Å; C4-G8 VanDerWaalsContact O-N 3.11Å |
| 5 | Q | 44.9 | Very low | 49.4 | Very low | 149 Ų | 149 | 118.7 Ų | 118.7 | 70% | 0.696 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -72.5 | -39.2 | 176.4 | -109.7 | 167.2 | -39.9 | 0 | 0 | 111.9 | M1 E2 L9 | M1-Q5 PolarHBondContact O-N 3.3Å; E2-Q5 PolarHBondContact O-N 3.25Å; Q5-L9 PolarHBondContact O-N 3.48Å; Q5-L9 VanDerWaalsContact O-N 3.15Å |
| 6 | Q | 44.3 | Very low | 50 | Low | 140 Ų | 140 | 116.9 Ų | 116.9 | 65% | 0.654 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -69.5 | -40.2 | 176.4 | -111.3 | 162.2 | -23.8 | 0 | 0 | 112.9 | E2 L9 S10 | E2-Q6 PolarHBondContact O-N 3.41Å; E2-Q6 VanDerWaalsContact O-N 3.15Å; Q6-L9 PolarHBondContact O-N 3.11Å; Q6-S10 PolarHBondContact O-N 3.27Å; Q6-S10 VanDerWaalsContact O-N 3.15Å |
| 7 | A | 44.1 | Very low | 50.8 | Low | 58 Ų | 58 | 116.3 Ų | 116.3 | 48% | 0.479 | 63% | 0.625 | S | S | . | * | H | α-helix | trans | -67.7 | -37.6 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | W3 S10 M11 | W3-A7 WeakPolarHBondContact O-CB 3.34Å; W3-A7 PolarHBondContact O-N 3.48Å; A7-S10 PolarHBondContact O-OG 3.47Å; A7-M11 WeakPolarHBondContact O-CB 3.47Å; A7-M11 PolarHBondContact O-N 3.39Å |
| 8 | G | 48.1 | Very low | 51.4 | Low | 36 Ų | 36 | 112.9 Ų | 112.9 | 37% | 0.371 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -65 | -37 | 174.2 | 0 | 0 | 0 | 0 | 0 | 113 | C4 V12 | C4-G8 PolarHBondContact O-N 3.44Å; C4-G8 VanDerWaalsContact O-N 3.11Å; G8-V12 VanDerWaalsContact O-CG2 3.24Å; G8-V12 WeakPolarHBondContact O-CG2 3.24Å; G8-V12 PolarHBondContact O-N 3.4Å; G8-V12 VanDerWaalsContact O-N 3.13Å |
| 9 | L | 50.9 | Low | 51.9 | Low | 131 Ų | 131 | 117.6 Ų | 117.6 | 69% | 0.686 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -70.6 | -40.3 | 179.1 | -154.7 | 79.8 | 0 | 0 | 0 | 112.3 | Q5 Q6 L13 | Q5-L9 PolarHBondContact O-N 3.48Å; Q5-L9 VanDerWaalsContact O-N 3.15Å; Q6-L9 PolarHBondContact O-N 3.11Å; L9-L13 WeakPolarHBondContact O-CB 3.46Å; L9-L13 PolarHBondContact O-N 3.36Å |
| 10 | S | 52.3 | Low | 52.2 | Low | 64 Ų | 64 | 113.4 Ų | 113.4 | 45% | 0.448 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -68.3 | -38.8 | 177.6 | 88.2 | 0 | 0 | 0 | 0 | 111.8 | Q6 A7 V12 L13 D14 | Q6-S10 PolarHBondContact O-N 3.27Å; Q6-S10 VanDerWaalsContact O-N 3.15Å; A7-S10 PolarHBondContact O-OG 3.47Å; S10-V12 PolarHBondContact O-N 3.42Å; S10-L13 PolarHBondContact O-N 3.15Å; S10-D14 WeakPolarHBondContact O-CB 3.5Å; S10-D14 PolarHBondContact O-N 3.11Å |
| 11 | M | 52.5 | Low | 52.8 | Low | 145 Ų | 145 | 117.3 Ų | 117.3 | 71% | 0.714 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -68 | -35.6 | 178.6 | -140.1 | 177.6 | 82.5 | 0 | 0 | 112.3 | A7 A15 | A7-M11 WeakPolarHBondContact O-CB 3.47Å; A7-M11 PolarHBondContact O-N 3.39Å; M11-A15 VanDerWaalsContact O-CB 3.24Å; M11-A15 WeakPolarHBondContact O-CB 3.24Å; M11-A15 PolarHBondContact O-N 2.87Å |
| 12 | V | 57.3 | Low | 53.3 | Low | 91 Ų | 91 | 111.4 Ų | 111.4 | 55% | 0.552 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -68.6 | -41.5 | 171.9 | 171.3 | 0 | 0 | 0 | 0 | 110.8 | G8 S10 A15 V16 | G8-V12 VanDerWaalsContact O-CG2 3.24Å; G8-V12 WeakPolarHBondContact O-CG2 3.24Å; G8-V12 PolarHBondContact O-N 3.4Å; G8-V12 VanDerWaalsContact O-N 3.13Å; S10-V12 PolarHBondContact O-N 3.42Å; V12-A15 PolarHBondContact O-N 3.47Å; V12-V16 HydrophobicContact CG1-CG2 4.23Å; V12-V16 VanDerWaalsContact O-CB 3.28Å; V12-V16 WeakPolarHBondContact O-CB 3.39Å; V12-V16 WeakPolarHBondContact O-CG2 3.46Å; V12-V16 PolarHBondContact O-N 3.15Å |
| 13 | L | 56.6 | Low | 54 | Low | 109 Ų | 109 | 107.4 Ų | 107.4 | 57% | 0.571 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -63.5 | -43.7 | 177.6 | -160.5 | 80.8 | 0 | 0 | 0 | 111.6 | L9 S10 V16 L17 | L9-L13 WeakPolarHBondContact O-CB 3.46Å; L9-L13 PolarHBondContact O-N 3.36Å; S10-L13 PolarHBondContact O-N 3.15Å; L13-V16 PolarHBondContact O-N 3.39Å; L13-L17 HydrophobicContact CD2-CD1 4.39Å; L13-L17 HydrophobicContact CG-CD1 4.17Å; L13-L17 VanDerWaalsContact O-CB 3.31Å; L13-L17 WeakPolarHBondContact O-CB 3.48Å; L13-L17 VanDerWaalsContact O-CG 3.29Å; L13-L17 WeakPolarHBondContact O-CG 2.88Å; L13-L17 PolarHBondContact O-N 3.21Å |
| 14 | D | 61.8 | Low | 55 | Low | 101 Ų | 101 | 100 Ų | 100 | 54% | 0.54 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -68.2 | -38.2 | 177.3 | -76 | -29.3 | 0 | 0 | 0 | 112 | S10 L17 A18 | S10-D14 WeakPolarHBondContact O-CB 3.5Å; S10-D14 PolarHBondContact O-N 3.11Å; D14-L17 PolarHBondContact O-N 3.21Å; D14-A18 WeakPolarHBondContact O-CB 3.17Å; D14-A18 PolarHBondContact O-N 3.12Å |
| 15 | A | 56.2 | Low | 55.8 | Low | 57 Ų | 57 | 103.3 Ų | 103.3 | 47% | 0.471 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -66.8 | -37.5 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | M11 V12 R19 | M11-A15 VanDerWaalsContact O-CB 3.24Å; M11-A15 WeakPolarHBondContact O-CB 3.24Å; M11-A15 PolarHBondContact O-N 2.87Å; V12-A15 PolarHBondContact O-N 3.47Å; A15-R19 WeakPolarHBondContact O-CB 3.12Å; A15-R19 PolarHBondContact O-N 2.84Å |
| 16 | V | 59.1 | Low | 56.1 | Low | 91 Ų | 91 | 103.8 Ų | 103.8 | 55% | 0.552 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -69 | -41.3 | 174.6 | 168.6 | 0 | 0 | 0 | 0 | 110.9 | V12 L13 G20 | V12-V16 HydrophobicContact CG1-CG2 4.23Å; V12-V16 VanDerWaalsContact O-CB 3.28Å; V12-V16 WeakPolarHBondContact O-CB 3.39Å; V12-V16 WeakPolarHBondContact O-CG2 3.46Å; V12-V16 PolarHBondContact O-N 3.15Å; L13-V16 PolarHBondContact O-N 3.39Å; V16-G20 PolarHBondContact O-N 3.13Å |
| 17 | L | 62.9 | Low | 57 | Low | 106 Ų | 106 | 100.1 Ų | 100.1 | 56% | 0.555 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -66.4 | -41 | 175 | -79.3 | 163.8 | 0 | 0 | 0 | 111.6 | L13 D14 G20 R21 | L13-L17 HydrophobicContact CD2-CD1 4.39Å; L13-L17 HydrophobicContact CG-CD1 4.17Å; L13-L17 VanDerWaalsContact O-CB 3.31Å; L13-L17 WeakPolarHBondContact O-CB 3.48Å; L13-L17 VanDerWaalsContact O-CG 3.29Å; L13-L17 WeakPolarHBondContact O-CG 2.88Å; L13-L17 PolarHBondContact O-N 3.21Å; D14-L17 PolarHBondContact O-N 3.21Å; L17-G20 PolarHBondContact O-N 3.17Å; L17-R21 WeakPolarHBondContact O-CB 3.44Å; L17-R21 PolarHBondContact O-N 3.49Å |
| 18 | A | 62.4 | Low | 58.1 | Low | 56 Ų | 56 | 98.6 Ų | 98.6 | 46% | 0.463 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -67.6 | -41.1 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | D14 R21 T22 | D14-A18 WeakPolarHBondContact O-CB 3.17Å; D14-A18 PolarHBondContact O-N 3.12Å; A18-R21 PolarHBondContact O-N 2.99Å; A18-T22 PolarHBondContact O-N 2.98Å; A18-T22 PolarHBondContact O-OG1 3.44Å |
| 19 | R | 59.3 | Low | 58.6 | Low | 201 Ų | 201 | 100 Ų | 100 | 76% | 0.758 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -61.9 | -44.9 | 169 | -101.5 | -177.4 | 168.7 | -169.1 | -2.6 | 111 | A15 R21 T22 V23 | A15-R19 WeakPolarHBondContact O-CB 3.12Å; A15-R19 PolarHBondContact O-N 2.84Å; R19-R21 VanDerWaalsContact C-N 3.33Å; R19-R21 PolarHBondContact O-N 2.97Å; R19-T22 PolarHBondContact O-N 3.45Å; R19-V23 WeakPolarHBondContact O-CB 3.28Å; R19-V23 VanDerWaalsContact O-CG2 3.23Å; R19-V23 WeakPolarHBondContact O-CG2 3.31Å; R19-V23 PolarHBondContact O-N 3.15Å |
| 20 | G | 58.5 | Low | 59 | Low | 34 Ų | 34 | 96 Ų | 96 | 35% | 0.351 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -58.8 | -42.5 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | V16 L17 T22 V23 C24 | V16-G20 PolarHBondContact O-N 3.13Å; L17-G20 PolarHBondContact O-N 3.17Å; G20-T22 PolarHBondContact O-N 3.06Å; G20-V23 PolarHBondContact O-N 3.29Å; G20-C24 WeakPolarHBondContact O-CB 3.19Å; G20-C24 PolarHBondContact O-N 3.32Å |
| 21 | R | 65.6 | Low | 59.8 | Low | 196 Ų | 196 | 95.3 Ų | 95.3 | 74% | 0.74 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -65.5 | -39.2 | 176.5 | -137.8 | 176.4 | -163.7 | 177.9 | 5.1 | 112.2 | L17 A18 R19 K25 | L17-R21 WeakPolarHBondContact O-CB 3.44Å; L17-R21 PolarHBondContact O-N 3.49Å; A18-R21 PolarHBondContact O-N 2.99Å; R19-R21 VanDerWaalsContact C-N 3.33Å; R19-R21 PolarHBondContact O-N 2.97Å; R21-K25 WeakPolarHBondContact O-CG 3.47Å; R21-K25 PolarHBondContact O-N 3.05Å |
| 22 | T | 57.7 | Low | 60.9 | Low | 86 Ų | 86 | 92.2 Ų | 92.2 | 53% | 0.528 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -69.3 | -41.3 | 177.2 | -51.6 | 0 | 0 | 0 | 0 | 111.5 | A18 R19 G20 K25 H26 | A18-T22 PolarHBondContact O-N 2.98Å; A18-T22 PolarHBondContact O-OG1 3.44Å; R19-T22 PolarHBondContact O-N 3.45Å; G20-T22 PolarHBondContact O-N 3.06Å; T22-K25 PolarHBondContact O-N 2.89Å; T22-H26 PolarHBondContact O-N 2.86Å |
| 23 | V | 58.5 | Low | 61.3 | Low | 73 Ų | 73 | 88.2 Ų | 88.2 | 44% | 0.442 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -65.9 | -42.7 | 175.3 | 171.3 | 0 | 0 | 0 | 0 | 111.2 | R19 G20 K25 H26 N27 I31 | R19-V23 WeakPolarHBondContact O-CB 3.28Å; R19-V23 VanDerWaalsContact O-CG2 3.23Å; R19-V23 WeakPolarHBondContact O-CG2 3.31Å; R19-V23 PolarHBondContact O-N 3.15Å; G20-V23 PolarHBondContact O-N 3.29Å; V23-K25 VanDerWaalsContact C-N 3.31Å; V23-K25 PolarHBondContact O-N 3.24Å; V23-H26 PolarHBondContact O-N 3.4Å; V23-N27 WeakPolarHBondContact O-CB 3.29Å; V23-N27 PolarHBondContact O-N 2.84Å; V23-I31 HydrophobicContact CG1-CD1 4.26Å |
| 24 | C | 58.3 | Low | 62 | Low | 70 Ų | 70 | 85.2 Ų | 85.2 | 47% | 0.473 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -63.1 | -33.7 | 173.8 | -92.3 | 0 | 0 | 0 | 0 | 113 | G20 G28 | G20-C24 WeakPolarHBondContact O-CB 3.19Å; G20-C24 PolarHBondContact O-N 3.32Å; C24-G28 WeakPolarHBondContact O-CA 3.4Å; C24-G28 PolarHBondContact O-N 2.81Å |
| 25 | K | 60.3 | Low | 62.9 | Low | 175 Ų | 175 | 84.7 Ų | 84.7 | 76% | 0.761 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -70.4 | -35.7 | 175.9 | -79.9 | -176.4 | 175.4 | -172.2 | 0 | 113.1 | R21 T22 V23 | R21-K25 WeakPolarHBondContact O-CG 3.47Å; R21-K25 PolarHBondContact O-N 3.05Å; T22-K25 PolarHBondContact O-N 2.89Å; V23-K25 VanDerWaalsContact C-N 3.31Å; V23-K25 PolarHBondContact O-N 3.24Å |
| 26 | H | 52.3 | Low | 64.1 | Low | 160 Ų | 160 | 82.5 Ų | 82.5 | 74% | 0.741 | 43% | 0.433 | S | S | * | . | H | α-helix | trans | -86.9 | -32.8 | -179.3 | -87.7 | 73.4 | 0 | 0 | 0 | 113.9 | T22 V23 | T22-H26 PolarHBondContact O-N 2.86Å; V23-H26 PolarHBondContact O-N 3.4Å |
| 27 | N | 62.4 | Low | 64.8 | Low | 62 Ų | 62 | 78.9 Ų | 78.9 | 33% | 0.332 | 41% | 0.411 | S | S | . | . | S | Bend | trans | -117.2 | 21.9 | -175.7 | -60 | -59.2 | 0 | 0 | 0 | 112.5 | V23 L29 L30 I31 | V23-N27 WeakPolarHBondContact O-CB 3.29Å; V23-N27 PolarHBondContact O-N 2.84Å; N27-L29 VanDerWaalsContact C-N 3.32Å; N27-L29 PolarHBondContact O-N 2.79Å; N27-L30 HydrophobicContact CB-CB 4.48Å; N27-L30 WeakPolarHBondContact O-CB 3.44Å; N27-L30 PolarHBondContact O-N 2.9Å; N27-L30 VanDerWaalsContact O-N 3.13Å; N27-I31 HydrophobicContact CB-CD1 4.15Å; N27-I31 HydrophobicContact CB-CG1 4.41Å; N27-I31 WeakPolarHBondContact O-CG1 3.09Å; N27-I31 PolarHBondContact O-N 3.13Å |
| 28 | G | 65.9 | Low | 65.7 | Low | 26 Ų | 26 | 78 Ų | 78 | 27% | 0.268 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -56 | -43.9 | -171.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | C24 L30 I31 L32 | C24-G28 WeakPolarHBondContact O-CA 3.4Å; C24-G28 PolarHBondContact O-N 2.81Å; G28-L30 PolarHBondContact O-N 3.43Å; G28-I31 PolarHBondContact O-N 3.43Å; G28-L32 WeakPolarHBondContact O-CB 3.37Å; G28-L32 PolarHBondContact O-N 2.96Å |
| 29 | L | 60.1 | Low | 67 | Low | 67 Ų | 67 | 78.9 Ų | 78.9 | 35% | 0.351 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -64 | -43 | 178.8 | -171.7 | 66.6 | 0 | 0 | 0 | 112 | N27 L32 S33 G274 W275 P278 | N27-L29 VanDerWaalsContact C-N 3.32Å; N27-L29 PolarHBondContact O-N 2.79Å; L29-L32 PolarHBondContact O-N 3.39Å; L29-S33 PolarHBondContact O-N 3.12Å; L29-S33 PolarHBondContact O-OG 2.95Å; L29-S33 VanDerWaalsContact O-OG 3.07Å; L29-G274 WeakPolarHBondContact CD1-O 3.29Å; L29-W275 HydrophobicContact CD1-CE3 4.49Å; L29-P278 HydrophobicContact CD1-CG 3.85Å |
| 30 | L | 58.2 | Low | 68.3 | Low | 47 Ų | 47 | 69.3 Ų | 69.3 | 25% | 0.246 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -61.4 | -49.4 | 177.3 | 179.2 | 163.2 | 0 | 0 | 0 | 111.4 | N27 G28 L32 S33 V34 A349 R465 | N27-L30 HydrophobicContact CB-CB 4.48Å; N27-L30 WeakPolarHBondContact O-CB 3.44Å; N27-L30 PolarHBondContact O-N 2.9Å; N27-L30 VanDerWaalsContact O-N 3.13Å; G28-L30 PolarHBondContact O-N 3.43Å; L30-L32 VanDerWaalsContact C-N 3.31Å; L30-L32 PolarHBondContact O-N 3.42Å; L30-S33 PolarHBondContact O-N 3.24Å; L30-V34 HydrophobicContact CD2-CG2 4.25Å; L30-V34 WeakPolarHBondContact O-CG2 3.34Å; L30-V34 PolarHBondContact O-N 3.37Å; L30-A349 HydrophobicContact CD1-CB 3.99Å; L30-A349 WeakPolarHBondContact CD1-O 3.26Å; L30-R465 VanDerWaalsContact CD1-NH1 3.25Å |
| 31 | I | 69.4 | Low | 69.5 | Low | 49 Ų | 49 | 69.8 Ų | 69.8 | 25% | 0.251 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -63 | -43.2 | -179.4 | -66.7 | 166.1 | 0 | 0 | 0 | 109.8 | V23 N27 G28 V34 L35 | V23-I31 HydrophobicContact CG1-CD1 4.26Å; N27-I31 HydrophobicContact CB-CD1 4.15Å; N27-I31 HydrophobicContact CB-CG1 4.41Å; N27-I31 WeakPolarHBondContact O-CG1 3.09Å; N27-I31 PolarHBondContact O-N 3.13Å; G28-I31 PolarHBondContact O-N 3.43Å; I31-V34 PolarHBondContact O-N 3.5Å; I31-L35 HydrophobicContact CG2-CD1 3.85Å; I31-L35 HydrophobicContact CG2-CG 4.45Å; I31-L35 WeakPolarHBondContact O-CB 3.3Å; I31-L35 VanDerWaalsContact O-CG 3.32Å; I31-L35 WeakPolarHBondContact O-CG 3.4Å; I31-L35 PolarHBondContact O-N 3.28Å |
| 32 | L | 75.4 | Confident | 70.7 | Confident | 80 Ų | 80 | 66.1 Ų | 66.1 | 42% | 0.419 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -62.6 | -43.6 | 178 | -165.8 | 64.9 | 0 | 0 | 0 | 111.2 | G28 L29 L30 L35 S36 P278 | G28-L32 WeakPolarHBondContact O-CB 3.37Å; G28-L32 PolarHBondContact O-N 2.96Å; L29-L32 PolarHBondContact O-N 3.39Å; L30-L32 VanDerWaalsContact C-N 3.31Å; L30-L32 PolarHBondContact O-N 3.42Å; L32-L35 PolarHBondContact O-N 3.14Å; L32-S36 WeakPolarHBondContact O-CB 3.39Å; L32-S36 PolarHBondContact O-N 3.43Å; L32-S36 PolarHBondContact O-OG 2.86Å; L32-P278 HydrophobicContact CB-CB 4.15Å; L32-P278 HydrophobicContact CB-CG 4.17Å; L32-P278 HydrophobicContact CD2-CB 3.78Å; L32-P278 HydrophobicContact CD2-CG 3.77Å; L32-P278 HydrophobicContact CG-CB 3.55Å; L32-P278 HydrophobicContact CG-CG 3.91Å |
| 33 | S | 66.1 | Low | 72.3 | Confident | 6 Ų | 6 | 64.5 Ų | 64.5 | 4% | 0.042 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -62.1 | -43 | 175.9 | -64.3 | 0 | 0 | 0 | 0 | 113.2 | L29 L30 S36 V37 | L29-S33 PolarHBondContact O-N 3.12Å; L29-S33 PolarHBondContact O-OG 2.95Å; L29-S33 VanDerWaalsContact O-OG 3.07Å; L30-S33 PolarHBondContact O-N 3.24Å; S33-S36 WeakPolarHBondContact O-CB 3.23Å; S33-S36 PolarHBondContact O-N 3.41Å; S33-V37 WeakPolarHBondContact O-CG2 3.26Å; S33-V37 PolarHBondContact O-N 2.87Å; S33-V37 VanDerWaalsContact O-N 3.09Å |
| 34 | V | 71 | Confident | 73.7 | Confident | 46 Ų | 46 | 61 Ų | 61 | 28% | 0.279 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -63.3 | -46.1 | 176.9 | 174.3 | 0 | 0 | 0 | 0 | 110.5 | L30 I31 S36 V37 I38 W461 | L30-V34 HydrophobicContact CD2-CG2 4.25Å; L30-V34 WeakPolarHBondContact O-CG2 3.34Å; L30-V34 PolarHBondContact O-N 3.37Å; I31-V34 PolarHBondContact O-N 3.5Å; V34-S36 VanDerWaalsContact C-N 3.32Å; V34-S36 PolarHBondContact O-N 2.98Å; V34-V37 PolarHBondContact O-N 3.09Å; V34-I38 HydrophobicContact CG1-CD1 4.09Å; V34-I38 WeakPolarHBondContact O-CG1 3.43Å; V34-I38 PolarHBondContact O-N 3.44Å; V34-I38 VanDerWaalsContact O-N 3.16Å; V34-W461 HydrophobicContact CB-CH2 4.46Å; V34-W461 HydrophobicContact CG1-CH2 4.42Å; V34-W461 HydrophobicContact CG2-CE3 4.49Å; V34-W461 HydrophobicContact CG2-CH2 3.81Å; V34-W461 HydrophobicContact CG2-CZ3 3.54Å |
| 35 | L | 81.2 | Confident | 75.1 | Confident | 90 Ų | 90 | 63 Ų | 63 | 47% | 0.471 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -60.5 | -42.9 | 176.3 | -74 | 169.4 | 0 | 0 | 0 | 111.2 | I31 L32 V37 I38 V39 | I31-L35 HydrophobicContact CG2-CD1 3.85Å; I31-L35 HydrophobicContact CG2-CG 4.45Å; I31-L35 WeakPolarHBondContact O-CB 3.3Å; I31-L35 VanDerWaalsContact O-CG 3.32Å; I31-L35 WeakPolarHBondContact O-CG 3.4Å; I31-L35 PolarHBondContact O-N 3.28Å; L32-L35 PolarHBondContact O-N 3.14Å; L35-V37 VanDerWaalsContact C-N 3.3Å; L35-V37 PolarHBondContact O-N 3.26Å; L35-I38 PolarHBondContact O-N 3.01Å; L35-V39 WeakPolarHBondContact O-CB 3.14Å; L35-V39 VanDerWaalsContact O-CG2 3.24Å; L35-V39 WeakPolarHBondContact O-CG2 3.38Å; L35-V39 PolarHBondContact O-N 3.46Å |
| 36 | S | 80.8 | Confident | 76.5 | Confident | 11 Ų | 11 | 60.5 Ų | 60.5 | 8% | 0.077 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -59.1 | -38.4 | 177 | -74.1 | 0 | 0 | 0 | 0 | 113.4 | L32 S33 V34 G40 P278 V282 | L32-S36 WeakPolarHBondContact O-CB 3.39Å; L32-S36 PolarHBondContact O-N 3.43Å; L32-S36 PolarHBondContact O-OG 2.86Å; S33-S36 WeakPolarHBondContact O-CB 3.23Å; S33-S36 PolarHBondContact O-N 3.41Å; V34-S36 VanDerWaalsContact C-N 3.32Å; V34-S36 PolarHBondContact O-N 2.98Å; S36-G40 PolarHBondContact O-N 3.5Å; S36-P278 WeakPolarHBondContact CB-O 3.18Å; S36-P278 VanDerWaalsContact OG-C 3.22Å; S36-P278 WeakPolarHBondContact OG-CA 3.48Å; S36-P278 WeakPolarHBondContact OG-CB 3.41Å; S36-P278 PolarHBondContact OG-O 3.01Å; S36-V282 WeakPolarHBondContact O-CG2 3.48Å |
| 37 | V | 74 | Confident | 78.3 | Confident | 15 Ų | 15 | 54.1 Ų | 54.1 | 9% | 0.091 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -66.5 | -47.1 | 175.8 | 172.1 | 0 | 0 | 0 | 0 | 110.7 | S33 V34 L35 V39 G40 C41 I281 I285 W461 | S33-V37 WeakPolarHBondContact O-CG2 3.26Å; S33-V37 PolarHBondContact O-N 2.87Å; S33-V37 VanDerWaalsContact O-N 3.09Å; V34-V37 PolarHBondContact O-N 3.09Å; L35-V37 VanDerWaalsContact C-N 3.3Å; L35-V37 PolarHBondContact O-N 3.26Å; V37-V39 PolarHBondContact O-N 3.46Å; V37-G40 PolarHBondContact O-N 3.15Å; V37-C41 WeakPolarHBondContact O-CB 3.23Å; V37-C41 PolarHBondContact O-N 3.48Å; V37-C41 PolarHBondContact O-SG 3.47Å; V37-C41 VanDerWaalsContact O-SG 3.37Å; V37-I281 HydrophobicContact CG2-CG2 3.8Å; V37-I285 HydrophobicContact CB-CD1 4.15Å; V37-I285 HydrophobicContact CG1-CD1 3.96Å; V37-I285 HydrophobicContact CG2-CD1 3.86Å; V37-W461 HydrophobicContact CB-CZ2 4.36Å; V37-W461 HydrophobicContact CG1-CZ2 4.17Å; V37-W461 HydrophobicContact CG2-CD2 3.88Å; V37-W461 HydrophobicContact CG2-CG 3.83Å; V37-W461 HydrophobicContact CG2-CZ2 4.25Å |
| 38 | I | 82.3 | Confident | 79.4 | Confident | 88 Ų | 88 | 54.7 Ų | 54.7 | 45% | 0.451 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -60.8 | -48.1 | 178.8 | -64.4 | 167.6 | 0 | 0 | 0 | 110 | V34 L35 C41 L42 | V34-I38 HydrophobicContact CG1-CD1 4.09Å; V34-I38 WeakPolarHBondContact O-CG1 3.43Å; V34-I38 PolarHBondContact O-N 3.44Å; V34-I38 VanDerWaalsContact O-N 3.16Å; L35-I38 PolarHBondContact O-N 3.01Å; I38-C41 PolarHBondContact O-N 3.29Å; I38-L42 HydrophobicContact CG2-CD1 3.96Å; I38-L42 HydrophobicContact CG2-CG 4.48Å; I38-L42 WeakPolarHBondContact O-CB 3.42Å; I38-L42 VanDerWaalsContact O-CG 3.29Å; I38-L42 WeakPolarHBondContact O-CG 3.35Å; I38-L42 PolarHBondContact O-N 3.33Å |
| 39 | V | 89.9 | Confident | 80.4 | Confident | 74 Ų | 74 | 58.2 Ų | 58.2 | 45% | 0.448 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -62.6 | -44.2 | 177.9 | 172.5 | 0 | 0 | 0 | 0 | 110.9 | L35 V37 C41 L42 L43 V282 | L35-V39 WeakPolarHBondContact O-CB 3.14Å; L35-V39 VanDerWaalsContact O-CG2 3.24Å; L35-V39 WeakPolarHBondContact O-CG2 3.38Å; L35-V39 PolarHBondContact O-N 3.46Å; V37-V39 PolarHBondContact O-N 3.46Å; V39-C41 PolarHBondContact O-N 2.95Å; V39-L42 PolarHBondContact O-N 3.12Å; V39-L43 WeakPolarHBondContact O-CB 3.48Å; V39-L43 PolarHBondContact O-N 2.82Å; V39-V282 HydrophobicContact CG1-CG1 4.08Å; V39-V282 HydrophobicContact CG1-CG2 4.46Å |
| 40 | G | 86.9 | Confident | 81.6 | Confident | 0 Ų | 0 | 60.5 Ų | 60.5 | 0% | 0 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -60.7 | -43.8 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | S36 V37 G44 V282 A286 | S36-G40 PolarHBondContact O-N 3.5Å; V37-G40 PolarHBondContact O-N 3.15Å; G40-G44 PolarHBondContact O-N 3.15Å; G40-V282 WeakPolarHBondContact CA-O 3.1Å; G40-A286 WeakPolarHBondContact O-CA 3.4Å; G40-A286 VanDerWaalsContact O-CB 3.31Å; G40-A286 WeakPolarHBondContact O-CB 3.47Å |
| 41 | C | 83.7 | Confident | 82.8 | Confident | 44 Ų | 44 | 69.5 Ų | 69.5 | 30% | 0.297 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -61.4 | -51.3 | 174.4 | -74.3 | 0 | 0 | 0 | 0 | 111.8 | V37 I38 V39 L43 G44 F45 I289 | V37-C41 WeakPolarHBondContact O-CB 3.23Å; V37-C41 PolarHBondContact O-N 3.48Å; V37-C41 PolarHBondContact O-SG 3.47Å; V37-C41 VanDerWaalsContact O-SG 3.37Å; I38-C41 PolarHBondContact O-N 3.29Å; V39-C41 PolarHBondContact O-N 2.95Å; C41-L43 VanDerWaalsContact C-N 3.35Å; C41-L43 PolarHBondContact O-N 3.17Å; C41-G44 PolarHBondContact O-N 3.29Å; C41-F45 WeakPolarHBondContact O-CD2 3.46Å; C41-F45 PolarHBondContact O-N 2.92Å; C41-I289 HydrophobicContact CB-CD1 4.42Å |
| 42 | L | 89.6 | Confident | 83.6 | Confident | 119 Ų | 119 | 69.7 Ų | 69.7 | 62% | 0.623 | 34% | 0.344 | S | S | * | . | H | α-helix | trans | -60.5 | -44.7 | 180 | -69.8 | 173.6 | 0 | 0 | 0 | 111.7 | I38 V39 F46 | I38-L42 HydrophobicContact CG2-CD1 3.96Å; I38-L42 HydrophobicContact CG2-CG 4.48Å; I38-L42 WeakPolarHBondContact O-CB 3.42Å; I38-L42 VanDerWaalsContact O-CG 3.29Å; I38-L42 WeakPolarHBondContact O-CG 3.35Å; I38-L42 PolarHBondContact O-N 3.33Å; V39-L42 PolarHBondContact O-N 3.12Å; L42-F46 VanDerWaalsContact O-CB 3.29Å; L42-F46 WeakPolarHBondContact O-CB 3.22Å; L42-F46 PolarHBondContact O-N 2.98Å |
| 43 | L | 91.7 | Very high | 84.3 | Confident | 53 Ų | 53 | 68 Ų | 68 | 28% | 0.277 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -65.6 | -42.3 | 178.7 | -175.4 | 60.9 | 0 | 0 | 0 | 111.5 | V39 C41 F46 L47 F60 V282 A286 | V39-L43 WeakPolarHBondContact O-CB 3.48Å; V39-L43 PolarHBondContact O-N 2.82Å; C41-L43 VanDerWaalsContact C-N 3.35Å; C41-L43 PolarHBondContact O-N 3.17Å; L43-F46 PolarHBondContact O-N 3.34Å; L43-L47 HydrophobicContact CD1-CD1 3.96Å; L43-L47 HydrophobicContact CD1-CG 4.02Å; L43-L47 HydrophobicContact CG-CD1 3.85Å; L43-L47 HydrophobicContact CG-CG 4.31Å; L43-L47 WeakPolarHBondContact O-CB 3.42Å; L43-L47 VanDerWaalsContact O-CG 3.29Å; L43-L47 WeakPolarHBondContact O-CG 3.42Å; L43-L47 PolarHBondContact O-N 2.93Å; L43-F60 HydrophobicContact CD2-CE2 4.14Å; L43-F60 HydrophobicContact CD2-CZ 3.72Å; L43-F60 HydrophobicContact CG-CZ 4.12Å; L43-V282 HydrophobicContact CD2-CG1 4.1Å; L43-A286 HydrophobicContact CB-CB 4.34Å; L43-A286 HydrophobicContact CD2-CB 4.48Å; L43-A286 HydrophobicContact CG-CB 4.39Å |
| 44 | G | 87.7 | Confident | 85.3 | Confident | 0 Ų | 0 | 73.1 Ų | 73.1 | 0% | 0 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -61 | -47.5 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | G40 C41 F46 L47 R48 | G40-G44 PolarHBondContact O-N 3.15Å; C41-G44 PolarHBondContact O-N 3.29Å; G44-F46 VanDerWaalsContact C-N 3.34Å; G44-F46 PolarHBondContact O-N 3.4Å; G44-L47 PolarHBondContact O-N 3.42Å; G44-R48 WeakPolarHBondContact O-CB 3.49Å; G44-R48 PolarHBondContact O-N 2.83Å |
| 45 | F | 87.9 | Confident | 86.2 | Confident | 110 Ų | 110 | 77.7 Ų | 77.7 | 48% | 0.482 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -65 | -37.7 | 176.4 | -78.5 | -64.9 | 0 | 0 | 0 | 112.6 | C41 I289 P295 | C41-F45 WeakPolarHBondContact O-CD2 3.46Å; C41-F45 PolarHBondContact O-N 2.92Å; F45-I289 HydrophobicContact CD1-CG2 4.23Å; F45-I289 HydrophobicContact CD2-CD1 4.48Å; F45-I289 HydrophobicContact CE1-CG2 4.35Å; F45-I289 HydrophobicContact CE2-CD1 4.31Å; F45-I289 HydrophobicContact CG-CG2 4.43Å; F45-P295 HydrophobicContact CE1-CB 3.68Å; F45-P295 HydrophobicContact CE1-CG 4.29Å; F45-P295 HydrophobicContact CZ-CB 4.21Å |
| 46 | F | 90.8 | Very high | 86.6 | Confident | 123 Ų | 123 | 78 Ų | 78 | 54% | 0.539 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -65.8 | -49.3 | 175.9 | 176.2 | -101.5 | 0 | 0 | 0 | 112.1 | L42 L43 G44 R48 T49 | L42-F46 VanDerWaalsContact O-CB 3.29Å; L42-F46 WeakPolarHBondContact O-CB 3.22Å; L42-F46 PolarHBondContact O-N 2.98Å; L43-F46 PolarHBondContact O-N 3.34Å; G44-F46 VanDerWaalsContact C-N 3.34Å; G44-F46 PolarHBondContact O-N 3.4Å; F46-R48 PolarHBondContact O-N 2.97Å; F46-T49 PolarHBondContact O-N 2.96Å; F46-T49 VanDerWaalsContact O-N 3.11Å; F46-T49 PolarHBondContact O-OG1 2.77Å |
| 47 | L | 90.1 | Very high | 86.9 | Confident | 27 Ų | 27 | 78.7 Ų | 78.7 | 14% | 0.141 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -65.2 | -28.1 | -180 | -71.3 | 174.8 | 0 | 0 | 0 | 112.2 | L43 G44 T49 Q50 L52 F60 L290 | L43-L47 HydrophobicContact CD1-CD1 3.96Å; L43-L47 HydrophobicContact CD1-CG 4.02Å; L43-L47 HydrophobicContact CG-CD1 3.85Å; L43-L47 HydrophobicContact CG-CG 4.31Å; L43-L47 WeakPolarHBondContact O-CB 3.42Å; L43-L47 VanDerWaalsContact O-CG 3.29Å; L43-L47 WeakPolarHBondContact O-CG 3.42Å; L43-L47 PolarHBondContact O-N 2.93Å; G44-L47 PolarHBondContact O-N 3.42Å; L47-T49 PolarHBondContact O-N 3.07Å; L47-Q50 WeakPolarHBondContact O-CB 3.13Å; L47-Q50 PolarHBondContact O-N 3.43Å; L47-L52 HydrophobicContact CB-CD1 3.97Å; L47-L52 HydrophobicContact CD2-CD1 4.32Å; L47-F60 HydrophobicContact CD1-CD1 4.31Å; L47-F60 HydrophobicContact CD1-CD2 4.02Å; L47-F60 HydrophobicContact CD1-CE1 3.76Å; L47-F60 HydrophobicContact CD1-CE2 3.44Å; L47-F60 VanDerWaalsContact CD1-CE2 3.44Å; L47-F60 HydrophobicContact CD1-CG 4.42Å; L47-F60 HydrophobicContact CD1-CZ 3.3Å; L47-L290 HydrophobicContact CB-CD1 4.08Å; L47-L290 HydrophobicContact CB-CD2 3.74Å; L47-L290 HydrophobicContact CB-CG 4.39Å; L47-L290 HydrophobicContact CD1-CD1 4.25Å |
| 48 | R | 83.8 | Confident | 87.4 | Confident | 73 Ų | 73 | 81 Ų | 81 | 28% | 0.275 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -61 | -32.4 | 174.8 | -167.9 | -176.1 | -176.2 | 81.9 | 7.6 | 112.4 | G44 F46 Q50 R51 I289 L290 M292 D293 P295 | G44-R48 WeakPolarHBondContact O-CB 3.49Å; G44-R48 PolarHBondContact O-N 2.83Å; F46-R48 PolarHBondContact O-N 2.97Å; R48-Q50 PolarHBondContact O-N 3.01Å; R48-R51 PolarHBondContact O-N 3.25Å; R48-I289 PolarHBondContact NH1-O 3.29Å; R48-L290 HydrophobicContact CB-CD2 4.02Å; R48-L290 VanDerWaalsContact N-CD2 3.3Å; R48-M292 PolarHBondContact NH1-O 3.37Å; R48-M292 PolarHBondContact NH2-O 3.5Å; R48-D293 VanDerWaalsContact NH2-C 3.34Å; R48-D293 PolarHBondContact NH2-O 2.89Å; R48-P295 VanDerWaalsContact CZ-CG 3.45Å |
| 49 | T | 86.9 | Confident | 87.9 | Confident | 100 Ų | 100 | 85.3 Ų | 85.3 | 61% | 0.613 | 42% | 0.421 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.3 | -17.2 | 177.3 | 71.9 | 0 | 0 | 0 | 0 | 112.6 | F46 L47 | F46-T49 PolarHBondContact O-N 2.96Å; F46-T49 VanDerWaalsContact O-N 3.11Å; F46-T49 PolarHBondContact O-OG1 2.77Å; L47-T49 PolarHBondContact O-N 3.07Å |
| 50 | Q | 87.3 | Confident | 87.9 | Confident | 115 Ų | 115 | 84 Ų | 84 | 54% | 0.537 | 41% | 0.41 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -90 | -4.5 | -176.8 | -55.7 | -61 | -26.4 | 0 | 0 | 113.9 | L47 R48 L52 | L47-Q50 WeakPolarHBondContact O-CB 3.13Å; L47-Q50 PolarHBondContact O-N 3.43Å; R48-Q50 PolarHBondContact O-N 3.01Å; Q50-L52 PolarHBondContact O-N 3.29Å |
| 51 | R | 83.1 | Confident | 87.7 | Confident | 236 Ų | 236 | 85.3 Ų | 85.3 | 89% | 0.891 | 42% | 0.416 | S | S | * | . | trans | 45.2 | 58 | -179.9 | -65.4 | -166 | 176.4 | -162.1 | -0.5 | 113.8 | R48 | R48-R51 PolarHBondContact O-N 3.25Š| ||
| 52 | L | 85.7 | Confident | 88 | Confident | 53 Ų | 53 | 88.8 Ų | 88.8 | 28% | 0.277 | 43% | 0.426 | S | S | . | . | trans | -59.6 | 150.1 | 176.2 | -68.7 | 154.4 | 0 | 0 | 0 | 112.3 | L47 Q50 E56 I57 L290 | L47-L52 HydrophobicContact CB-CD1 3.97Å; L47-L52 HydrophobicContact CD2-CD1 4.32Å; Q50-L52 PolarHBondContact O-N 3.29Å; L52-E56 HydrophobicContact CB-CB 4.38Å; L52-E56 HydrophobicContact CD2-CB 4.07Å; L52-I57 HydrophobicContact CB-CD1 4.45Å; L52-I57 HydrophobicContact CB-CG1 3.93Å; L52-L290 HydrophobicContact CD1-CD1 4Å; L52-L290 HydrophobicContact CD1-CD2 4.33Å | ||
| 53 | S | 90.1 | Very high | 87.9 | Confident | 45 Ų | 45 | 84.2 Ų | 84.2 | 32% | 0.315 | 40% | 0.403 | S | S | . | . | trans | -72.7 | 158.1 | 172.4 | 69.5 | 0 | 0 | 0 | 0 | 111.9 | Q55 E56 I57 | S53-Q55 VanDerWaalsContact C-N 3.25Å; S53-Q55 PolarHBondContact O-N 3.42Å; S53-E56 VanDerWaalsContact CB-OE2 3.3Å; S53-E56 WeakPolarHBondContact CB-OE2 3.36Å; S53-E56 PolarHBondContact N-OE2 3.34Å; S53-E56 PolarHBondContact O-N 3.05Å; S53-E56 VanDerWaalsContact O-N 3.15Å; S53-E56 VanDerWaalsContact OG-CG 3.25Å; S53-E56 WeakPolarHBondContact OG-CG 3.43Å; S53-E56 PolarHBondContact OG-N 2.84Å; S53-E56 PolarHBondContact OG-OE2 2.93Å; S53-I57 WeakPolarHBondContact O-CG1 3.2Å; S53-I57 PolarHBondContact O-N 3.39Å | ||
| 54 | P | 86.4 | Confident | 87 | Confident | 113 Ų | 113 | 81.8 Ų | 81.8 | 73% | 0.734 | 39% | 0.391 | S | S | * | . | H | α-helix | trans | -58 | -34 | 178.9 | -26.1 | 35 | 0 | 0 | 0 | 114.3 | S58 | P54-S58 PolarHBondContact O-N 3.2Å; P54-S58 VanDerWaalsContact O-N 3.1Å |
| 55 | Q | 89.5 | Confident | 86.4 | Confident | 142 Ų | 142 | 85.4 Ų | 85.4 | 66% | 0.664 | 41% | 0.408 | S | S | * | . | H | α-helix | trans | -68.6 | -42 | 177.3 | -71.5 | -178.7 | -9.2 | 0 | 0 | 111.7 | S53 I57 S58 Y59 | S53-Q55 VanDerWaalsContact C-N 3.25Å; S53-Q55 PolarHBondContact O-N 3.42Å; Q55-I57 VanDerWaalsContact C-N 3.34Å; Q55-I57 PolarHBondContact O-N 2.87Å; Q55-S58 WeakPolarHBondContact O-CB 3.41Å; Q55-S58 PolarHBondContact O-N 2.81Å; Q55-Y59 PolarHBondContact O-N 2.79Å |
| 56 | E | 90.1 | Very high | 86 | Confident | 96 Ų | 96 | 83.2 Ų | 83.2 | 45% | 0.449 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -65.9 | -37.8 | 177.1 | -68.6 | 164.1 | 138.3 | 0 | 0 | 111.7 | L52 S53 S58 Y59 F60 | L52-E56 HydrophobicContact CB-CB 4.38Å; L52-E56 HydrophobicContact CD2-CB 4.07Å; S53-E56 VanDerWaalsContact CB-OE2 3.3Å; S53-E56 WeakPolarHBondContact CB-OE2 3.36Å; S53-E56 PolarHBondContact N-OE2 3.34Å; S53-E56 PolarHBondContact O-N 3.05Å; S53-E56 VanDerWaalsContact O-N 3.15Å; S53-E56 VanDerWaalsContact OG-CG 3.25Å; S53-E56 WeakPolarHBondContact OG-CG 3.43Å; S53-E56 PolarHBondContact OG-N 2.84Å; S53-E56 PolarHBondContact OG-OE2 2.93Å; E56-S58 VanDerWaalsContact C-N 3.33Å; E56-S58 PolarHBondContact O-N 3.49Å; E56-Y59 PolarHBondContact O-N 3.43Å; E56-F60 VanDerWaalsContact O-CB 3.29Å; E56-F60 WeakPolarHBondContact O-CB 3.33Å; E56-F60 PolarHBondContact O-N 2.83Å |
| 57 | I | 86.8 | Confident | 85.1 | Confident | 27 Ų | 27 | 77.6 Ų | 77.6 | 14% | 0.138 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -61.1 | -44 | 174 | -65.2 | 169 | 0 | 0 | 0 | 110.3 | L52 S53 Q55 F60 Q61 L290 E291 | L52-I57 HydrophobicContact CB-CD1 4.45Å; L52-I57 HydrophobicContact CB-CG1 3.93Å; S53-I57 WeakPolarHBondContact O-CG1 3.2Å; S53-I57 PolarHBondContact O-N 3.39Å; Q55-I57 VanDerWaalsContact C-N 3.34Å; Q55-I57 PolarHBondContact O-N 2.87Å; I57-F60 PolarHBondContact O-N 2.91Å; I57-Q61 HydrophobicContact CG2-CG 4.46Å; I57-Q61 WeakPolarHBondContact O-CB 3.41Å; I57-Q61 WeakPolarHBondContact O-CG 3.39Å; I57-Q61 PolarHBondContact O-N 2.89Å; I57-L290 HydrophobicContact CD1-CB 4.26Å; I57-L290 HydrophobicContact CG1-CB 4.28Å; I57-L290 HydrophobicContact CG1-CD1 4.4Å; I57-L290 HydrophobicContact CG2-CB 4.2Å; I57-E291 HydrophobicContact CG2-CG 4.25Å |
| 58 | S | 84.7 | Confident | 83.9 | Confident | 64 Ų | 64 | 77.7 Ų | 77.7 | 45% | 0.448 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -61.5 | -44.9 | 177.1 | -179.4 | 0 | 0 | 0 | 0 | 112.2 | P54 Q55 E56 F60 Q61 F62 | P54-S58 PolarHBondContact O-N 3.2Å; P54-S58 VanDerWaalsContact O-N 3.1Å; Q55-S58 WeakPolarHBondContact O-CB 3.41Å; Q55-S58 PolarHBondContact O-N 2.81Å; E56-S58 VanDerWaalsContact C-N 3.33Å; E56-S58 PolarHBondContact O-N 3.49Å; S58-F60 PolarHBondContact O-N 3.47Å; S58-Q61 PolarHBondContact O-N 3.42Å; S58-F62 PolarHBondContact O-N 2.89Å |
| 59 | Y | 92.3 | Very high | 83.4 | Confident | 178 Ų | 178 | 81.7 Ų | 81.7 | 70% | 0.698 | 39% | 0.392 | S | S | * | . | H | α-helix | trans | -65.8 | -38.6 | 176.5 | -64.6 | -22 | 0 | 0 | 0 | 112.9 | Q55 E56 Q61 F62 | Q55-Y59 PolarHBondContact O-N 2.79Å; E56-Y59 PolarHBondContact O-N 3.43Å; Y59-Q61 VanDerWaalsContact C-N 3.32Å; Y59-Q61 PolarHBondContact O-N 3.09Å; Y59-F62 WeakPolarHBondContact O-CB 3.29Å; Y59-F62 PolarHBondContact O-N 3.2Å |
| 60 | F | 90.2 | Very high | 82.6 | Confident | 46 Ų | 46 | 79.5 Ų | 79.5 | 20% | 0.202 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -64.9 | -36.3 | 176.8 | 177.5 | -97.6 | 0 | 0 | 0 | 112.3 | L43 L47 E56 I57 S58 F62 P63 F283 A286 L290 | L43-F60 HydrophobicContact CD2-CE2 4.14Å; L43-F60 HydrophobicContact CD2-CZ 3.72Å; L43-F60 HydrophobicContact CG-CZ 4.12Å; L47-F60 HydrophobicContact CD1-CD1 4.31Å; L47-F60 HydrophobicContact CD1-CD2 4.02Å; L47-F60 HydrophobicContact CD1-CE1 3.76Å; L47-F60 HydrophobicContact CD1-CE2 3.44Å; L47-F60 VanDerWaalsContact CD1-CE2 3.44Å; L47-F60 HydrophobicContact CD1-CG 4.42Å; L47-F60 HydrophobicContact CD1-CZ 3.3Å; E56-F60 VanDerWaalsContact O-CB 3.29Å; E56-F60 WeakPolarHBondContact O-CB 3.33Å; E56-F60 PolarHBondContact O-N 2.83Å; I57-F60 PolarHBondContact O-N 2.91Å; S58-F60 PolarHBondContact O-N 3.47Å; F60-F62 VanDerWaalsContact C-N 3.31Å; F60-F62 PolarHBondContact O-N 2.69Å; F60-P63 WeakPolarHBondContact O-CD 3.19Å; F60-F283 HydrophobicContact CD2-CD1 4.26Å; F60-F283 HydrophobicContact CD2-CE1 4.45Å; F60-F283 HydrophobicContact CE1-CD1 4.3Å; F60-F283 AromaticContact CE2-CD1 3.82Å; F60-F283 HydrophobicContact CE2-CD1 3.82Å; F60-F283 AromaticContact CE2-CE1 3.91Å; F60-F283 HydrophobicContact CE2-CE1 3.91Å; F60-F283 AromaticContact CZ-CD1 3.83Å; F60-F283 HydrophobicContact CZ-CD1 3.83Å; F60-F283 HydrophobicContact CZ-CE1 4.28Å; F60-F283 WeakPolarHBondContact O-CD1 3.48Å; F60-A286 HydrophobicContact CE1-CB 3.59Å; F60-A286 HydrophobicContact CZ-CB 3.83Å; F60-L290 HydrophobicContact CD1-CD1 3.97Å; F60-L290 HydrophobicContact CE1-CD1 4.2Å |
| 61 | Q | 83.6 | Confident | 81.3 | Confident | 28 Ų | 28 | 75.7 Ų | 75.7 | 13% | 0.131 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -74.1 | -16.1 | 179.5 | -81.1 | -179.7 | 13.5 | 0 | 0 | 115 | I57 S58 Y59 P63 G64 E65 G287 E291 | I57-Q61 HydrophobicContact CG2-CG 4.46Å; I57-Q61 WeakPolarHBondContact O-CB 3.41Å; I57-Q61 WeakPolarHBondContact O-CG 3.39Å; I57-Q61 PolarHBondContact O-N 2.89Å; S58-Q61 PolarHBondContact O-N 3.42Å; Y59-Q61 VanDerWaalsContact C-N 3.32Å; Y59-Q61 PolarHBondContact O-N 3.09Å; Q61-P63 VanDerWaalsContact C-CD 3.46Å; Q61-P63 VanDerWaalsContact O-N 3.17Å; Q61-G64 WeakPolarHBondContact O-CA 3.49Å; Q61-G64 PolarHBondContact O-N 2.93Å; Q61-E65 PolarHBondContact O-N 3.01Å; Q61-G287 VanDerWaalsContact CG-CA 3.49Å; Q61-G287 PolarHBondContact NE2-O 3.13Å; Q61-E291 PolarHBondContact NE2-OE1 3.3Å; Q61-E291 PolarHBondContact OE1-OE1 2.97Å; Q61-E291 VanDerWaalsContact OE1-OE1 3.09Å |
| 62 | F | 89.1 | Confident | 80.3 | Confident | 116 Ų | 116 | 70.1 Ų | 70.1 | 51% | 0.509 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -50.4 | -42.3 | -171.3 | 179.3 | -103.6 | 0 | 0 | 0 | 115 | S58 Y59 F60 G64 E65 L66 | S58-F62 PolarHBondContact O-N 2.89Å; Y59-F62 WeakPolarHBondContact O-CB 3.29Å; Y59-F62 PolarHBondContact O-N 3.2Å; F60-F62 VanDerWaalsContact C-N 3.31Å; F60-F62 PolarHBondContact O-N 2.69Å; F62-G64 VanDerWaalsContact C-N 3.3Å; F62-G64 PolarHBondContact O-N 3.32Å; F62-E65 WeakPolarHBondContact O-CB 3.41Å; F62-E65 PolarHBondContact O-N 3.33Å; F62-L66 PolarHBondContact O-N 3.19Å |
| 63 | P | 87.8 | Confident | 79.9 | Confident | 23 Ų | 23 | 73.6 Ų | 73.6 | 15% | 0.149 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -62.3 | -35.5 | 175.4 | -23.7 | 35.6 | 0 | 0 | 0 | 113.8 | F60 Q61 L67 Y276 F279 F283 | F60-P63 WeakPolarHBondContact O-CD 3.19Å; Q61-P63 VanDerWaalsContact C-CD 3.46Å; Q61-P63 VanDerWaalsContact O-N 3.17Å; P63-L67 PolarHBondContact O-N 3.39Å; P63-Y276 WeakPolarHBondContact CA-OH 3.05Å; P63-Y276 PolarHBondContact O-OH 3Å; P63-Y276 VanDerWaalsContact O-OH 3.07Å; P63-F279 HydrophobicContact CB-CD1 4.41Å; P63-F279 HydrophobicContact CB-CE1 3.81Å; P63-F279 HydrophobicContact CG-CE1 4.39Å; P63-F283 HydrophobicContact CB-CB 4.08Å; P63-F283 HydrophobicContact CB-CD2 3.65Å; P63-F283 HydrophobicContact CB-CE2 4.26Å; P63-F283 HydrophobicContact CB-CG 3.84Å; P63-F283 HydrophobicContact CG-CB 4.35Å; P63-F283 HydrophobicContact CG-CD1 4.1Å; P63-F283 HydrophobicContact CG-CD2 3.97Å; P63-F283 HydrophobicContact CG-CE1 4.41Å; P63-F283 HydrophobicContact CG-CE2 4.31Å; P63-F283 HydrophobicContact CG-CG 3.86Å |
| 64 | G | 73.5 | Confident | 79 | Confident | 2 Ų | 2 | 72 Ų | 72 | 2% | 0.021 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -69 | -39.2 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | Q61 F62 L67 M68 G280 | Q61-G64 WeakPolarHBondContact O-CA 3.49Å; Q61-G64 PolarHBondContact O-N 2.93Å; F62-G64 VanDerWaalsContact C-N 3.3Å; F62-G64 PolarHBondContact O-N 3.32Å; G64-L67 WeakPolarHBondContact O-CB 3.26Å; G64-L67 PolarHBondContact O-N 3.4Å; G64-M68 PolarHBondContact O-N 2.96Å; G64-G280 WeakPolarHBondContact CA-O 3.49Å |
| 65 | E | 74.9 | Confident | 78.1 | Confident | 76 Ų | 76 | 67.2 Ų | 67.2 | 36% | 0.355 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -63 | -42.2 | 174 | -166.2 | -165.2 | 151.5 | 0 | 0 | 111.7 | Q61 F62 L67 M68 R69 | Q61-E65 PolarHBondContact O-N 3.01Å; F62-E65 WeakPolarHBondContact O-CB 3.41Å; F62-E65 PolarHBondContact O-N 3.33Å; E65-L67 VanDerWaalsContact C-N 3.31Å; E65-L67 PolarHBondContact O-N 3.39Å; E65-M68 WeakPolarHBondContact O-CB 3.28Å; E65-M68 PolarHBondContact O-N 3.25Å; E65-M68 VanDerWaalsContact O-N 3.11Å; E65-R69 WeakPolarHBondContact O-CG 3.39Å; E65-R69 PolarHBondContact O-N 3.08Å; E65-R69 IonicContact OE1-CZ 3.18Å; E65-R69 IonicContact OE1-NE 3.8Å; E65-R69 PolarHBondContact OE1-NE 3.29Å; E65-R69 IonicContact OE1-NH2 3.74Å; E65-R69 PolarHBondContact OE1-NH2 3.14Å |
| 66 | L | 80.3 | Confident | 77.6 | Confident | 65 Ų | 65 | 63.1 Ų | 63.1 | 34% | 0.34 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -60 | -42 | 177.7 | -173.7 | 64 | 0 | 0 | 0 | 111.4 | F62 M68 R69 M70 | F62-L66 PolarHBondContact O-N 3.19Å; L66-M68 VanDerWaalsContact C-N 3.32Å; L66-M68 PolarHBondContact O-N 3Å; L66-R69 PolarHBondContact O-N 3.47Å; L66-M70 HydrophobicContact CG-SD 4.38Å; L66-M70 WeakPolarHBondContact O-CG 3.22Å; L66-M70 PolarHBondContact O-N 3.37Å |
| 67 | L | 71.3 | Confident | 77.2 | Confident | 4 Ų | 4 | 60.5 Ų | 60.5 | 2% | 0.021 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -56 | -47.9 | 173.5 | 174.3 | 62.9 | 0 | 0 | 0 | 111 | P63 G64 E65 R69 M70 L71 Y276 F277 I281 | P63-L67 PolarHBondContact O-N 3.39Å; G64-L67 WeakPolarHBondContact O-CB 3.26Å; G64-L67 PolarHBondContact O-N 3.4Å; E65-L67 VanDerWaalsContact C-N 3.31Å; E65-L67 PolarHBondContact O-N 3.39Å; L67-R69 VanDerWaalsContact C-N 3.33Å; L67-R69 PolarHBondContact O-N 3.16Å; L67-M70 PolarHBondContact O-N 3.3Å; L67-L71 HydrophobicContact CD1-CD1 4.38Å; L67-L71 HydrophobicContact CD1-CG 4.36Å; L67-L71 HydrophobicContact CG-CD1 4.41Å; L67-L71 WeakPolarHBondContact O-CG 3.3Å; L67-L71 PolarHBondContact O-N 3.48Å; L67-Y276 HydrophobicContact CB-CD1 4.11Å; L67-Y276 HydrophobicContact CB-CE1 3.85Å; L67-Y276 HydrophobicContact CD1-CD1 4.02Å; L67-F277 HydrophobicContact CD1-CB 4.47Å; L67-F277 HydrophobicContact CD1-CD2 4.04Å; L67-F277 HydrophobicContact CD2-CD2 3.79Å; L67-F277 HydrophobicContact CD2-CE2 4.19Å; L67-F277 HydrophobicContact CG-CD2 4.49Å; L67-I281 HydrophobicContact CD2-CG1 4.44Å |
| 68 | M | 64.4 | Low | 76.4 | Confident | 29 Ų | 29 | 59.8 Ų | 59.8 | 14% | 0.143 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -63.2 | -38.1 | 179.4 | -66.1 | -55.4 | -69.8 | 0 | 0 | 112.6 | G64 E65 L66 L71 K72 L284 I457 | G64-M68 PolarHBondContact O-N 2.96Å; E65-M68 WeakPolarHBondContact O-CB 3.28Å; E65-M68 PolarHBondContact O-N 3.25Å; E65-M68 VanDerWaalsContact O-N 3.11Å; L66-M68 VanDerWaalsContact C-N 3.32Å; L66-M68 PolarHBondContact O-N 3Å; M68-L71 PolarHBondContact O-N 2.98Å; M68-K72 WeakPolarHBondContact O-CB 3.12Å; M68-K72 VanDerWaalsContact O-CG 3.29Å; M68-K72 WeakPolarHBondContact O-CG 3.42Å; M68-K72 PolarHBondContact O-N 3.17Å; M68-L284 HydrophobicContact CG-CD1 3.72Å; M68-L284 HydrophobicContact SD-CD1 3.78Å; M68-I457 HydrophobicContact CE-CD1 3.48Å; M68-I457 VanDerWaalsContact CE-CD1 3.48Å; M68-I457 HydrophobicContact SD-CD1 3.53Å; M68-I457 VanDerWaalsContact SD-CD1 3.53Å |
| 69 | R | 72.6 | Confident | 75.7 | Confident | 157 Ų | 157 | 56.9 Ų | 56.9 | 59% | 0.592 | 26% | 0.263 | S | S | * | . | H | α-helix | trans | -65.8 | -42.1 | 175.3 | -70 | 178.3 | 178.1 | -132.6 | 4.5 | 111.9 | E65 L66 L67 K72 M73 | E65-R69 WeakPolarHBondContact O-CG 3.39Å; E65-R69 PolarHBondContact O-N 3.08Å; E65-R69 IonicContact OE1-CZ 3.18Å; E65-R69 IonicContact OE1-NE 3.8Å; E65-R69 PolarHBondContact OE1-NE 3.29Å; E65-R69 IonicContact OE1-NH2 3.74Å; E65-R69 PolarHBondContact OE1-NH2 3.14Å; L66-R69 PolarHBondContact O-N 3.47Å; L67-R69 VanDerWaalsContact C-N 3.33Å; L67-R69 PolarHBondContact O-N 3.16Å; R69-K72 PolarHBondContact O-N 2.83Å; R69-M73 PolarHBondContact O-N 3.49Å |
| 70 | M | 70.1 | Confident | 75.3 | Confident | 54 Ų | 54 | 50.3 Ų | 50.3 | 27% | 0.266 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -60.3 | -45.5 | 175.9 | -70.6 | 172.3 | 67.4 | 0 | 0 | 111.5 | L66 L67 M73 L74 A273 Y276 | L66-M70 HydrophobicContact CG-SD 4.38Å; L66-M70 WeakPolarHBondContact O-CG 3.22Å; L66-M70 PolarHBondContact O-N 3.37Å; L67-M70 PolarHBondContact O-N 3.3Å; M70-M73 PolarHBondContact O-N 3.14Å; M70-L74 WeakPolarHBondContact O-CG 3.39Å; M70-A273 HydrophobicContact CE-CB 3.74Å; M70-Y276 HydrophobicContact SD-CD1 3.87Å; M70-Y276 HydrophobicContact SD-CE1 4.27Å; M70-Y276 HydrophobicContact SD-CG 4.35Å |
| 71 | L | 60.8 | Low | 74.9 | Confident | 36 Ų | 36 | 48.1 Ų | 48.1 | 19% | 0.188 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -64.5 | -43.3 | 177 | -64.7 | 178.3 | 0 | 0 | 0 | 111.7 | L67 M68 M73 L74 I75 V437 | L67-L71 HydrophobicContact CD1-CD1 4.38Å; L67-L71 HydrophobicContact CD1-CG 4.36Å; L67-L71 HydrophobicContact CG-CD1 4.41Å; L67-L71 WeakPolarHBondContact O-CG 3.3Å; L67-L71 PolarHBondContact O-N 3.48Å; M68-L71 PolarHBondContact O-N 2.98Å; L71-M73 VanDerWaalsContact C-N 3.31Å; L71-M73 PolarHBondContact O-N 3.25Å; L71-L74 PolarHBondContact O-N 3.45Å; L71-I75 WeakPolarHBondContact O-CG1 3.43Å; L71-V437 HydrophobicContact CB-CG2 4.5Å |
| 72 | K | 62.3 | Low | 74.4 | Confident | 118 Ų | 118 | 47.1 Ų | 47.1 | 51% | 0.513 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -61.8 | -35.4 | 178.2 | -77 | 177 | -178.6 | -179.6 | 0 | 113.6 | M68 R69 L74 I75 | M68-K72 WeakPolarHBondContact O-CB 3.12Å; M68-K72 VanDerWaalsContact O-CG 3.29Å; M68-K72 WeakPolarHBondContact O-CG 3.42Å; M68-K72 PolarHBondContact O-N 3.17Å; R69-K72 PolarHBondContact O-N 2.83Å; K72-L74 VanDerWaalsContact C-N 3.29Å; K72-L74 PolarHBondContact O-N 2.94Å; K72-I75 HydrophobicContact CB-CD1 4.24Å; K72-I75 HydrophobicContact CG-CD1 4.23Å; K72-I75 WeakPolarHBondContact O-CD1 3.44Å; K72-I75 VanDerWaalsContact O-CG1 3.24Å; K72-I75 WeakPolarHBondContact O-CG1 3.2Å; K72-I75 PolarHBondContact O-N 3.33Å |
| 73 | M | 78 | Confident | 73.7 | Confident | 126 Ų | 126 | 41.7 Ų | 41.7 | 62% | 0.621 | 20% | 0.204 | S | C | * | . | H | α-helix | trans | -64.5 | -33.6 | 177.6 | -178.1 | -172.2 | 71 | 0 | 0 | 112.5 | R69 M70 L71 I75 P77 | R69-M73 PolarHBondContact O-N 3.49Å; M70-M73 PolarHBondContact O-N 3.14Å; L71-M73 VanDerWaalsContact C-N 3.31Å; L71-M73 PolarHBondContact O-N 3.25Å; M73-I75 VanDerWaalsContact C-N 3.33Å; M73-P77 WeakPolarHBondContact O-CD 3.48Å |
| 74 | L | 70.4 | Confident | 73.5 | Confident | 11 Ų | 11 | 41.2 Ų | 41.2 | 6% | 0.058 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -80.2 | -15.9 | -174.6 | -62.7 | 170.1 | 0 | 0 | 0 | 113.2 | M70 L71 K72 P77 L78 V266 I269 V270 A273 | M70-L74 WeakPolarHBondContact O-CG 3.39Å; L71-L74 PolarHBondContact O-N 3.45Å; K72-L74 VanDerWaalsContact C-N 3.29Å; K72-L74 PolarHBondContact O-N 2.94Å; L74-P77 WeakPolarHBondContact O-CD 3.27Å; L74-L78 WeakPolarHBondContact O-CB 3.29Å; L74-L78 PolarHBondContact O-N 3.12Å; L74-V266 HydrophobicContact CD2-CG1 4.25Å; L74-I269 HydrophobicContact CD2-CB 4.13Å; L74-I269 HydrophobicContact CD2-CG2 3.64Å; L74-V270 HydrophobicContact CD1-CG2 3.78Å; L74-A273 HydrophobicContact CD1-CB 4.35Å |
| 75 | I | 67.4 | Low | 73.7 | Confident | 14 Ų | 14 | 41.6 Ų | 41.6 | 7% | 0.072 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -58.6 | -57.8 | -175.5 | -50.5 | 175.1 | 0 | 0 | 0 | 111.3 | L71 K72 M73 L78 V79 M229 V437 | L71-I75 WeakPolarHBondContact O-CG1 3.43Å; K72-I75 HydrophobicContact CB-CD1 4.24Å; K72-I75 HydrophobicContact CG-CD1 4.23Å; K72-I75 WeakPolarHBondContact O-CD1 3.44Å; K72-I75 VanDerWaalsContact O-CG1 3.24Å; K72-I75 WeakPolarHBondContact O-CG1 3.2Å; K72-I75 PolarHBondContact O-N 3.33Å; M73-I75 VanDerWaalsContact C-N 3.33Å; I75-L78 PolarHBondContact O-N 2.8Å; I75-V79 HydrophobicContact CG2-CG2 3.97Å; I75-V79 WeakPolarHBondContact O-CB 3.37Å; I75-V79 VanDerWaalsContact O-CG2 3.25Å; I75-V79 WeakPolarHBondContact O-CG2 3.22Å; I75-V79 PolarHBondContact O-N 3.05Å; I75-M229 HydrophobicContact CB-CE 3.79Å; I75-M229 HydrophobicContact CD1-CE 4.25Å; I75-M229 HydrophobicContact CG2-CE 3.44Å; I75-M229 VanDerWaalsContact CG2-CE 3.44Å; I75-V437 HydrophobicContact CB-CG1 3.92Å; I75-V437 HydrophobicContact CD1-CB 4.01Å; I75-V437 HydrophobicContact CD1-CG1 3.48Å; I75-V437 VanDerWaalsContact CD1-CG1 3.48Å; I75-V437 HydrophobicContact CD1-CG2 3.79Å; I75-V437 HydrophobicContact CG1-CB 4.01Å; I75-V437 HydrophobicContact CG1-CG1 3.29Å; I75-V437 HydrophobicContact CG1-CG2 3.66Å; I75-V437 HydrophobicContact CG2-CG1 3.5Å |
| 76 | L | 78.2 | Confident | 73.6 | Confident | 55 Ų | 55 | 38.9 Ų | 38.9 | 29% | 0.288 | 19% | 0.194 | S | C | . | . | H | α-helix | trans | -57.9 | -56 | -172.5 | 177.9 | 63.8 | 0 | 0 | 0 | 113.1 | L78 V80 T165 M229 I234 | L76-L78 VanDerWaalsContact C-N 3.27Å; L76-L78 PolarHBondContact O-N 3.09Å; L76-V80 HydrophobicContact CD1-CG2 4.07Å; L76-V80 WeakPolarHBondContact O-CG2 3.32Å; L76-V80 PolarHBondContact O-N 3.39Å; L76-V80 VanDerWaalsContact O-N 3.16Å; L76-T165 HydrophobicContact CD1-CG2 4.01Å; L76-T165 HydrophobicContact CD2-CG2 3.75Å; L76-M229 HydrophobicContact CB-SD 3.87Å; L76-M229 HydrophobicContact CD1-SD 3.97Å; L76-M229 HydrophobicContact CG-SD 4.4Å; L76-I234 HydrophobicContact CD1-CD1 3.59Å; L76-I234 HydrophobicContact CD1-CG1 4.46Å; L76-I234 HydrophobicContact CD1-CG2 4.14Å |
| 77 | P | 81.4 | Confident | 73.3 | Confident | 41 Ų | 41 | 36.7 Ų | 36.7 | 27% | 0.266 | 18% | 0.183 | S | C | . | . | H | α-helix | trans | -66.4 | -32 | -178.1 | 27.9 | -36.3 | 0 | 0 | 0 | 111.9 | M73 L74 S81 V266 | M73-P77 WeakPolarHBondContact O-CD 3.48Å; L74-P77 WeakPolarHBondContact O-CD 3.27Å; P77-S81 WeakPolarHBondContact O-CB 3.03Å; P77-S81 PolarHBondContact O-N 3.26Å; P77-S81 VanDerWaalsContact O-N 3.12Å; P77-S81 PolarHBondContact O-OG 3.42Å; P77-V266 HydrophobicContact CB-CG2 3.91Å; P77-V266 HydrophobicContact CG-CG1 4.48Å; P77-V266 HydrophobicContact CG-CG2 4.19Å |
| 78 | L | 71.6 | Confident | 73.7 | Confident | 12 Ų | 12 | 37 Ų | 37 | 6% | 0.063 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -69 | -51.4 | 178.6 | -172.4 | 61.8 | 0 | 0 | 0 | 111.7 | L74 I75 L76 V80 S81 S82 N263 V266 M267 A429 I431 | L74-L78 WeakPolarHBondContact O-CB 3.29Å; L74-L78 PolarHBondContact O-N 3.12Å; I75-L78 PolarHBondContact O-N 2.8Å; L76-L78 VanDerWaalsContact C-N 3.27Å; L76-L78 PolarHBondContact O-N 3.09Å; L78-V80 PolarHBondContact O-N 3.22Å; L78-S81 PolarHBondContact O-N 2.95Å; L78-S81 PolarHBondContact O-OG 2.96Å; L78-S82 WeakPolarHBondContact O-CB 3.47Å; L78-S82 PolarHBondContact O-N 3.38Å; L78-S82 PolarHBondContact O-OG 2.91Å; L78-N263 WeakPolarHBondContact CD1-OD1 3.48Å; L78-V266 HydrophobicContact CB-CG1 4.02Å; L78-V266 HydrophobicContact CD1-CG1 4.08Å; L78-M267 HydrophobicContact CD1-CG 4.45Å; L78-M267 HydrophobicContact CD1-SD 4.1Å; L78-A429 HydrophobicContact CD1-CB 4.15Å; L78-A429 HydrophobicContact CD2-CB 3.38Å; L78-A429 HydrophobicContact CG-CB 3.83Å; L78-I431 HydrophobicContact CD2-CD1 3.86Å |
| 79 | V | 69.9 | Low | 73.9 | Confident | 4 Ų | 4 | 38.6 Ų | 38.6 | 2% | 0.024 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -58.9 | -48.2 | -179.9 | 170.4 | 0 | 0 | 0 | 0 | 110.7 | I75 S82 L83 I234 V235 | I75-V79 HydrophobicContact CG2-CG2 3.97Å; I75-V79 WeakPolarHBondContact O-CB 3.37Å; I75-V79 VanDerWaalsContact O-CG2 3.25Å; I75-V79 WeakPolarHBondContact O-CG2 3.22Å; I75-V79 PolarHBondContact O-N 3.05Å; V79-S82 PolarHBondContact O-OG 2.95Å; V79-L83 HydrophobicContact CG1-CD1 3.68Å; V79-L83 VanDerWaalsContact O-CB 3.28Å; V79-L83 WeakPolarHBondContact O-CB 3.41Å; V79-L83 VanDerWaalsContact O-CG 3.27Å; V79-L83 WeakPolarHBondContact O-CG 3.3Å; V79-L83 PolarHBondContact O-N 2.86Å; V79-L83 VanDerWaalsContact O-N 3.11Å; V79-I234 HydrophobicContact CG1-CG2 4.34Å; V79-V235 HydrophobicContact CG1-CG2 3.6Å |
| 80 | V | 83.3 | Confident | 73.6 | Confident | 40 Ų | 40 | 32.8 Ų | 32.8 | 24% | 0.242 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -63.9 | -51.1 | -177.9 | 173.8 | 0 | 0 | 0 | 0 | 111.2 | L76 L78 M84 I234 S238 | L76-V80 HydrophobicContact CD1-CG2 4.07Å; L76-V80 WeakPolarHBondContact O-CG2 3.32Å; L76-V80 PolarHBondContact O-N 3.39Å; L76-V80 VanDerWaalsContact O-N 3.16Å; L78-V80 PolarHBondContact O-N 3.22Å; V80-M84 HydrophobicContact CG1-SD 3.68Å; V80-M84 VanDerWaalsContact O-CB 3.28Å; V80-M84 WeakPolarHBondContact O-CB 3.49Å; V80-M84 WeakPolarHBondContact O-CG 3.43Å; V80-M84 PolarHBondContact O-N 3.31Å; V80-M84 VanDerWaalsContact O-N 3.13Å; V80-I234 HydrophobicContact CG2-CG2 3.47Å; V80-I234 VanDerWaalsContact CG2-CG2 3.47Å; V80-S238 WeakPolarHBondContact CA-OG 3.43Å |
| 81 | S | 81.5 | Confident | 73 | Confident | 0 Ų | 0 | 33.7 Ų | 33.7 | 0% | 0 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -71.1 | -40.4 | -174.8 | 63.8 | 0 | 0 | 0 | 0 | 113 | P77 L78 S85 C259 N263 | P77-S81 WeakPolarHBondContact O-CB 3.03Å; P77-S81 PolarHBondContact O-N 3.26Å; P77-S81 VanDerWaalsContact O-N 3.12Å; P77-S81 PolarHBondContact O-OG 3.42Å; L78-S81 PolarHBondContact O-N 2.95Å; L78-S81 PolarHBondContact O-OG 2.96Å; S81-S85 WeakPolarHBondContact O-CB 3.38Å; S81-S85 PolarHBondContact O-N 3.42Å; S81-S85 VanDerWaalsContact O-N 3.09Å; S81-S85 PolarHBondContact O-OG 2.84Å; S81-C259 WeakPolarHBondContact CB-O 3.26Å; S81-N263 WeakPolarHBondContact OG-CA 3.44Å; S81-N263 WeakPolarHBondContact OG-CB 3.47Å |
| 82 | S | 73.7 | Confident | 72.7 | Confident | 6 Ų | 6 | 33.4 Ų | 33.4 | 4% | 0.042 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -68.8 | -43.9 | 179.4 | 63.9 | 0 | 0 | 0 | 0 | 112.5 | L78 V79 S85 G86 | L78-S82 WeakPolarHBondContact O-CB 3.47Å; L78-S82 PolarHBondContact O-N 3.38Å; L78-S82 PolarHBondContact O-OG 2.91Å; V79-S82 PolarHBondContact O-OG 2.95Å; S82-S85 PolarHBondContact O-OG 3.06Å; S82-G86 WeakPolarHBondContact O-CA 3.3Å; S82-G86 PolarHBondContact O-N 3.39Å |
| 83 | L | 73.1 | Confident | 72.2 | Confident | 2 Ų | 2 | 36.9 Ų | 36.9 | 1% | 0.01 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -69.2 | -43.8 | 178.9 | -70.6 | 173.4 | 0 | 0 | 0 | 112.1 | V79 L87 V235 I426 | V79-L83 HydrophobicContact CG1-CD1 3.68Å; V79-L83 VanDerWaalsContact O-CB 3.28Å; V79-L83 WeakPolarHBondContact O-CB 3.41Å; V79-L83 VanDerWaalsContact O-CG 3.27Å; V79-L83 WeakPolarHBondContact O-CG 3.3Å; V79-L83 PolarHBondContact O-N 2.86Å; V79-L83 VanDerWaalsContact O-N 3.11Å; L83-L87 WeakPolarHBondContact O-CB 3.46Å; L83-L87 WeakPolarHBondContact O-CG 3.34Å; L83-L87 PolarHBondContact O-N 3.07Å; L83-V235 HydrophobicContact CD1-CB 4.03Å; L83-V235 HydrophobicContact CD1-CG1 3.8Å; L83-V235 HydrophobicContact CD1-CG2 3.92Å; L83-I426 HydrophobicContact CD2-CG2 3.78Å |
| 84 | M | 84.1 | Confident | 70.8 | Confident | 14 Ų | 14 | 36.9 Ų | 36.9 | 7% | 0.069 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -62.5 | -48.4 | 179.2 | -73.5 | 177.6 | 63.9 | 0 | 0 | 111.2 | V80 A88 S238 M241 G242 L245 L255 C259 | V80-M84 HydrophobicContact CG1-SD 3.68Å; V80-M84 VanDerWaalsContact O-CB 3.28Å; V80-M84 WeakPolarHBondContact O-CB 3.49Å; V80-M84 WeakPolarHBondContact O-CG 3.43Å; V80-M84 PolarHBondContact O-N 3.31Å; V80-M84 VanDerWaalsContact O-N 3.13Å; M84-A88 WeakPolarHBondContact O-CB 3.2Å; M84-A88 PolarHBondContact O-N 3.17Å; M84-S238 WeakPolarHBondContact CG-O 3.24Å; M84-M241 HydrophobicContact CE-CB 4.32Å; M84-M241 HydrophobicContact CE-CG 3.64Å; M84-M241 HydrophobicContact CG-CB 4.46Å; M84-M241 HydrophobicContact SD-CG 4.47Å; M84-G242 WeakPolarHBondContact O-CA 3.36Å; M84-L245 HydrophobicContact CE-CD1 3.68Å; M84-L255 HydrophobicContact CE-CD2 4.24Å; M84-L255 HydrophobicContact CE-CG 4.47Å; M84-C259 HydrophobicContact CB-CB 4.42Å |
| 85 | S | 78.1 | Confident | 70.1 | Confident | 9 Ų | 9 | 37.9 Ų | 37.9 | 6% | 0.063 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -70.6 | -40.7 | 179.2 | 59.4 | 0 | 0 | 0 | 0 | 112.9 | S81 S82 A88 S89 | S81-S85 WeakPolarHBondContact O-CB 3.38Å; S81-S85 PolarHBondContact O-N 3.42Å; S81-S85 VanDerWaalsContact O-N 3.09Å; S81-S85 PolarHBondContact O-OG 2.84Å; S82-S85 PolarHBondContact O-OG 3.06Å; S85-A88 PolarHBondContact O-N 3.32Å; S85-S89 PolarHBondContact O-N 3.46Å; S85-S89 VanDerWaalsContact O-N 3.13Å |
| 86 | G | 71.9 | Confident | 69.9 | Low | 19 Ų | 19 | 39.9 Ų | 39.9 | 20% | 0.196 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -61.2 | -48.7 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112 | S82 S89 | S82-G86 WeakPolarHBondContact O-CA 3.3Å; S82-G86 PolarHBondContact O-N 3.39Å; G86-S89 PolarHBondContact O-OG 3.11Å |
| 87 | L | 75.8 | Confident | 70 | Confident | 20 Ų | 20 | 43.9 Ų | 43.9 | 11% | 0.105 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -78.7 | -25.7 | -179.1 | -67.2 | 167.6 | 0 | 0 | 0 | 113.4 | L83 S89 L90 A239 I243 I385 | L83-L87 WeakPolarHBondContact O-CB 3.46Å; L83-L87 WeakPolarHBondContact O-CG 3.34Å; L83-L87 PolarHBondContact O-N 3.07Å; L87-S89 VanDerWaalsContact C-N 3.33Å; L87-L90 HydrophobicContact CD2-CD1 3.69Å; L87-L90 WeakPolarHBondContact O-CB 3.46Å; L87-L90 PolarHBondContact O-N 3.13Å; L87-A239 HydrophobicContact CD1-CB 3.42Å; L87-A239 VanDerWaalsContact CD1-CB 3.42Å; L87-I243 HydrophobicContact CB-CG1 4.12Å; L87-I385 HydrophobicContact CD2-CD1 3.88Å |
| 88 | A | 78.9 | Confident | 70 | Confident | 10 Ų | 10 | 42.5 Ų | 42.5 | 8% | 0.083 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -71.4 | -28 | 173.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | M84 S85 L90 G242 L245 G246 V256 | M84-A88 WeakPolarHBondContact O-CB 3.2Å; M84-A88 PolarHBondContact O-N 3.17Å; S85-A88 PolarHBondContact O-N 3.32Å; A88-L90 PolarHBondContact O-N 2.87Å; A88-G242 WeakPolarHBondContact CA-O 3.43Å; A88-G242 VanDerWaalsContact CB-O 3.29Å; A88-G242 WeakPolarHBondContact CB-O 3.32Å; A88-G242 PolarHBondContact N-O 3.48Å; A88-L245 HydrophobicContact CB-CB 4.06Å; A88-G246 VanDerWaalsContact O-CA 3.3Å; A88-G246 WeakPolarHBondContact O-CA 3.35Å; A88-V256 HydrophobicContact CB-CB 4.4Å; A88-V256 HydrophobicContact CB-CG1 4.06Å; A88-V256 HydrophobicContact CB-CG2 3.42Å; A88-V256 VanDerWaalsContact CB-CG2 3.42Å |
| 89 | S | 68.7 | Low | 70.4 | Confident | 63 Ų | 63 | 42.3 Ų | 42.3 | 44% | 0.441 | 24% | 0.237 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -69.4 | -10.2 | 175.7 | 75.6 | 0 | 0 | 0 | 0 | 113.8 | S85 G86 L87 D91 | S85-S89 PolarHBondContact O-N 3.46Å; S85-S89 VanDerWaalsContact O-N 3.13Å; G86-S89 PolarHBondContact O-OG 3.11Å; L87-S89 VanDerWaalsContact C-N 3.33Å; S89-D91 PolarHBondContact O-N 3.2Å |
| 90 | L | 65.7 | Low | 71 | Confident | 34 Ų | 34 | 47.8 Ų | 47.8 | 18% | 0.178 | 27% | 0.265 | C | S | . | . | S | Bend | trans | -76.6 | 87.9 | 175.2 | -59.7 | 175.5 | 0 | 0 | 0 | 109.6 | L87 A88 A92 V103 F377 V381 | L87-L90 HydrophobicContact CD2-CD1 3.69Å; L87-L90 WeakPolarHBondContact O-CB 3.46Å; L87-L90 PolarHBondContact O-N 3.13Å; A88-L90 PolarHBondContact O-N 2.87Å; L90-A92 PolarHBondContact O-N 3Å; L90-V103 HydrophobicContact CD1-CG2 4.06Å; L90-F377 HydrophobicContact CD2-CE1 4.37Å; L90-F377 HydrophobicContact CD2-CE2 4.02Å; L90-F377 HydrophobicContact CD2-CZ 3.5Å; L90-F377 VanDerWaalsContact CD2-CZ 3.5Å; L90-V381 HydrophobicContact CD2-CG1 4.35Å; L90-V381 HydrophobicContact CD2-CG2 4.03Å |
| 91 | D | 58.3 | Low | 71.2 | Confident | 73 Ų | 73 | 48.5 Ų | 48.5 | 39% | 0.39 | 27% | 0.267 | S | S | . | . | trans | -59.9 | 117.3 | 179.7 | -177.4 | 16.8 | 0 | 0 | 0 | 112.1 | S89 K93 T94 | S89-D91 PolarHBondContact O-N 3.2Å; D91-K93 VanDerWaalsContact C-N 3.35Å; D91-K93 PolarHBondContact O-N 3.29Å; D91-K93 PolarHBondContact OD1-N 3.48Å; D91-T94 PolarHBondContact OD2-OG1 2.93Å | ||
| 92 | A | 55 | Low | 71.5 | Confident | 30 Ų | 30 | 48.5 Ų | 48.5 | 25% | 0.248 | 27% | 0.267 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -77.5 | -14.6 | -175.3 | 0 | 0 | 0 | 0 | 0 | 113.9 | L90 S96 R247 | L90-A92 PolarHBondContact O-N 3Å; A92-S96 WeakPolarHBondContact O-CB 3.32Å; A92-R247 HydrophobicContact CB-CG 4.3Å |
| 93 | K | 52 | Low | 72.1 | Confident | 191 Ų | 191 | 49.8 Ų | 49.8 | 83% | 0.83 | 28% | 0.275 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -106.2 | -27.2 | -170 | -77.1 | 180 | 178.3 | 175.3 | 0 | 115.3 | D91 | D91-K93 VanDerWaalsContact C-N 3.35Å; D91-K93 PolarHBondContact O-N 3.29Å; D91-K93 PolarHBondContact OD1-N 3.48Å |
| 94 | T | 47.4 | Very low | 72.9 | Confident | 127 Ų | 127 | 52.2 Ų | 52.2 | 78% | 0.779 | 30% | 0.295 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -124.5 | -17.7 | -173.9 | 0.4 | 0 | 0 | 0 | 0 | 114.7 | D91 | D91-T94 PolarHBondContact OD2-OG1 2.93Š|
| 95 | S | 56.1 | Low | 73.3 | Confident | 32 Ų | 32 | 52.5 Ų | 52.5 | 22% | 0.224 | 30% | 0.296 | C | S | . | . | S | Bend | trans | -129.3 | 21.2 | -178.4 | -163.8 | 0 | 0 | 0 | 0 | 112.9 | R97 L98 G99 | S95-R97 VanDerWaalsContact C-N 3.32Å; S95-R97 PolarHBondContact O-N 2.88Å; S95-L98 PolarHBondContact O-N 3.09Å; S95-G99 PolarHBondContact O-N 2.98Å |
| 96 | S | 64 | Low | 74 | Confident | 55 Ų | 55 | 52.1 Ų | 52.1 | 39% | 0.385 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -62.2 | -37 | -171 | 63.4 | 0 | 0 | 0 | 0 | 112.9 | A92 I100 | A92-S96 WeakPolarHBondContact O-CB 3.32Å; S96-I100 VanDerWaalsContact O-CB 3.28Å; S96-I100 WeakPolarHBondContact O-CB 3.44Å; S96-I100 WeakPolarHBondContact O-CD1 3.42Å; S96-I100 WeakPolarHBondContact O-CG1 3.33Å; S96-I100 PolarHBondContact O-N 3.48Å |
| 97 | R | 78.9 | Confident | 74.9 | Confident | 140 Ų | 140 | 54.8 Ų | 54.8 | 53% | 0.528 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -70.9 | -47.2 | -179.6 | -171.3 | 177.5 | 173.3 | -156.7 | -1.5 | 112.6 | S95 G99 L101 D489 | S95-R97 VanDerWaalsContact C-N 3.32Å; S95-R97 PolarHBondContact O-N 2.88Å; R97-G99 VanDerWaalsContact C-N 3.31Å; R97-G99 PolarHBondContact O-N 3.33Å; R97-L101 WeakPolarHBondContact O-CB 3.49Å; R97-L101 PolarHBondContact O-N 3.19Å; R97-D489 IonicContact CZ-OD1 3.27Å; R97-D489 IonicContact CZ-OD2 3.57Å; R97-D489 IonicContact NE-OD2 2.83Å; R97-D489 IonicContact NH1-OD1 2.72Å; R97-D489 PolarHBondContact NH1-OD1 2.9Å; R97-D489 IonicContact NH1-OD2 3.43Å; R97-D489 PolarHBondContact NH1-OD2 3.22Å |
| 98 | L | 83 | Confident | 75.8 | Confident | 11 Ų | 11 | 60.7 Ų | 60.7 | 6% | 0.058 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -61.1 | -44.1 | 175.7 | 177.5 | 67.7 | 0 | 0 | 0 | 110.2 | S95 T102 F377 V378 M482 C486 F490 | S95-L98 PolarHBondContact O-N 3.09Å; L98-T102 VanDerWaalsContact O-CB 3.26Å; L98-T102 WeakPolarHBondContact O-CB 3.42Å; L98-T102 PolarHBondContact O-N 2.88Å; L98-T102 PolarHBondContact O-OG1 2.99Å; L98-F377 HydrophobicContact CD2-CB 4.17Å; L98-F377 HydrophobicContact CD2-CD1 3.74Å; L98-F377 HydrophobicContact CD2-CE1 4.41Å; L98-F377 HydrophobicContact CD2-CG 4.02Å; L98-F377 HydrophobicContact CG-CD1 3.93Å; L98-F377 HydrophobicContact CG-CE1 4.19Å; L98-V378 HydrophobicContact CD1-CG2 4.48Å; L98-M482 HydrophobicContact CD1-CB 3.77Å; L98-M482 HydrophobicContact CD1-CG 4.2Å; L98-M482 HydrophobicContact CD1-SD 4.48Å; L98-C486 HydrophobicContact CD1-CB 4.49Å; L98-F490 HydrophobicContact CD2-CZ 4.22Å |
| 99 | G | 79.2 | Confident | 76.6 | Confident | 8 Ų | 8 | 60.2 Ų | 60.2 | 8% | 0.082 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -59.2 | -56.4 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.8 | S95 R97 L101 T102 V103 F377 | S95-G99 PolarHBondContact O-N 2.98Å; R97-G99 VanDerWaalsContact C-N 3.31Å; R97-G99 PolarHBondContact O-N 3.33Å; G99-L101 VanDerWaalsContact C-N 3.31Å; G99-L101 PolarHBondContact O-N 2.82Å; G99-T102 PolarHBondContact O-N 2.75Å; G99-V103 WeakPolarHBondContact O-CG2 3.27Å; G99-V103 PolarHBondContact O-N 3.14Å; G99-F377 VanDerWaalsContact CA-CZ 3.48Å |
| 100 | I | 82.1 | Confident | 77.8 | Confident | 120 Ų | 120 | 57.3 Ų | 57.3 | 62% | 0.615 | 30% | 0.299 | S | S | * | . | H | α-helix | trans | -60 | -43.9 | -179 | -69.1 | 164.4 | 0 | 0 | 0 | 110.7 | S96 T102 A104 | S96-I100 VanDerWaalsContact O-CB 3.28Å; S96-I100 WeakPolarHBondContact O-CB 3.44Å; S96-I100 WeakPolarHBondContact O-CD1 3.42Å; S96-I100 WeakPolarHBondContact O-CG1 3.33Å; S96-I100 PolarHBondContact O-N 3.48Å; I100-T102 PolarHBondContact O-N 2.8Å; I100-A104 WeakPolarHBondContact O-CB 3.49Å; I100-A104 PolarHBondContact O-N 2.86Å |
| 101 | L | 88.1 | Confident | 79.2 | Confident | 55 Ų | 55 | 59.6 Ų | 59.6 | 29% | 0.288 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -65.4 | -40.1 | 179.9 | -169.4 | 71.8 | 0 | 0 | 0 | 111.8 | R97 G99 Y105 M482 I485 | R97-L101 WeakPolarHBondContact O-CB 3.49Å; R97-L101 PolarHBondContact O-N 3.19Å; G99-L101 VanDerWaalsContact C-N 3.31Å; G99-L101 PolarHBondContact O-N 2.82Å; L101-Y105 VanDerWaalsContact O-CB 3.28Å; L101-Y105 WeakPolarHBondContact O-CB 3.06Å; L101-Y105 PolarHBondContact O-N 3.39Å; L101-M482 HydrophobicContact CB-SD 4.02Å; L101-M482 HydrophobicContact CD2-CE 4.32Å; L101-M482 HydrophobicContact CD2-SD 3.51Å; L101-M482 VanDerWaalsContact CD2-SD 3.51Å; L101-M482 HydrophobicContact CG-CE 3.97Å; L101-M482 HydrophobicContact CG-SD 3.65Å; L101-M482 WeakPolarHBondContact O-CE 3.04Å; L101-I485 HydrophobicContact CD2-CB 3.91Å; L101-I485 HydrophobicContact CD2-CD1 3.8Å; L101-I485 HydrophobicContact CD2-CG1 4.47Å; L101-I485 HydrophobicContact CD2-CG2 3.46Å; L101-I485 VanDerWaalsContact CD2-CG2 3.46Å |
| 102 | T | 88.2 | Confident | 81 | Confident | 0 Ų | 0 | 58.3 Ų | 58.3 | 0% | 0 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -64.2 | -50 | 177.2 | -58.9 | 0 | 0 | 0 | 0 | 111.2 | L98 G99 I100 A104 Y105 Y106 V378 | L98-T102 VanDerWaalsContact O-CB 3.26Å; L98-T102 WeakPolarHBondContact O-CB 3.42Å; L98-T102 PolarHBondContact O-N 2.88Å; L98-T102 PolarHBondContact O-OG1 2.99Å; G99-T102 PolarHBondContact O-N 2.75Å; I100-T102 PolarHBondContact O-N 2.8Å; T102-A104 PolarHBondContact O-N 2.97Å; T102-Y105 WeakPolarHBondContact O-CB 3.31Å; T102-Y105 PolarHBondContact O-N 3.4Å; T102-Y106 HydrophobicContact CG2-CD2 3.88Å; T102-Y106 HydrophobicContact CG2-CE1 4.42Å; T102-Y106 HydrophobicContact CG2-CE2 3.35Å; T102-Y106 WeakPolarHBondContact O-CD2 3.3Å; T102-Y106 VanDerWaalsContact O-CG 3.31Å; T102-Y106 PolarHBondContact O-N 3.27Å; T102-V378 HydrophobicContact CG2-CB 4.47Å; T102-V378 HydrophobicContact CG2-CG1 4.02Å; T102-V378 HydrophobicContact CG2-CG2 4.21Å |
| 103 | V | 85.4 | Confident | 83 | Confident | 33 Ų | 33 | 56.9 Ų | 56.9 | 20% | 0.2 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -63.3 | -43.5 | 178.5 | 173.6 | 0 | 0 | 0 | 0 | 111.1 | L90 G99 Y105 Y106 L107 | L90-V103 HydrophobicContact CD1-CG2 4.06Å; G99-V103 WeakPolarHBondContact O-CG2 3.27Å; G99-V103 PolarHBondContact O-N 3.14Å; V103-Y105 VanDerWaalsContact C-N 3.32Å; V103-Y105 PolarHBondContact O-N 3.38Å; V103-Y106 PolarHBondContact O-N 3.05Å; V103-L107 HydrophobicContact CG1-CD1 4.1Å; V103-L107 HydrophobicContact CG1-CG 4.36Å; V103-L107 WeakPolarHBondContact O-CG 3.44Å; V103-L107 PolarHBondContact O-N 3.37Å |
| 104 | A | 89.4 | Confident | 85.1 | Confident | 53 Ų | 53 | 47.8 Ų | 47.8 | 44% | 0.438 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -61.7 | -40.5 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112 | I100 T102 W108 | I100-A104 WeakPolarHBondContact O-CB 3.49Å; I100-A104 PolarHBondContact O-N 2.86Å; T102-A104 PolarHBondContact O-N 2.97Å; A104-W108 WeakPolarHBondContact O-CB 3.42Å; A104-W108 PolarHBondContact O-N 3.49Å |
| 105 | Y | 93.6 | Very high | 87.5 | Confident | 20 Ų | 20 | 44 Ų | 44 | 8% | 0.078 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -63 | -44.9 | 174.9 | 175.9 | -87.4 | 0 | 0 | 0 | 111.9 | L101 T102 V103 W108 T109 L324 A478 I481 M482 | L101-Y105 VanDerWaalsContact O-CB 3.28Å; L101-Y105 WeakPolarHBondContact O-CB 3.06Å; L101-Y105 PolarHBondContact O-N 3.39Å; T102-Y105 WeakPolarHBondContact O-CB 3.31Å; T102-Y105 PolarHBondContact O-N 3.4Å; V103-Y105 VanDerWaalsContact C-N 3.32Å; V103-Y105 PolarHBondContact O-N 3.38Å; Y105-W108 PolarHBondContact O-N 2.97Å; Y105-T109 HydrophobicContact CD1-CG2 4.26Å; Y105-T109 HydrophobicContact CD2-CG2 4.43Å; Y105-T109 HydrophobicContact CE1-CG2 3.71Å; Y105-T109 HydrophobicContact CE2-CG2 3.95Å; Y105-T109 PolarHBondContact O-N 3.02Å; Y105-T109 PolarHBondContact O-OG1 3.03Å; Y105-L324 HydrophobicContact CD2-CD2 4.33Å; Y105-L324 HydrophobicContact CE2-CD2 3.43Å; Y105-L324 VanDerWaalsContact CE2-CD2 3.43Å; Y105-L324 HydrophobicContact CE2-CG 4.11Å; Y105-A478 HydrophobicContact CD1-CB 3.75Å; Y105-A478 HydrophobicContact CE1-CB 3.51Å; Y105-I481 HydrophobicContact CD2-CD1 4.47Å; Y105-I481 HydrophobicContact CE2-CD1 3.45Å; Y105-I481 VanDerWaalsContact CE2-CD1 3.45Å; Y105-I481 WeakPolarHBondContact OH-CD1 3.35Å; Y105-M482 HydrophobicContact CD1-CE 4.45Å; Y105-M482 HydrophobicContact CD2-CE 4.32Å; Y105-M482 HydrophobicContact CG-CE 3.85Å |
| 106 | Y | 92.3 | Very high | 89.4 | Confident | 1 Ų | 1 | 43.3 Ų | 43.3 | 0% | 0.004 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -61.6 | -50.7 | 177 | -66.7 | -28.2 | 0 | 0 | 0 | 112 | T102 V103 W108 T109 T110 V378 V381 G382 I385 N386 A478 | T102-Y106 HydrophobicContact CG2-CD2 3.88Å; T102-Y106 HydrophobicContact CG2-CE1 4.42Å; T102-Y106 HydrophobicContact CG2-CE2 3.35Å; T102-Y106 WeakPolarHBondContact O-CD2 3.3Å; T102-Y106 VanDerWaalsContact O-CG 3.31Å; T102-Y106 PolarHBondContact O-N 3.27Å; V103-Y106 PolarHBondContact O-N 3.05Å; Y106-W108 PolarHBondContact O-N 3.49Å; Y106-T109 WeakPolarHBondContact CA-OG1 3.32Å; Y106-T109 PolarHBondContact O-N 3.42Å; Y106-T109 PolarHBondContact O-OG1 3.02Å; Y106-T109 VanDerWaalsContact O-OG1 3.09Å; Y106-T110 WeakPolarHBondContact O-CB 3.38Å; Y106-T110 PolarHBondContact O-N 3.43Å; Y106-T110 PolarHBondContact O-OG1 3.41Å; Y106-T110 VanDerWaalsContact O-OG1 3.05Å; Y106-V378 WeakPolarHBondContact OH-CG1 3.22Å; Y106-V378 PolarHBondContact OH-O 2.85Å; Y106-V381 HydrophobicContact CE2-CG1 4.19Å; Y106-G382 VanDerWaalsContact CE2-CA 3.45Å; Y106-G382 WeakPolarHBondContact OH-CA 3.3Å; Y106-I385 HydrophobicContact CD2-CB 4.46Å; Y106-I385 HydrophobicContact CD2-CG2 4.37Å; Y106-N386 HydrophobicContact CD1-CB 3.41Å; Y106-N386 VanDerWaalsContact CD1-CB 3.41Å; Y106-N386 WeakPolarHBondContact CD1-ND2 3.11Å; Y106-N386 WeakPolarHBondContact CD1-OD1 3.4Å; Y106-N386 HydrophobicContact CD2-CB 3.89Å; Y106-N386 HydrophobicContact CE1-CB 3.62Å; Y106-N386 VanDerWaalsContact CE1-CG 3.49Å; Y106-N386 WeakPolarHBondContact CE1-ND2 3.37Å; Y106-N386 HydrophobicContact CE2-CB 4.08Å; Y106-N386 HydrophobicContact CG-CB 3.55Å; Y106-A478 HydrophobicContact CD1-CB 4.27Å; Y106-A478 HydrophobicContact CE1-CB 3.39Å |
| 107 | L | 90.5 | Very high | 91 | Very high | 75 Ų | 75 | 40.7 Ų | 40.7 | 39% | 0.393 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -57.5 | -39.5 | 177.1 | -67.7 | 176.9 | 0 | 0 | 0 | 112.4 | V103 F111 I426 | V103-L107 HydrophobicContact CG1-CD1 4.1Å; V103-L107 HydrophobicContact CG1-CG 4.36Å; V103-L107 WeakPolarHBondContact O-CG 3.44Å; V103-L107 PolarHBondContact O-N 3.37Å; L107-F111 VanDerWaalsContact O-CB 3.29Å; L107-F111 WeakPolarHBondContact O-CB 3.41Å; L107-F111 PolarHBondContact O-N 2.93Å; L107-I426 HydrophobicContact CD2-CD1 3.59Å |
| 108 | W | 93.9 | Very high | 91.8 | Very high | 143 Ų | 143 | 35 Ų | 35 | 54% | 0.542 | 18% | 0.182 | S | C | . | . | H | α-helix | trans | -68.3 | -45.7 | 178.1 | -178.1 | -106.1 | 0 | 0 | 0 | 112.9 | A104 Y105 Y106 F111 L112 | A104-W108 WeakPolarHBondContact O-CB 3.42Å; A104-W108 PolarHBondContact O-N 3.49Å; Y105-W108 PolarHBondContact O-N 2.97Å; Y106-W108 PolarHBondContact O-N 3.49Å; W108-F111 PolarHBondContact O-N 3.47Å; W108-L112 HydrophobicContact CZ2-CD1 4.46Å; W108-L112 HydrophobicContact CZ2-CD2 4.37Å; W108-L112 HydrophobicContact CZ2-CG 4.49Å; W108-L112 WeakPolarHBondContact O-CG 3.38Å; W108-L112 PolarHBondContact O-N 2.92Å |
| 109 | T | 95.8 | Very high | 92.5 | Very high | 1 Ų | 1 | 38.8 Ų | 38.8 | 1% | 0.006 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -68.1 | -39.6 | -179.5 | 43.6 | 0 | 0 | 0 | 0 | 112.3 | Y105 Y106 L112 A113 H316 L321 L324 | Y105-T109 HydrophobicContact CD1-CG2 4.26Å; Y105-T109 HydrophobicContact CD2-CG2 4.43Å; Y105-T109 HydrophobicContact CE1-CG2 3.71Å; Y105-T109 HydrophobicContact CE2-CG2 3.95Å; Y105-T109 PolarHBondContact O-N 3.02Å; Y105-T109 PolarHBondContact O-OG1 3.03Å; Y106-T109 WeakPolarHBondContact CA-OG1 3.32Å; Y106-T109 PolarHBondContact O-N 3.42Å; Y106-T109 PolarHBondContact O-OG1 3.02Å; Y106-T109 VanDerWaalsContact O-OG1 3.09Å; T109-L112 PolarHBondContact O-N 3.26Å; T109-A113 PolarHBondContact O-N 3.33Å; T109-H316 PolarHBondContact O-CE1 3.48Å; T109-L321 HydrophobicContact CG2-CD2 3.86Å; T109-L324 HydrophobicContact CG2-CD2 3.58Å |
| 110 | T | 94.9 | Very high | 93.3 | Very high | 2 Ų | 2 | 40 Ų | 40 | 1% | 0.012 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -65 | -43.5 | 174.3 | -59.6 | 0 | 0 | 0 | 0 | 111.7 | Y106 L112 A113 V114 D388 A391 T422 S425 | Y106-T110 WeakPolarHBondContact O-CB 3.38Å; Y106-T110 PolarHBondContact O-N 3.43Å; Y106-T110 PolarHBondContact O-OG1 3.41Å; Y106-T110 VanDerWaalsContact O-OG1 3.05Å; T110-L112 VanDerWaalsContact C-N 3.35Å; T110-L112 PolarHBondContact O-N 3.16Å; T110-A113 WeakPolarHBondContact O-CB 3.48Å; T110-A113 PolarHBondContact O-N 3.16Å; T110-A113 VanDerWaalsContact O-N 3.17Å; T110-V114 WeakPolarHBondContact O-CG2 3.48Å; T110-V114 PolarHBondContact O-N 3.06Å; T110-D388 WeakPolarHBondContact CA-OD1 3.34Å; T110-D388 WeakPolarHBondContact CB-OD1 3.27Å; T110-D388 PolarHBondContact N-OD1 3.22Å; T110-D388 PolarHBondContact OG1-OD1 3.11Å; T110-A391 HydrophobicContact CG2-CB 3.46Å; T110-A391 VanDerWaalsContact CG2-CB 3.46Å; T110-T422 HydrophobicContact CG2-CG2 3.98Å; T110-S425 VanDerWaalsContact CG2-OG 3.31Å; T110-S425 WeakPolarHBondContact CG2-OG 3.5Å |
| 111 | F | 94.4 | Very high | 93.9 | Very high | 81 Ų | 81 | 34.3 Ų | 34.3 | 36% | 0.355 | 18% | 0.176 | S | C | . | . | H | α-helix | trans | -60.6 | -42.6 | 173.9 | 179.1 | -103.4 | 0 | 0 | 0 | 112.1 | L107 W108 A113 V114 V115 | L107-F111 VanDerWaalsContact O-CB 3.29Å; L107-F111 WeakPolarHBondContact O-CB 3.41Å; L107-F111 PolarHBondContact O-N 2.93Å; W108-F111 PolarHBondContact O-N 3.47Å; F111-A113 VanDerWaalsContact C-N 3.33Å; F111-A113 PolarHBondContact O-N 3.26Å; F111-V114 WeakPolarHBondContact O-CB 3.31Å; F111-V114 PolarHBondContact O-N 3.47Å; F111-V115 HydrophobicContact CD1-CG2 4.36Å; F111-V115 HydrophobicContact CE1-CG2 3.93Å; F111-V115 HydrophobicContact CE2-CG2 4.41Å; F111-V115 HydrophobicContact CZ-CG2 3.96Å; F111-V115 WeakPolarHBondContact O-CG2 3.49Å; F111-V115 PolarHBondContact O-N 3.34Å |
| 112 | L | 96.4 | Very high | 94.1 | Very high | 46 Ų | 46 | 34.6 Ų | 34.6 | 24% | 0.241 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -61 | -40.8 | 173.8 | -75.6 | 176.5 | 0 | 0 | 0 | 112.2 | W108 T109 T110 V114 V115 V116 I320 | W108-L112 HydrophobicContact CZ2-CD1 4.46Å; W108-L112 HydrophobicContact CZ2-CD2 4.37Å; W108-L112 HydrophobicContact CZ2-CG 4.49Å; W108-L112 WeakPolarHBondContact O-CG 3.38Å; W108-L112 PolarHBondContact O-N 2.92Å; T109-L112 PolarHBondContact O-N 3.26Å; T110-L112 VanDerWaalsContact C-N 3.35Å; T110-L112 PolarHBondContact O-N 3.16Å; L112-V114 VanDerWaalsContact C-N 3.32Å; L112-V114 PolarHBondContact O-N 3.33Å; L112-V115 PolarHBondContact O-N 2.84Å; L112-V116 WeakPolarHBondContact O-CG2 3.19Å; L112-V116 PolarHBondContact O-N 3.44Å; L112-I320 HydrophobicContact CD1-CG2 4.47Å |
| 113 | A | 97.4 | Very high | 94.3 | Very high | 0 Ų | 0 | 40.7 Ų | 40.7 | 0% | 0 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -60.5 | -42.8 | 177 | 0 | 0 | 0 | 0 | 0 | 111.6 | T109 T110 F111 V116 G117 D388 L392 | T109-A113 PolarHBondContact O-N 3.33Å; T110-A113 WeakPolarHBondContact O-CB 3.48Å; T110-A113 PolarHBondContact O-N 3.16Å; T110-A113 VanDerWaalsContact O-N 3.17Å; F111-A113 VanDerWaalsContact C-N 3.33Å; F111-A113 PolarHBondContact O-N 3.26Å; A113-V116 PolarHBondContact O-N 2.78Å; A113-G117 PolarHBondContact O-N 2.81Å; A113-D388 HydrophobicContact CB-CB 4.02Å; A113-D388 WeakPolarHBondContact CB-O 3.46Å; A113-L392 HydrophobicContact CB-CB 4.17Å; A113-L392 WeakPolarHBondContact O-CD1 3.44Å; A113-L392 WeakPolarHBondContact O-CG 3.21Å |
| 114 | V | 96.9 | Very high | 94.6 | Very high | 0 Ų | 0 | 41.6 Ų | 41.6 | 0% | 0 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -61.4 | -47.3 | 175.4 | 169.3 | 0 | 0 | 0 | 0 | 111.4 | T110 F111 L112 V116 G117 I118 A391 A395 S418 A421 | T110-V114 WeakPolarHBondContact O-CG2 3.48Å; T110-V114 PolarHBondContact O-N 3.06Å; F111-V114 WeakPolarHBondContact O-CB 3.31Å; F111-V114 PolarHBondContact O-N 3.47Å; L112-V114 VanDerWaalsContact C-N 3.32Å; L112-V114 PolarHBondContact O-N 3.33Å; V114-V116 VanDerWaalsContact C-N 3.3Å; V114-V116 PolarHBondContact O-N 2.76Å; V114-G117 WeakPolarHBondContact O-CA 3.3Å; V114-G117 PolarHBondContact O-N 3.15Å; V114-G117 VanDerWaalsContact O-N 3.1Å; V114-I118 HydrophobicContact CG1-CD1 3.87Å; V114-I118 HydrophobicContact CG1-CG1 4.44Å; V114-I118 WeakPolarHBondContact O-CG1 3.42Å; V114-I118 PolarHBondContact O-N 3.37Å; V114-A391 HydrophobicContact CG2-CB 3.49Å; V114-A391 VanDerWaalsContact CG2-CB 3.49Å; V114-A395 HydrophobicContact CG1-CB 3.98Å; V114-S418 VanDerWaalsContact CG1-OG 3.29Å; V114-S418 WeakPolarHBondContact CG1-OG 3.44Å; V114-A421 HydrophobicContact CG2-CB 4.14Å |
| 115 | V | 96.5 | Very high | 94.7 | Very high | 48 Ų | 48 | 43.5 Ų | 43.5 | 29% | 0.291 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -59.1 | -43 | 177.4 | 171.5 | 0 | 0 | 0 | 0 | 111 | F111 L112 G117 I118 I119 | F111-V115 HydrophobicContact CD1-CG2 4.36Å; F111-V115 HydrophobicContact CE1-CG2 3.93Å; F111-V115 HydrophobicContact CE2-CG2 4.41Å; F111-V115 HydrophobicContact CZ-CG2 3.96Å; F111-V115 WeakPolarHBondContact O-CG2 3.49Å; F111-V115 PolarHBondContact O-N 3.34Å; L112-V115 PolarHBondContact O-N 2.84Å; V115-G117 VanDerWaalsContact C-N 3.33Å; V115-G117 PolarHBondContact O-N 3.2Å; V115-I118 PolarHBondContact O-N 3.36Å; V115-I119 HydrophobicContact CG1-CD1 3.78Å; V115-I119 HydrophobicContact CG1-CG1 4.43Å; V115-I119 WeakPolarHBondContact O-CB 3.31Å; V115-I119 VanDerWaalsContact O-CG1 3.26Å; V115-I119 WeakPolarHBondContact O-CG1 3.41Å; V115-I119 PolarHBondContact O-N 3.43Å |
| 116 | V | 97.4 | Very high | 94.4 | Very high | 17 Ų | 17 | 42.6 Ų | 42.6 | 10% | 0.103 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -61.3 | -43.4 | 175.4 | 172.6 | 0 | 0 | 0 | 0 | 111 | L112 A113 V114 I119 M120 V315 I320 L392 | L112-V116 WeakPolarHBondContact O-CG2 3.19Å; L112-V116 PolarHBondContact O-N 3.44Å; A113-V116 PolarHBondContact O-N 2.78Å; V114-V116 VanDerWaalsContact C-N 3.3Å; V114-V116 PolarHBondContact O-N 2.76Å; V116-I119 PolarHBondContact O-N 2.97Å; V116-M120 VanDerWaalsContact O-CB 3.3Å; V116-M120 WeakPolarHBondContact O-CB 3.45Å; V116-M120 PolarHBondContact O-N 3.13Å; V116-V315 HydrophobicContact CG1-CB 4.32Å; V116-V315 HydrophobicContact CG1-CG1 4Å; V116-I320 HydrophobicContact CG2-CD1 3.23Å; V116-L392 HydrophobicContact CB-CD1 4.4Å; V116-L392 HydrophobicContact CG1-CD1 4.18Å |
| 117 | G | 97.1 | Very high | 93.9 | Very high | 0 Ų | 0 | 42.5 Ų | 42.5 | 0% | 0 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -57.5 | -50.6 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | A113 V114 V115 I119 M120 V121 V396 | A113-G117 PolarHBondContact O-N 2.81Å; V114-G117 WeakPolarHBondContact O-CA 3.3Å; V114-G117 PolarHBondContact O-N 3.15Å; V114-G117 VanDerWaalsContact O-N 3.1Å; V115-G117 VanDerWaalsContact C-N 3.33Å; V115-G117 PolarHBondContact O-N 3.2Å; G117-I119 PolarHBondContact O-N 3.01Å; G117-M120 PolarHBondContact O-N 3.28Å; G117-V121 WeakPolarHBondContact O-CG1 3.27Å; G117-V121 PolarHBondContact O-N 3.27Å; G117-V396 WeakPolarHBondContact O-CG2 3.31Å |
| 118 | I | 96.1 | Very high | 93 | Very high | 22 Ų | 22 | 40.1 Ų | 40.1 | 11% | 0.113 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -60.2 | -44.5 | 178.7 | -65.6 | 171.3 | 0 | 0 | 0 | 111 | V114 V115 V121 S122 A395 I399 I414 | V114-I118 HydrophobicContact CG1-CD1 3.87Å; V114-I118 HydrophobicContact CG1-CG1 4.44Å; V114-I118 WeakPolarHBondContact O-CG1 3.42Å; V114-I118 PolarHBondContact O-N 3.37Å; V115-I118 PolarHBondContact O-N 3.36Å; I118-V121 WeakPolarHBondContact O-CG1 3.39Å; I118-S122 VanDerWaalsContact O-CB 3.24Å; I118-S122 WeakPolarHBondContact O-CB 3.02Å; I118-S122 PolarHBondContact O-N 2.82Å; I118-S122 PolarHBondContact O-OG 3.27Å; I118-A395 HydrophobicContact CG1-CB 4Å; I118-I399 HydrophobicContact CB-CD1 4.28Å; I118-I399 HydrophobicContact CG1-CD1 3.87Å; I118-I399 HydrophobicContact CG2-CD1 4.08Å; I118-I414 HydrophobicContact CD1-CG2 4.13Å; I118-I414 HydrophobicContact CG2-CG2 3.86Å |
| 119 | I | 96.1 | Very high | 91.3 | Very high | 90 Ų | 90 | 35 Ų | 35 | 46% | 0.462 | 19% | 0.194 | S | C | . | . | H | α-helix | trans | -61.5 | -47.3 | 176.3 | -69.8 | 168.2 | 0 | 0 | 0 | 110.1 | V115 V116 G117 S122 I123 | V115-I119 HydrophobicContact CG1-CD1 3.78Å; V115-I119 HydrophobicContact CG1-CG1 4.43Å; V115-I119 WeakPolarHBondContact O-CB 3.31Å; V115-I119 VanDerWaalsContact O-CG1 3.26Å; V115-I119 WeakPolarHBondContact O-CG1 3.41Å; V115-I119 PolarHBondContact O-N 3.43Å; V116-I119 PolarHBondContact O-N 2.97Å; G117-I119 PolarHBondContact O-N 3.01Å; I119-S122 PolarHBondContact O-N 3.44Å; I119-I123 HydrophobicContact CG2-CD1 3.62Å; I119-I123 HydrophobicContact CG2-CG1 4.44Å; I119-I123 VanDerWaalsContact O-CG1 3.29Å; I119-I123 WeakPolarHBondContact O-CG1 3.49Å; I119-I123 PolarHBondContact O-N 3.29Å |
| 120 | M | 95.8 | Very high | 89.3 | Confident | 34 Ų | 34 | 36.6 Ų | 36.6 | 17% | 0.167 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -64 | -45.5 | -176.3 | -163.3 | 61.1 | 68.6 | 0 | 0 | 112.2 | V116 G117 S122 I123 I124 T308 C311 V315 | V116-M120 VanDerWaalsContact O-CB 3.3Å; V116-M120 WeakPolarHBondContact O-CB 3.45Å; V116-M120 PolarHBondContact O-N 3.13Å; G117-M120 PolarHBondContact O-N 3.28Å; M120-S122 VanDerWaalsContact C-N 3.33Å; M120-S122 PolarHBondContact O-N 2.93Å; M120-I123 PolarHBondContact O-N 3.36Å; M120-I124 HydrophobicContact CG-CD1 3.89Å; M120-I124 WeakPolarHBondContact O-CB 3.34Å; M120-I124 WeakPolarHBondContact O-CG1 3.28Å; M120-I124 PolarHBondContact O-N 2.88Å; M120-I124 HydrophobicContact SD-CD1 3.77Å; M120-I124 HydrophobicContact SD-CG1 4.39Å; M120-T308 HydrophobicContact CB-CG2 4.25Å; M120-T308 HydrophobicContact CG-CG2 3.88Å; M120-C311 HydrophobicContact CE-CB 4.41Å; M120-C311 HydrophobicContact CG-CB 4.41Å; M120-C311 HydrophobicContact SD-CB 4.2Å; M120-V315 HydrophobicContact CE-CG2 3.93Å |
| 121 | V | 95.4 | Very high | 87.2 | Confident | 0 Ų | 0 | 39.3 Ų | 39.3 | 0% | 0 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -70.5 | -29.5 | 178.9 | 71.2 | 0 | 0 | 0 | 0 | 112.7 | G117 I118 H125 P126 T308 V396 I399 | G117-V121 WeakPolarHBondContact O-CG1 3.27Å; G117-V121 PolarHBondContact O-N 3.27Å; I118-V121 WeakPolarHBondContact O-CG1 3.39Å; V121-H125 VanDerWaalsContact O-CA 3.28Å; V121-H125 WeakPolarHBondContact O-CA 3.43Å; V121-H125 PolarHBondContact O-N 3.44Å; V121-P126 HydrophobicContact CG2-CG 3.84Å; V121-T308 HydrophobicContact CB-CG2 3.98Å; V121-T308 HydrophobicContact CG2-CG2 4.38Å; V121-V396 HydrophobicContact CB-CB 4.48Å; V121-V396 HydrophobicContact CB-CG1 4.1Å; V121-V396 HydrophobicContact CB-CG2 4.31Å; V121-V396 HydrophobicContact CG2-CG1 4.11Å; V121-I399 HydrophobicContact CB-CG2 4.49Å; V121-I399 HydrophobicContact CG1-CB 3.82Å; V121-I399 HydrophobicContact CG1-CD1 3.61Å; V121-I399 HydrophobicContact CG1-CG1 4.3Å; V121-I399 HydrophobicContact CG1-CG2 3.72Å; V121-I399 HydrophobicContact CG2-CB 4.16Å; V121-I399 HydrophobicContact CG2-CG2 3.92Å |
| 122 | S | 91.6 | Very high | 84.9 | Confident | 61 Ų | 61 | 45.2 Ų | 45.2 | 43% | 0.427 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -71.9 | -37.9 | 175.5 | -59.2 | 0 | 0 | 0 | 0 | 111.8 | I118 I119 M120 | I118-S122 VanDerWaalsContact O-CB 3.24Å; I118-S122 WeakPolarHBondContact O-CB 3.02Å; I118-S122 PolarHBondContact O-N 2.82Å; I118-S122 PolarHBondContact O-OG 3.27Å; I119-S122 PolarHBondContact O-N 3.44Å; M120-S122 VanDerWaalsContact C-N 3.33Å; M120-S122 PolarHBondContact O-N 2.93Å |
| 123 | I | 92.9 | Very high | 82.4 | Confident | 128 Ų | 128 | 51.1 Ų | 51.1 | 66% | 0.656 | 27% | 0.272 | S | S | * | . | H | α-helix | trans | -73.2 | -48.2 | 178 | -68.3 | 169.6 | 0 | 0 | 0 | 111.4 | I119 M120 | I119-I123 HydrophobicContact CG2-CD1 3.62Å; I119-I123 HydrophobicContact CG2-CG1 4.44Å; I119-I123 VanDerWaalsContact O-CG1 3.29Å; I119-I123 WeakPolarHBondContact O-CG1 3.49Å; I119-I123 PolarHBondContact O-N 3.29Å; M120-I123 PolarHBondContact O-N 3.36Å |
| 124 | I | 92.4 | Very high | 79.6 | Confident | 52 Ų | 52 | 57 Ų | 57 | 27% | 0.267 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -77.9 | -32.3 | -175.3 | -63.1 | 176.4 | 0 | 0 | 0 | 111.3 | M120 F304 T308 | M120-I124 HydrophobicContact CG-CD1 3.89Å; M120-I124 WeakPolarHBondContact O-CB 3.34Å; M120-I124 WeakPolarHBondContact O-CG1 3.28Å; M120-I124 PolarHBondContact O-N 2.88Å; M120-I124 HydrophobicContact SD-CD1 3.77Å; M120-I124 HydrophobicContact SD-CG1 4.39Å; I124-F304 HydrophobicContact CG2-CD1 4.17Å; I124-T308 HydrophobicContact CD1-CG2 4.18Å; I124-T308 WeakPolarHBondContact CG2-OG1 3.38Å |
| 125 | H | 90.6 | Very high | 76.7 | Confident | 93 Ų | 93 | 62.9 Ų | 62.9 | 43% | 0.431 | 34% | 0.344 | S | S | . | . | trans | 50.9 | 57.2 | 178.9 | -151.1 | 90.4 | 0 | 0 | 0 | 113.8 | V121 G127 G128 A129 Q403 | V121-H125 VanDerWaalsContact O-CA 3.28Å; V121-H125 WeakPolarHBondContact O-CA 3.43Å; V121-H125 PolarHBondContact O-N 3.44Å; H125-G127 VanDerWaalsContact C-N 3.29Å; H125-G127 PolarHBondContact O-N 2.87Å; H125-G128 PolarHBondContact O-N 3.32Å; H125-A129 PolarHBondContact O-N 3.09Å; H125-Q403 PolarHBondContact CE1-NE2 2.8Å; H125-Q403 PolarHBondContact ND1-NE2 2.88Å | ||
| 126 | P | 88.4 | Confident | 74 | Confident | 0 Ų | 0 | 68.4 Ų | 68.4 | 0% | 0 | 37% | 0.367 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -62.4 | -28.1 | -169.3 | 23.3 | -33.2 | 0 | 0 | 0 | 114.8 | V121 F304 F400 | V121-P126 HydrophobicContact CG2-CG 3.84Å; P126-F304 HydrophobicContact CB-CB 3.81Å; P126-F400 HydrophobicContact CB-CD2 3.93Å; P126-F400 HydrophobicContact CB-CE2 4.23Å; P126-F400 HydrophobicContact CG-CB 4.46Å; P126-F400 HydrophobicContact CG-CD2 3.82Å |
| 127 | G | 80.6 | Confident | 71.2 | Confident | 0 Ų | 0 | 76.1 Ų | 76.1 | 0% | 0 | 40% | 0.401 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -75.3 | -32.3 | -179.6 | 0 | 0 | 0 | 0 | 0 | 114 | H125 K301 | H125-G127 VanDerWaalsContact C-N 3.29Å; H125-G127 PolarHBondContact O-N 2.87Å; G127-K301 WeakPolarHBondContact O-CE 3.49Å |
| 128 | G | 72.8 | Confident | 68.5 | Low | 24 Ų | 24 | 80.3 Ų | 80.3 | 25% | 0.247 | 43% | 0.431 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -85.1 | -15 | 179.5 | 0 | 0 | 0 | 0 | 0 | 114.7 | H125 A130 Q131 | H125-G128 PolarHBondContact O-N 3.32Å; G128-A130 PolarHBondContact O-N 2.81Å; G128-Q131 PolarHBondContact O-N 3.37Å |
| 129 | A | 58.6 | Low | 66 | Low | 37 Ų | 37 | 82.6 Ų | 82.6 | 31% | 0.306 | 46% | 0.46 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62.6 | -4.5 | -177.4 | 0 | 0 | 0 | 0 | 0 | 115.6 | H125 K300 F304 | H125-A129 PolarHBondContact O-N 3.09Å; A129-K300 PolarHBondContact O-NZ 2.8Å; A129-F304 HydrophobicContact CB-CD2 4.37Å |
| 130 | A | 52.5 | Low | 63.8 | Low | 33 Ų | 33 | 84.6 Ų | 84.6 | 27% | 0.273 | 47% | 0.465 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -126.4 | 10 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113.8 | G128 K301 | G128-A130 PolarHBondContact O-N 2.81Å; A130-K301 HydrophobicContact CB-CD 4.16Å; A130-K301 HydrophobicContact CB-CG 3.63Å |
| 131 | Q | 51.3 | Low | 61.7 | Low | 59 Ų | 59 | 88.1 Ų | 88.1 | 28% | 0.276 | 49% | 0.491 | S | S | . | . | trans | -101.5 | 23.9 | -171 | -122 | 173.6 | 20.2 | 0 | 0 | 114.8 | G128 E133 N406 | G128-Q131 PolarHBondContact O-N 3.37Å; Q131-E133 PolarHBondContact O-N 3.32Å; Q131-E133 VanDerWaalsContact O-N 3.13Å; Q131-N406 PolarHBondContact NE2-ND2 2.94Å; Q131-N406 VanDerWaalsContact NE2-ND2 3.11Å; Q131-N406 PolarHBondContact NE2-OD1 2.98Å; Q131-N406 PolarHBondContact OE1-OD1 3.13Å | ||
| 132 | K | 45.5 | Very low | 59.7 | Low | 206 Ų | 206 | 91 Ų | 91 | 90% | 0.896 | 51% | 0.508 | S | S | * | . | S | Bend | trans | -71.9 | -3.2 | -178.2 | -131.7 | -179.3 | -176.8 | -176.7 | 0 | 114.4 | ||
| 133 | E | 43.8 | Very low | 58.3 | Low | 170 Ų | 170 | 89.4 Ų | 89.4 | 79% | 0.794 | 49% | 0.494 | S | S | * | . | S | Bend | trans | -142.3 | 133.3 | 175.4 | -61.7 | -169.1 | 177.9 | 0 | 0 | 110.6 | Q131 | Q131-E133 PolarHBondContact O-N 3.32Å; Q131-E133 VanDerWaalsContact O-N 3.13Å |
| 134 | T | 39.1 | Very low | 57.2 | Low | 122 Ų | 122 | 86.5 Ų | 86.5 | 75% | 0.748 | 49% | 0.485 | S | S | * | . | trans | 85.6 | 80.6 | 177.7 | -7.4 | 0 | 0 | 0 | 0 | 117 | E136 | T134-E136 PolarHBondContact O-N 3.01Š| ||
| 135 | T | 36.3 | Very low | 56 | Low | 124 Ų | 124 | 85.4 Ų | 85.4 | 76% | 0.761 | 48% | 0.482 | S | S | * | . | trans | -83.5 | 88.1 | 162.7 | -52.5 | 0 | 0 | 0 | 0 | 109.2 | Q137 | T135-Q137 HydrophobicContact CG2-CG 4.09Š| ||
| 136 | E | 40.1 | Very low | 55.2 | Low | 165 Ų | 165 | 83.7 Ų | 83.7 | 77% | 0.771 | 48% | 0.484 | S | S | * | . | trans | -97.1 | 107.9 | 152.1 | -75.8 | -160.2 | 163.8 | 0 | 0 | 107.7 | T134 S138 | T134-E136 PolarHBondContact O-N 3.01Å; E136-S138 VanDerWaalsContact C-N 3.33Å; E136-S138 PolarHBondContact O-N 3.01Å | ||
| 137 | Q | 38.9 | Very low | 54.6 | Low | 178 Ų | 178 | 84.8 Ų | 84.8 | 83% | 0.832 | 49% | 0.49 | S | S | * | . | trans | -68.2 | 91.1 | 172.6 | -75.2 | 177.2 | -18.3 | 0 | 0 | 108.6 | T135 G139 | T135-Q137 HydrophobicContact CG2-CG 4.09Å; Q137-G139 PolarHBondContact O-N 2.92Å | ||
| 138 | S | 40 | Very low | 54.1 | Low | 88 Ų | 88 | 84.9 Ų | 84.9 | 62% | 0.615 | 49% | 0.491 | S | S | * | . | trans | -71 | 80.9 | 163.1 | 173 | 0 | 0 | 0 | 0 | 108.4 | E136 K140 | E136-S138 VanDerWaalsContact C-N 3.33Å; E136-S138 PolarHBondContact O-N 3.01Å; S138-K140 VanDerWaalsContact C-N 3.26Å; S138-K140 PolarHBondContact O-N 3.36Å | ||
| 139 | G | 43.1 | Very low | 54 | Low | 71 Ų | 71 | 87.7 Ų | 87.7 | 73% | 0.732 | 50% | 0.5 | S | S | * | . | trans | -66.8 | 76.8 | 176 | 0 | 0 | 0 | 0 | 0 | 112.2 | Q137 | Q137-G139 PolarHBondContact O-N 2.92Š| ||
| 140 | K | 49.3 | Very low | 55.1 | Low | 131 Ų | 131 | 90 Ų | 90 | 57% | 0.57 | 51% | 0.506 | S | S | * | . | trans | -79 | 122.7 | 152.5 | -69.3 | -179 | -176.4 | 171.1 | 0 | 106.2 | S138 V142 Y407 | S138-K140 VanDerWaalsContact C-N 3.26Å; S138-K140 PolarHBondContact O-N 3.36Å; K140-V142 PolarHBondContact O-N 3.22Å; K140-Y407 HydrophobicContact CB-CE1 4.28Å | ||
| 141 | P | 51.6 | Low | 56.3 | Low | 109 Ų | 109 | 88.7 Ų | 88.7 | 71% | 0.708 | 50% | 0.495 | S | S | * | . | trans | -61.6 | 113.7 | -180 | 23.8 | -30.7 | 0 | 0 | 0 | 108.3 | M143 | P141-M143 PolarHBondContact O-N 3.15Š| ||
| 142 | V | 54.6 | Low | 57.4 | Low | 61 Ų | 61 | 86.3 Ų | 86.3 | 37% | 0.37 | 48% | 0.484 | S | S | . | . | P | Polyproline II helix | trans | -63.8 | 132.5 | 168 | -179 | 0 | 0 | 0 | 0 | 106.5 | K140 Y407 | K140-V142 PolarHBondContact O-N 3.22Å; V142-Y407 HydrophobicContact CG2-CD1 4Å |
| 143 | M | 61.2 | Low | 59.1 | Low | 26 Ų | 26 | 80 Ų | 80 | 13% | 0.128 | 46% | 0.462 | C | S | . | . | P | Polyproline II helix | trans | -56.9 | 145.1 | -178.8 | -159.8 | 157.4 | 109.8 | 0 | 0 | 110 | P141 S145 D147 A148 D151 | P141-M143 PolarHBondContact O-N 3.15Å; M143-S145 PolarHBondContact O-N 3.36Å; M143-D147 HydrophobicContact CE-CB 3.79Å; M143-D147 WeakPolarHBondContact CE-O 3.21Å; M143-D147 HydrophobicContact CG-CB 3.81Å; M143-D147 HydrophobicContact SD-CB 4.45Å; M143-A148 HydrophobicContact CE-CB 4.02Å; M143-D151 HydrophobicContact CE-CB 3.88Å; M143-D151 WeakPolarHBondContact CE-OD2 3.47Å |
| 144 | S | 70.5 | Confident | 61 | Low | 67 Ų | 67 | 76.4 Ų | 76.4 | 47% | 0.469 | 44% | 0.442 | S | S | . | . | P | Polyproline II helix | trans | -54.8 | 136.1 | 171.3 | 177 | 0 | 0 | 0 | 0 | 109.5 | A146 D147 A148 | S144-A146 PolarHBondContact O-N 3.49Å; S144-D147 WeakPolarHBondContact O-CA 3.28Å; S144-D147 WeakPolarHBondContact O-CB 3.47Å; S144-D147 PolarHBondContact O-N 2.67Å; S144-A148 PolarHBondContact O-N 3.39Å |
| 145 | S | 67.5 | Low | 62.8 | Low | 29 Ų | 29 | 71.4 Ų | 71.4 | 20% | 0.203 | 41% | 0.41 | C | S | . | . | H | α-helix | trans | -57.5 | -33.5 | -178.7 | -45 | 0 | 0 | 0 | 0 | 112.6 | M143 A148 L149 D410 | M143-S145 PolarHBondContact O-N 3.36Å; S145-A148 PolarHBondContact O-N 3.26Å; S145-L149 PolarHBondContact O-N 3.5Å; S145-D410 WeakPolarHBondContact CB-OD2 3.31Å; S145-D410 VanDerWaalsContact OG-CB 3.26Å; S145-D410 WeakPolarHBondContact OG-CB 3.35Å; S145-D410 PolarHBondContact OG-OD2 3.17Å |
| 146 | A | 73.4 | Confident | 64.9 | Low | 57 Ų | 57 | 68.3 Ų | 68.3 | 47% | 0.471 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -64.7 | -45.7 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.2 | S144 A148 L149 L150 | S144-A146 PolarHBondContact O-N 3.49Å; A146-A148 VanDerWaalsContact C-N 3.29Å; A146-A148 PolarHBondContact O-N 2.82Å; A146-L149 PolarHBondContact O-N 2.94Å; A146-L150 WeakPolarHBondContact O-CB 3.5Å; A146-L150 WeakPolarHBondContact O-CG 3.4Å; A146-L150 PolarHBondContact O-N 2.81Å |
| 147 | D | 76.6 | Confident | 67.2 | Low | 24 Ų | 24 | 67.6 Ų | 67.6 | 13% | 0.128 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -63.5 | -37.4 | 176.4 | -72.4 | -21.4 | 0 | 0 | 0 | 110.6 | M143 S144 L150 D151 T171 S221 | M143-D147 HydrophobicContact CE-CB 3.79Å; M143-D147 WeakPolarHBondContact CE-O 3.21Å; M143-D147 HydrophobicContact CG-CB 3.81Å; M143-D147 HydrophobicContact SD-CB 4.45Å; S144-D147 WeakPolarHBondContact O-CA 3.28Å; S144-D147 WeakPolarHBondContact O-CB 3.47Å; S144-D147 PolarHBondContact O-N 2.67Å; D147-L150 PolarHBondContact O-N 2.95Å; D147-D151 VanDerWaalsContact O-CB 3.3Å; D147-D151 WeakPolarHBondContact O-CB 3.49Å; D147-D151 VanDerWaalsContact O-CG 3.28Å; D147-D151 PolarHBondContact O-N 3.5Å; D147-T171 HydrophobicContact CB-CG2 4.31Å; D147-S221 PolarHBondContact OD2-OG 3.22Å |
| 148 | A | 70.4 | Confident | 69.4 | Low | 1 Ų | 1 | 61 Ų | 61 | 1% | 0.008 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -65 | -43.4 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | M143 S144 S145 A146 D151 L152 | M143-A148 HydrophobicContact CE-CB 4.02Å; S144-A148 PolarHBondContact O-N 3.39Å; S145-A148 PolarHBondContact O-N 3.26Å; A146-A148 VanDerWaalsContact C-N 3.29Å; A146-A148 PolarHBondContact O-N 2.82Å; A148-D151 PolarHBondContact O-N 3.38Å; A148-L152 WeakPolarHBondContact O-CB 3.33Å; A148-L152 PolarHBondContact O-N 3.05Å |
| 149 | L | 70.6 | Confident | 71.8 | Confident | 84 Ų | 84 | 62 Ų | 62 | 44% | 0.44 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -66.5 | -40.6 | 175.3 | -173.3 | 68.3 | 0 | 0 | 0 | 111.7 | S145 A146 L152 V153 | S145-L149 PolarHBondContact O-N 3.5Å; A146-L149 PolarHBondContact O-N 2.94Å; L149-L152 HydrophobicContact CD1-CD2 4.32Å; L149-L152 WeakPolarHBondContact O-CB 3.48Å; L149-L152 PolarHBondContact O-N 3.03Å; L149-V153 WeakPolarHBondContact O-CG2 3.26Å; L149-V153 PolarHBondContact O-N 2.83Å; L149-V153 VanDerWaalsContact O-N 3.13Å |
| 150 | L | 80.9 | Confident | 74.1 | Confident | 84 Ų | 84 | 62.3 Ų | 62.3 | 44% | 0.44 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -67.1 | -39.7 | 177.6 | -69.4 | 174.1 | 0 | 0 | 0 | 111.6 | A146 D147 L152 V153 R154 | A146-L150 WeakPolarHBondContact O-CB 3.5Å; A146-L150 WeakPolarHBondContact O-CG 3.4Å; A146-L150 PolarHBondContact O-N 2.81Å; D147-L150 PolarHBondContact O-N 2.95Å; L150-L152 VanDerWaalsContact C-N 3.34Å; L150-V153 PolarHBondContact O-N 3.26Å; L150-R154 VanDerWaalsContact CB-NH1 3.34Å; L150-R154 VanDerWaalsContact O-CG 3.27Å; L150-R154 WeakPolarHBondContact O-CG 3.27Å; L150-R154 PolarHBondContact O-N 3.42Å |
| 151 | D | 78.4 | Confident | 76.1 | Confident | 7 Ų | 7 | 59.1 Ų | 59.1 | 4% | 0.037 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -66.7 | -36.7 | 175.1 | -78.2 | 3.9 | 0 | 0 | 0 | 112.1 | M143 D147 A148 R154 N155 Y169 R170 T171 | M143-D151 HydrophobicContact CE-CB 3.88Å; M143-D151 WeakPolarHBondContact CE-OD2 3.47Å; D147-D151 VanDerWaalsContact O-CB 3.3Å; D147-D151 WeakPolarHBondContact O-CB 3.49Å; D147-D151 VanDerWaalsContact O-CG 3.28Å; D147-D151 PolarHBondContact O-N 3.5Å; A148-D151 PolarHBondContact O-N 3.38Å; D151-R154 PolarHBondContact O-N 2.97Å; D151-R154 IonicContact OD1-CZ 3.94Å; D151-R154 IonicContact OD1-NH1 2.79Å; D151-R154 PolarHBondContact OD1-NH1 3.27Å; D151-N155 VanDerWaalsContact O-CB 3.31Å; D151-N155 WeakPolarHBondContact O-CB 3.14Å; D151-N155 PolarHBondContact O-N 2.94Å; D151-N155 PolarHBondContact O-ND2 3.37Å; D151-Y169 WeakPolarHBondContact OD1-CD1 3.36Å; D151-Y169 VanDerWaalsContact OD1-CE1 3.23Å; D151-Y169 WeakPolarHBondContact OD1-CE1 3.37Å; D151-R170 WeakPolarHBondContact OD2-CA 3.36Å; D151-T171 VanDerWaalsContact CG-OG1 3.29Å; D151-T171 PolarHBondContact OD1-OG1 3.44Å; D151-T171 WeakPolarHBondContact OD2-CB 3.38Å; D151-T171 PolarHBondContact OD2-N 3.42Å; D151-T171 PolarHBondContact OD2-OG1 3.41Å |
| 152 | L | 73.9 | Confident | 78.1 | Confident | 9 Ų | 9 | 58.7 Ų | 58.7 | 5% | 0.047 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -55 | -53.6 | 171 | 179.3 | 72.3 | 0 | 0 | 0 | 110.4 | A148 L149 L150 R154 N155 M156 L232 T416 T420 | A148-L152 WeakPolarHBondContact O-CB 3.33Å; A148-L152 PolarHBondContact O-N 3.05Å; L149-L152 HydrophobicContact CD1-CD2 4.32Å; L149-L152 WeakPolarHBondContact O-CB 3.48Å; L149-L152 PolarHBondContact O-N 3.03Å; L150-L152 VanDerWaalsContact C-N 3.34Å; L152-R154 PolarHBondContact O-N 2.92Å; L152-N155 PolarHBondContact O-N 3.26Å; L152-N155 VanDerWaalsContact O-N 3.17Å; L152-M156 WeakPolarHBondContact O-CG 3.26Å; L152-M156 PolarHBondContact O-N 2.97Å; L152-L232 HydrophobicContact CD1-CD2 3.39Å; L152-L232 HydrophobicContact CG-CD2 4.26Å; L152-T416 HydrophobicContact CD1-CG2 4.26Å; L152-T416 HydrophobicContact CD2-CG2 4.17Å; L152-T420 HydrophobicContact CD1-CG2 3.24Å; L152-T420 HydrophobicContact CG-CG2 4.5Å |
| 153 | V | 80.8 | Confident | 79.8 | Confident | 72 Ų | 72 | 59.2 Ų | 59.2 | 44% | 0.436 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -63.2 | -40.5 | -179.5 | 176 | 0 | 0 | 0 | 0 | 111.8 | L149 L150 N155 M156 | L149-V153 WeakPolarHBondContact O-CG2 3.26Å; L149-V153 PolarHBondContact O-N 2.83Å; L149-V153 VanDerWaalsContact O-N 3.13Å; L150-V153 PolarHBondContact O-N 3.26Å; V153-N155 VanDerWaalsContact C-N 3.3Å; V153-N155 PolarHBondContact O-N 2.89Å; V153-M156 WeakPolarHBondContact O-CB 3.45Å; V153-M156 PolarHBondContact O-N 3.16Å |
| 154 | R | 83.7 | Confident | 80.9 | Confident | 95 Ų | 95 | 58.1 Ų | 58.1 | 36% | 0.358 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -62 | -39.6 | 174.9 | -71.5 | 171.3 | -170 | 123.5 | 2.3 | 111.7 | L150 D151 L152 M156 F157 Y169 | L150-R154 VanDerWaalsContact CB-NH1 3.34Å; L150-R154 VanDerWaalsContact O-CG 3.27Å; L150-R154 WeakPolarHBondContact O-CG 3.27Å; L150-R154 PolarHBondContact O-N 3.42Å; D151-R154 PolarHBondContact O-N 2.97Å; D151-R154 IonicContact OD1-CZ 3.94Å; D151-R154 IonicContact OD1-NH1 2.79Å; D151-R154 PolarHBondContact OD1-NH1 3.27Å; L152-R154 PolarHBondContact O-N 2.92Å; R154-M156 VanDerWaalsContact C-N 3.32Å; R154-F157 CarbonylContact O-C 3.59Å; R154-F157 VanDerWaalsContact O-C 3.3Å; R154-F157 PolarHBondContact O-N 3.24Å; R154-F157 VanDerWaalsContact O-O 3.12Å; R154-Y169 HydrophobicContact CB-CD1 4.21Å; R154-Y169 HydrophobicContact CB-CG 4.32Å |
| 155 | N | 76.9 | Confident | 81.5 | Confident | 17 Ų | 17 | 57.1 Ų | 57.1 | 9% | 0.091 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -73.2 | -23.6 | 177.4 | -76 | -48.2 | 0 | 0 | 0 | 112.8 | D151 L152 V153 F157 Y169 N230 G233 | D151-N155 VanDerWaalsContact O-CB 3.31Å; D151-N155 WeakPolarHBondContact O-CB 3.14Å; D151-N155 PolarHBondContact O-N 2.94Å; D151-N155 PolarHBondContact O-ND2 3.37Å; L152-N155 PolarHBondContact O-N 3.26Å; L152-N155 VanDerWaalsContact O-N 3.17Å; V153-N155 VanDerWaalsContact C-N 3.3Å; V153-N155 PolarHBondContact O-N 2.89Å; N155-F157 PolarHBondContact O-N 3.43Å; N155-Y169 PolarHBondContact ND2-O 2.83Å; N155-Y169 WeakPolarHBondContact OD1-CB 3.44Å; N155-Y169 PolarHBondContact OD1-N 2.99Å; N155-N230 PolarHBondContact O-ND2 2.94Å; N155-N230 PolarHBondContact O-OD1 2.96Å; N155-N230 PolarHBondContact OD1-ND2 3.26Å; N155-G233 WeakPolarHBondContact O-CA 3.36Å; N155-G233 PolarHBondContact O-N 3.21Å |
| 156 | M | 80.9 | Confident | 82.1 | Confident | 60 Ų | 60 | 60.8 Ų | 60.8 | 30% | 0.296 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -63 | -31 | 171 | -68.3 | 176.4 | 68 | 0 | 0 | 112.8 | L152 V153 R154 L232 I236 | L152-M156 WeakPolarHBondContact O-CG 3.26Å; L152-M156 PolarHBondContact O-N 2.97Å; V153-M156 WeakPolarHBondContact O-CB 3.45Å; V153-M156 PolarHBondContact O-N 3.16Å; R154-M156 VanDerWaalsContact C-N 3.32Å; M156-L232 HydrophobicContact CG-CD2 3.71Å; M156-L232 HydrophobicContact CG-CG 4.09Å; M156-I236 HydrophobicContact CB-CD1 3.45Å; M156-I236 VanDerWaalsContact CB-CD1 3.45Å; M156-I236 HydrophobicContact CE-CD1 3.52Å; M156-I236 HydrophobicContact CG-CD1 3.4Å; M156-I236 VanDerWaalsContact CG-CD1 3.4Å; M156-I236 HydrophobicContact SD-CD1 4.27Å |
| 157 | F | 87.4 | Confident | 82.5 | Confident | 150 Ų | 150 | 61.3 Ų | 61.3 | 66% | 0.658 | 33% | 0.326 | S | S | * | . | S | Bend | trans | -124 | 76.8 | -179.6 | -60.5 | -80.4 | 0 | 0 | 0 | 110.4 | R154 N155 | R154-F157 CarbonylContact O-C 3.59Å; R154-F157 VanDerWaalsContact O-C 3.3Å; R154-F157 PolarHBondContact O-N 3.24Å; R154-F157 VanDerWaalsContact O-O 3.12Å; N155-F157 PolarHBondContact O-N 3.43Å |
| 158 | P | 85.9 | Confident | 82.4 | Confident | 39 Ų | 39 | 61 Ų | 61 | 25% | 0.253 | 32% | 0.324 | S | S | . | . | trans | -63.2 | 141.1 | -178.2 | 26.2 | -33.2 | 0 | 0 | 0 | 111.1 | N160 A164 | P158-N160 PolarHBondContact O-N 3.27Å; P158-A164 HydrophobicContact CB-CB 3.76Å; P158-A164 HydrophobicContact CG-CB 4.01Å | ||
| 159 | A | 89.4 | Confident | 82.8 | Confident | 108 Ų | 108 | 64.2 Ų | 64.2 | 89% | 0.893 | 34% | 0.336 | S | S | * | . | S | Bend | trans | -62.8 | -28.1 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||
| 160 | N | 93.1 | Very high | 83.2 | Confident | 78 Ų | 78 | 65.2 Ų | 65.2 | 42% | 0.417 | 33% | 0.334 | S | S | . | . | trans | -145.9 | 129.2 | 176.8 | -176.5 | -57.7 | 0 | 0 | 0 | 110.2 | P158 V162 E163 A164 | P158-N160 PolarHBondContact O-N 3.27Å; N160-V162 WeakPolarHBondContact OD1-CA 3.38Å; N160-V162 WeakPolarHBondContact OD1-CB 3.21Å; N160-V162 PolarHBondContact OD1-N 3.46Å; N160-E163 HydrophobicContact CB-CB 3.86Å; N160-E163 PolarHBondContact OD1-N 3.04Å; N160-A164 WeakPolarHBondContact O-CB 3.37Å; N160-A164 PolarHBondContact O-N 3.32Å | ||
| 161 | L | 90.3 | Very high | 83.2 | Confident | 64 Ų | 64 | 61.6 Ų | 61.6 | 34% | 0.335 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -71.3 | -34.6 | -177.3 | -171.8 | 67.9 | 0 | 0 | 0 | 112.9 | A164 T165 I234 F237 | L161-A164 WeakPolarHBondContact O-CB 3.46Å; L161-A164 PolarHBondContact O-N 3.48Å; L161-T165 WeakPolarHBondContact O-CG2 3.4Å; L161-T165 PolarHBondContact O-N 2.67Å; L161-I234 HydrophobicContact CD1-CG1 4.45Å; L161-F237 HydrophobicContact CD1-CB 4.01Å; L161-F237 HydrophobicContact CD1-CD1 3.81Å; L161-F237 HydrophobicContact CD1-CD2 4.46Å; L161-F237 HydrophobicContact CD1-CE1 4.46Å; L161-F237 HydrophobicContact CD1-CG 3.81Å; L161-F237 HydrophobicContact CD2-CD1 3.53Å; L161-F237 HydrophobicContact CD2-CD2 4.35Å; L161-F237 HydrophobicContact CD2-CE1 3.31Å; L161-F237 HydrophobicContact CD2-CE2 4.16Å; L161-F237 HydrophobicContact CD2-CG 4.06Å; L161-F237 HydrophobicContact CD2-CZ 3.65Å; L161-F237 HydrophobicContact CG-CD1 4.34Å |
| 162 | V | 93.6 | Very high | 83.3 | Confident | 100 Ų | 100 | 67.9 Ų | 67.9 | 61% | 0.606 | 34% | 0.343 | S | S | * | . | H | α-helix | trans | -69 | -44.8 | 176.4 | -177.2 | 0 | 0 | 0 | 0 | 109.6 | N160 A164 T165 F166 | N160-V162 WeakPolarHBondContact OD1-CA 3.38Å; N160-V162 WeakPolarHBondContact OD1-CB 3.21Å; N160-V162 PolarHBondContact OD1-N 3.46Å; V162-A164 VanDerWaalsContact C-N 3.28Å; V162-A164 PolarHBondContact O-N 3.23Å; V162-T165 WeakPolarHBondContact O-CB 3.47Å; V162-T165 PolarHBondContact O-N 3.44Å; V162-T165 VanDerWaalsContact O-N 3.07Å; V162-T165 PolarHBondContact O-OG1 3.08Å; V162-F166 HydrophobicContact CG1-CE1 4.48Å; V162-F166 WeakPolarHBondContact O-CD1 3.35Å; V162-F166 VanDerWaalsContact O-CE1 3.26Å; V162-F166 WeakPolarHBondContact O-CE1 3.32Å |
| 163 | E | 90.4 | Very high | 83.3 | Confident | 72 Ų | 72 | 69.7 Ų | 69.7 | 34% | 0.336 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -60.4 | -39.2 | 174.3 | -175.3 | 171.6 | -162.3 | 0 | 0 | 111.9 | N160 T165 F166 K167 | N160-E163 HydrophobicContact CB-CB 3.86Å; N160-E163 PolarHBondContact OD1-N 3.04Å; E163-T165 PolarHBondContact O-N 3.11Å; E163-F166 HydrophobicContact CB-CZ 4.42Å; E163-F166 HydrophobicContact CG-CE2 4.46Å; E163-F166 HydrophobicContact CG-CZ 4.37Å; E163-F166 PolarHBondContact O-N 3.36Å; E163-K167 HydrophobicContact CG-CB 3.93Å; E163-K167 HydrophobicContact CG-CD 4.08Å; E163-K167 PolarHBondContact O-N 3.46Å; E163-K167 WeakPolarHBondContact OE1-CD 3.46Å |
| 164 | A | 84.2 | Confident | 83 | Confident | 3 Ų | 3 | 67.7 Ų | 67.7 | 3% | 0.025 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -58 | -20.6 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | P158 N160 L161 V162 F166 K167 M229 N230 I234 | P158-A164 HydrophobicContact CB-CB 3.76Å; P158-A164 HydrophobicContact CG-CB 4.01Å; N160-A164 WeakPolarHBondContact O-CB 3.37Å; N160-A164 PolarHBondContact O-N 3.32Å; L161-A164 WeakPolarHBondContact O-CB 3.46Å; L161-A164 PolarHBondContact O-N 3.48Å; V162-A164 VanDerWaalsContact C-N 3.28Å; V162-A164 PolarHBondContact O-N 3.23Å; A164-F166 VanDerWaalsContact C-N 3.26Å; A164-F166 PolarHBondContact O-N 3.11Å; A164-K167 WeakPolarHBondContact CA-O 3.43Å; A164-M229 CarbonylContact O-C 3.07Å; A164-N230 HydrophobicContact CB-CB 4.11Å; A164-N230 PolarHBondContact O-N 3.35Å; A164-I234 HydrophobicContact CB-CG1 4.44Å |
| 165 | T | 82.8 | Confident | 82.6 | Confident | 46 Ų | 46 | 67 Ų | 67 | 28% | 0.282 | 35% | 0.35 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -71.2 | -19 | 176.4 | 68.8 | 0 | 0 | 0 | 0 | 113.6 | L76 L161 V162 E163 M229 I234 | L76-T165 HydrophobicContact CD1-CG2 4.01Å; L76-T165 HydrophobicContact CD2-CG2 3.75Å; L161-T165 WeakPolarHBondContact O-CG2 3.4Å; L161-T165 PolarHBondContact O-N 2.67Å; V162-T165 WeakPolarHBondContact O-CB 3.47Å; V162-T165 PolarHBondContact O-N 3.44Å; V162-T165 VanDerWaalsContact O-N 3.07Å; V162-T165 PolarHBondContact O-OG1 3.08Å; E163-T165 PolarHBondContact O-N 3.11Å; T165-M229 WeakPolarHBondContact O-CB 3.31Å; T165-M229 WeakPolarHBondContact O-CG 3.45Å; T165-I234 HydrophobicContact CG2-CD1 4.41Å |
| 166 | F | 80.9 | Confident | 82.4 | Confident | 107 Ų | 107 | 69.3 Ų | 69.3 | 47% | 0.469 | 37% | 0.365 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -138 | -7.5 | -177.4 | 59.9 | -91.9 | 0 | 0 | 0 | 115.3 | V162 E163 A164 G228 | V162-F166 HydrophobicContact CG1-CE1 4.48Å; V162-F166 WeakPolarHBondContact O-CD1 3.35Å; V162-F166 VanDerWaalsContact O-CE1 3.26Å; V162-F166 WeakPolarHBondContact O-CE1 3.32Å; E163-F166 HydrophobicContact CB-CZ 4.42Å; E163-F166 HydrophobicContact CG-CE2 4.46Å; E163-F166 HydrophobicContact CG-CZ 4.37Å; E163-F166 PolarHBondContact O-N 3.36Å; A164-F166 VanDerWaalsContact C-N 3.26Å; A164-F166 PolarHBondContact O-N 3.11Å; F166-G228 CarbonylContact C-O 3.52Å; F166-G228 VanDerWaalsContact C-O 3.24Å; F166-G228 CarbonylContact O-C 3.3Å; F166-G228 PolarHBondContact O-N 3.05Å |
| 167 | K | 81.8 | Confident | 82 | Confident | 67 Ų | 67 | 71.6 Ų | 71.6 | 29% | 0.291 | 38% | 0.377 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -134 | 151.7 | 175.3 | -75.6 | 174.3 | -177.7 | -179.4 | 0 | 112.2 | E163 A164 G228 N230 | E163-K167 HydrophobicContact CG-CB 3.93Å; E163-K167 HydrophobicContact CG-CD 4.08Å; E163-K167 PolarHBondContact O-N 3.46Å; E163-K167 WeakPolarHBondContact OE1-CD 3.46Å; A164-K167 WeakPolarHBondContact CA-O 3.43Å; K167-G228 CarbonylContact C-O 3.57Å; K167-G228 WeakPolarHBondContact CA-O 3.46Å; K167-G228 PolarHBondContact N-O 3.22Å; K167-G228 VanDerWaalsContact N-O 3.12Å; K167-N230 WeakPolarHBondContact O-CB 3.42Å |
| 168 | Q | 73.4 | Confident | 80.9 | Confident | 18 Ų | 18 | 69.5 Ų | 69.5 | 8% | 0.084 | 37% | 0.368 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -132.7 | 151.5 | 172.5 | 69 | -171.9 | -4.3 | 0 | 0 | 111.1 | T225 S226 G228 N230 T444 | Q168-T225 WeakPolarHBondContact O-CA 3.32Å; Q168-S226 WeakPolarHBondContact CG-OG 3.33Å; Q168-S226 PolarHBondContact N-O 3.21Å; Q168-S226 PolarHBondContact NE2-OG 2.92Å; Q168-S226 PolarHBondContact O-N 2.7Å; Q168-G228 PolarHBondContact N-O 3.45Å; Q168-N230 HydrophobicContact CB-CB 3.79Å; Q168-T444 PolarHBondContact OE1-OG1 3.23Å |
| 169 | Y | 80.1 | Confident | 79.6 | Confident | 69 Ų | 69 | 71.8 Ų | 71.8 | 27% | 0.271 | 38% | 0.384 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -73.1 | 131.8 | 177.8 | -168.9 | -84.5 | 0 | 0 | 0 | 110 | D151 R154 N155 P223 | D151-Y169 WeakPolarHBondContact OD1-CD1 3.36Å; D151-Y169 VanDerWaalsContact OD1-CE1 3.23Å; D151-Y169 WeakPolarHBondContact OD1-CE1 3.37Å; R154-Y169 HydrophobicContact CB-CD1 4.21Å; R154-Y169 HydrophobicContact CB-CG 4.32Å; N155-Y169 PolarHBondContact ND2-O 2.83Å; N155-Y169 WeakPolarHBondContact OD1-CB 3.44Å; N155-Y169 PolarHBondContact OD1-N 2.99Å; Y169-P223 HydrophobicContact CE2-CB 4.24Å; Y169-P223 WeakPolarHBondContact OH-CA 3.33Å; Y169-P223 WeakPolarHBondContact OH-CB 3.22Å |
| 170 | R | 78.5 | Confident | 77.9 | Confident | 104 Ų | 104 | 71.1 Ų | 71.1 | 39% | 0.392 | 37% | 0.371 | S | S | . | . | trans | -145.7 | 120.9 | 175.8 | -171.7 | 174.7 | -177.4 | 160.6 | 5.3 | 110.5 | D151 K172 G224 G447 | D151-R170 WeakPolarHBondContact OD2-CA 3.36Å; R170-K172 PolarHBondContact O-N 3.5Å; R170-G224 CarbonylContact C-O 3.56Å; R170-G224 PolarHBondContact N-O 2.9Å; R170-G224 CarbonylContact O-C 3.5Å; R170-G224 WeakPolarHBondContact O-CA 3.44Å; R170-G224 PolarHBondContact O-N 3.05Å; R170-G224 VanDerWaalsContact O-N 3.15Å; R170-G447 PolarHBondContact NH2-O 3.47Å | ||
| 171 | T | 81.7 | Confident | 75.9 | Confident | 9 Ų | 9 | 79.2 Ų | 79.2 | 6% | 0.055 | 40% | 0.396 | C | S | . | . | trans | -66.6 | 124.2 | 175.6 | -65.9 | 0 | 0 | 0 | 0 | 109.3 | D147 D151 | D147-T171 HydrophobicContact CB-CG2 4.31Å; D151-T171 VanDerWaalsContact CG-OG1 3.29Å; D151-T171 PolarHBondContact OD1-OG1 3.44Å; D151-T171 WeakPolarHBondContact OD2-CB 3.38Å; D151-T171 PolarHBondContact OD2-N 3.42Å; D151-T171 PolarHBondContact OD2-OG1 3.41Å | ||
| 172 | K | 79.2 | Confident | 74 | Confident | 139 Ų | 139 | 79.7 Ų | 79.7 | 60% | 0.604 | 42% | 0.416 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -98.3 | 118.5 | 175.9 | -171.6 | 178.9 | -179.9 | -179.2 | 0 | 108.6 | R170 T174 E222 | R170-K172 PolarHBondContact O-N 3.5Å; K172-T174 HydrophobicContact CD-CG2 4.3Å; K172-T174 HydrophobicContact CG-CG2 4.22Å; K172-T174 PolarHBondContact O-N 3.48Å; K172-E222 PolarHBondContact N-O 3.07Å; K172-E222 PolarHBondContact O-N 3.11Å |
| 173 | T | 74.2 | Confident | 71.7 | Confident | 46 Ų | 46 | 77.6 Ų | 77.6 | 28% | 0.282 | 41% | 0.409 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -85 | 112.3 | 173.8 | -46.2 | 0 | 0 | 0 | 0 | 109.2 | Y219 | T173-Y219 HydrophobicContact CG2-CD1 3.76Å; T173-Y219 HydrophobicContact CG2-CG 4.11Å |
| 174 | T | 75.3 | Confident | 69.6 | Low | 31 Ų | 31 | 78.2 Ų | 78.2 | 19% | 0.19 | 43% | 0.427 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.7 | 128.6 | 175.4 | 52.9 | 0 | 0 | 0 | 0 | 109.9 | K172 V176 K220 | K172-T174 HydrophobicContact CD-CG2 4.3Å; K172-T174 HydrophobicContact CG-CG2 4.22Å; K172-T174 PolarHBondContact O-N 3.48Å; T174-V176 PolarHBondContact O-N 2.9Å; T174-K220 PolarHBondContact N-O 3.44Å; T174-K220 PolarHBondContact O-N 3.39Å; T174-K220 PolarHBondContact OG1-O 3.19Å |
| 175 | P | 74.5 | Confident | 68.1 | Low | 81 Ų | 81 | 87.3 Ų | 87.3 | 53% | 0.526 | 47% | 0.469 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -72.8 | 114.6 | 174 | 28.5 | -31.4 | 0 | 0 | 0 | 108.7 | I217 Y219 | P175-I217 HydrophobicContact CB-CG2 3.67Å; P175-Y219 HydrophobicContact CB-CD1 4.3Å; P175-Y219 HydrophobicContact CB-CE1 4.15Å |
| 176 | V | 73.4 | Confident | 66.6 | Low | 65 Ų | 65 | 93.8 Ų | 93.8 | 39% | 0.394 | 50% | 0.496 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -95.7 | 110 | 173.2 | -176.9 | 0 | 0 | 0 | 0 | 107.7 | T174 K178 V218 K220 | T174-V176 PolarHBondContact O-N 2.9Å; V176-K178 PolarHBondContact O-N 3.45Å; V176-V218 WeakPolarHBondContact CA-O 3.38Å; V176-V218 WeakPolarHBondContact CB-O 3.39Å; V176-V218 PolarHBondContact N-O 2.97Å; V176-V218 PolarHBondContact O-N 3.4Å; V176-K220 HydrophobicContact CG2-CB 3.76Å; V176-K220 HydrophobicContact CG2-CD 4.3Å |
| 177 | I | 71.9 | Confident | 65.2 | Low | 107 Ų | 107 | 91.2 Ų | 91.2 | 55% | 0.549 | 50% | 0.495 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -69.8 | 111.6 | 172.3 | -59.2 | 175 | 0 | 0 | 0 | 107 | S179 P215 | I177-S179 PolarHBondContact O-N 3.34Å; I177-P215 HydrophobicContact CG2-CB 3.85Å; I177-P215 HydrophobicContact CG2-CG 4.41Å |
| 178 | K | 64.8 | Low | 63.7 | Low | 107 Ų | 107 | 93.8 Ų | 93.8 | 47% | 0.465 | 52% | 0.518 | S | S | . | . | trans | -70.6 | 101 | 166.8 | -78 | -179.1 | -178.2 | 163.1 | 0 | 107.5 | V176 E216 V218 | V176-K178 PolarHBondContact O-N 3.45Å; K178-E216 PolarHBondContact N-O 2.97Å; K178-E216 IonicContact NZ-OE1 2.85Å; K178-E216 PolarHBondContact NZ-OE1 3.38Å; K178-V218 HydrophobicContact CD-CG2 3.88Å; K178-V218 VanDerWaalsContact CE-CG2 3.45Å; K178-V218 HydrophobicContact CG-CG2 4.27Å | ||
| 179 | S | 57.7 | Low | 62.9 | Low | 86 Ų | 86 | 101.6 Ų | 101.6 | 60% | 0.601 | 55% | 0.547 | S | S | * | . | trans | -60.1 | 133.2 | 162.2 | -82.3 | 0 | 0 | 0 | 0 | 108.1 | I177 R181 | I177-S179 PolarHBondContact O-N 3.34Å; S179-R181 PolarHBondContact O-N 2.94Å | ||
| 180 | P | 54.9 | Low | 61.9 | Low | 94 Ų | 94 | 107.9 Ų | 107.9 | 61% | 0.61 | 57% | 0.57 | S | S | * | * | trans | -70.8 | 74.1 | 175.1 | 28.6 | -31.9 | 0 | 0 | 0 | 109.4 | G182 A183 | P180-G182 PolarHBondContact O-N 3.2Å; P180-A183 HydrophobicContact CB-CB 4.26Å | ||
| 181 | R | 50.5 | Low | 61.1 | Low | 248 Ų | 248 | 107.6 Ų | 107.6 | 94% | 0.936 | 58% | 0.575 | S | S | * | * | S | Bend | trans | -77.6 | 77.8 | 166.3 | -78.3 | -175.2 | 175 | 175.1 | -0.8 | 107.3 | S179 | S179-R181 PolarHBondContact O-N 2.94Š|
| 182 | G | 50.9 | Low | 60.3 | Low | 74 Ų | 74 | 110.5 Ų | 110.5 | 76% | 0.763 | 59% | 0.593 | S | S | * | * | S | Bend | trans | 147.7 | -17.2 | 172.9 | 0 | 0 | 0 | 0 | 0 | 115.8 | P180 | P180-G182 PolarHBondContact O-N 3.2Š|
| 183 | A | 45.5 | Very low | 59.8 | Low | 57 Ų | 57 | 109.3 Ų | 109.3 | 47% | 0.471 | 59% | 0.592 | S | S | . | * | trans | -108.4 | 21.5 | -176.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | P180 E185 | P180-A183 HydrophobicContact CB-CB 4.26Å; A183-E185 PolarHBondContact O-N 3.48Å | ||
| 184 | A | 46.4 | Very low | 59.4 | Low | 85 Ų | 85 | 112.7 Ų | 112.7 | 70% | 0.702 | 60% | 0.6 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.4 | -8.2 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||
| 185 | E | 52.1 | Low | 59.1 | Low | 193 Ų | 193 | 113.2 Ų | 113.2 | 90% | 0.902 | 61% | 0.612 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -102.8 | -16.8 | -178.6 | -75 | -174.7 | 151.7 | 0 | 0 | 115 | A183 | A183-E185 PolarHBondContact O-N 3.48Š|
| 186 | E | 50.6 | Low | 58.8 | Low | 182 Ų | 182 | 112.9 Ų | 112.9 | 85% | 0.85 | 61% | 0.609 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -129.9 | -1.1 | -171.1 | -72.4 | -171.6 | 161.1 | 0 | 0 | 116.9 | ||
| 187 | A | 50.8 | Low | 58.5 | Low | 54 Ų | 54 | 115.6 Ų | 115.6 | 45% | 0.446 | 62% | 0.617 | S | S | . | * | S | Bend | trans | -71.4 | 125.9 | 172.3 | 0 | 0 | 0 | 0 | 0 | 109.9 | R189 | A187-R189 PolarHBondContact O-N 2.92Š|
| 188 | P | 51.2 | Low | 58.3 | Low | 121 Ų | 121 | 116.8 Ų | 116.8 | 79% | 0.786 | 62% | 0.62 | S | S | * | * | trans | -65.9 | 104.4 | 179.3 | 26.1 | -31.9 | 0 | 0 | 0 | 108.7 | R190 | P188-R190 PolarHBondContact O-N 3.34Š| ||
| 189 | R | 57.5 | Low | 58.3 | Low | 181 Ų | 181 | 119.6 Ų | 119.6 | 68% | 0.683 | 64% | 0.64 | S | S | * | * | trans | -55.9 | 109.9 | 172.8 | -68.9 | -173.8 | -177.2 | 163.9 | 0.9 | 108.2 | A187 I191 | A187-R189 PolarHBondContact O-N 2.92Å; R189-I191 VanDerWaalsContact C-N 3.34Å; R189-I191 HydrophobicContact CB-CG1 4.31Å; R189-I191 PolarHBondContact O-N 3.17Å; R189-I191 VanDerWaalsContact O-N 3.09Å | ||
| 190 | R | 57.8 | Low | 58.5 | Low | 201 Ų | 201 | 123.8 Ų | 123.8 | 76% | 0.758 | 66% | 0.656 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -86.2 | 83.3 | -179.5 | -133.2 | -179.9 | -172.9 | -178.8 | 2.1 | 107.7 | P188 V192 | P188-R190 PolarHBondContact O-N 3.34Å; R190-V192 PolarHBondContact O-N 3.46Å |
| 191 | I | 61.8 | Low | 58.8 | Low | 99 Ų | 99 | 120.7 Ų | 120.7 | 51% | 0.508 | 64% | 0.641 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -77.8 | 113.1 | 178.5 | -55.6 | 175.5 | 0 | 0 | 0 | 108.1 | R189 I193 A208 | R189-I191 VanDerWaalsContact C-N 3.34Å; R189-I191 HydrophobicContact CB-CG1 4.31Å; R189-I191 PolarHBondContact O-N 3.17Å; R189-I191 VanDerWaalsContact O-N 3.09Å; I191-I193 HydrophobicContact CG2-CG1 4.05Å; I191-A208 HydrophobicContact CG2-CB 3.91Å |
| 192 | V | 65.8 | Low | 59.3 | Low | 70 Ų | 70 | 114.5 Ų | 114.5 | 42% | 0.424 | 64% | 0.636 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -98.2 | 115.3 | 173.2 | -178.3 | 0 | 0 | 0 | 0 | 107.7 | R190 L209 L211 | R190-V192 PolarHBondContact O-N 3.46Å; V192-L209 PolarHBondContact N-O 3.45Å; V192-L209 VanDerWaalsContact N-O 3.1Å; V192-L209 PolarHBondContact O-N 3.45Å; V192-L211 HydrophobicContact CG2-CD1 3.83Å |
| 193 | I | 68.8 | Low | 59.6 | Low | 114 Ų | 114 | 120.4 Ų | 120.4 | 59% | 0.585 | 64% | 0.635 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -98.4 | 119.4 | 175.9 | -54 | 176.2 | 0 | 0 | 0 | 107.6 | I191 N206 F207 A208 | I191-I193 HydrophobicContact CG2-CG1 4.05Å; I193-N206 HydrophobicContact CG2-CB 3.95Å; I193-F207 WeakPolarHBondContact CA-O 3.26Å; I193-A208 HydrophobicContact CG1-CB 4.41Å |
| 194 | Y | 65.6 | Low | 60.6 | Low | 116 Ų | 116 | 121.2 Ų | 121.2 | 46% | 0.455 | 63% | 0.634 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -122.1 | 136 | 170.6 | 66.6 | -83.5 | 0 | 0 | 0 | 109.8 | V196 F207 L209 | Y194-V196 HydrophobicContact CD2-CG2 3.9Å; Y194-V196 HydrophobicContact CE2-CG2 3.71Å; Y194-F207 HydrophobicContact CE1-CB 4.3Å; Y194-F207 PolarHBondContact N-O 3.31Å; Y194-F207 VanDerWaalsContact N-O 3.15Å; Y194-F207 PolarHBondContact O-N 2.92Å; Y194-L209 HydrophobicContact CE1-CD1 4.18Å |
| 195 | G | 67.8 | Low | 61.7 | Low | 43 Ų | 43 | 122.6 Ų | 122.6 | 44% | 0.443 | 63% | 0.626 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -92.1 | 123.2 | 177.6 | 0 | 0 | 0 | 0 | 0 | 109.6 | Q205 N206 | G195-Q205 WeakPolarHBondContact CA-O 3.3Å; G195-N206 WeakPolarHBondContact CA-OD1 3.21Å |
| 196 | V | 69.1 | Low | 62.7 | Low | 74 Ų | 74 | 118.7 Ų | 118.7 | 45% | 0.448 | 61% | 0.611 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -94.7 | 121.4 | 168 | -176.7 | 0 | 0 | 0 | 0 | 107 | Y194 Q205 F207 | Y194-V196 HydrophobicContact CD2-CG2 3.9Å; Y194-V196 HydrophobicContact CE2-CG2 3.71Å; V196-Q205 PolarHBondContact N-O 3.44Å; V196-Q205 PolarHBondContact O-N 3.29Å; V196-F207 HydrophobicContact CB-CE2 4.23Å; V196-F207 HydrophobicContact CG2-CD2 4.05Å; V196-F207 HydrophobicContact CG2-CE2 4.12Å |
| 197 | Q | 68.1 | Low | 63.8 | Low | 121 Ų | 121 | 114.2 Ų | 114.2 | 57% | 0.565 | 59% | 0.589 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -100.3 | 124.5 | 175.9 | -172.8 | 158.4 | 5.4 | 0 | 0 | 108.6 | V204 | Q197-V204 HydrophobicContact CB-CG2 4.32Å; Q197-V204 HydrophobicContact CG-CG2 4.25Å |
| 198 | E | 66.6 | Low | 64.5 | Low | 132 Ų | 132 | 115.1 Ų | 115.1 | 62% | 0.617 | 60% | 0.596 | S | S | * | * | P | Polyproline II helix | trans | -69.6 | 137 | 175.8 | -75.2 | 179.1 | 161.7 | 0 | 0 | 110.3 | N200 G201 | E198-N200 PolarHBondContact O-N 3.45Å; E198-G201 PolarHBondContact O-N 2.97Å; E198-G201 VanDerWaalsContact O-N 3.13Å |
| 199 | D | 63.9 | Low | 65.1 | Low | 167 Ų | 167 | 113.2 Ų | 113.2 | 89% | 0.893 | 58% | 0.579 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.5 | -1.7 | -169.3 | -77.4 | -29.6 | 0 | 0 | 0 | 116.2 | ||
| 200 | N | 62.4 | Low | 65.4 | Low | 174 Ų | 174 | 108.8 Ų | 108.8 | 93% | 0.93 | 57% | 0.569 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -148.2 | 21.4 | 175.1 | -105.9 | -16.9 | 0 | 0 | 0 | 115 | E198 | E198-N200 PolarHBondContact O-N 3.45Š|
| 201 | G | 60.8 | Low | 65.5 | Low | 29 Ų | 29 | 103.6 Ų | 103.6 | 30% | 0.299 | 56% | 0.556 | S | S | . | * | trans | -132.6 | 145.6 | -179.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | E198 R203 | E198-G201 PolarHBondContact O-N 2.97Å; E198-G201 VanDerWaalsContact O-N 3.13Å; G201-R203 PolarHBondContact O-N 2.98Å | ||
| 202 | S | 61.7 | Low | 65.4 | Low | 118 Ų | 118 | 104.8 Ų | 104.8 | 83% | 0.825 | 57% | 0.568 | S | S | * | * | S | Bend | trans | -75.9 | 9.7 | 173.4 | 66.2 | 0 | 0 | 0 | 0 | 113.7 | ||
| 203 | R | 57.9 | Low | 65.3 | Low | 198 Ų | 198 | 105.7 Ų | 105.7 | 75% | 0.747 | 58% | 0.575 | S | S | * | * | trans | -95.5 | 113.1 | -179.6 | -80.7 | 176.4 | 67.8 | 154 | -2 | 109.6 | G201 | G201-R203 PolarHBondContact O-N 2.98Š| ||
| 204 | V | 65.7 | Low | 65 | Low | 74 Ų | 74 | 105.9 Ų | 105.9 | 45% | 0.448 | 58% | 0.584 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -92.4 | 123.8 | 170.1 | -178.3 | 0 | 0 | 0 | 0 | 108.2 | Q197 | Q197-V204 HydrophobicContact CB-CG2 4.32Å; Q197-V204 HydrophobicContact CG-CG2 4.25Å |
| 205 | Q | 70.6 | Confident | 64.9 | Low | 114 Ų | 114 | 104 Ų | 104 | 53% | 0.533 | 59% | 0.586 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -100.9 | 116.8 | 175.2 | -145.4 | 169.7 | 19.9 | 0 | 0 | 108.8 | G195 V196 F207 | G195-Q205 WeakPolarHBondContact CA-O 3.3Å; V196-Q205 PolarHBondContact N-O 3.44Å; V196-Q205 PolarHBondContact O-N 3.29Å; Q205-F207 HydrophobicContact CB-CE2 3.98Å; Q205-F207 HydrophobicContact CB-CZ 4.32Å; Q205-F207 HydrophobicContact CG-CE2 4.3Å; Q205-F207 HydrophobicContact CG-CZ 4.18Å; Q205-F207 WeakPolarHBondContact O-CD2 3.39Å |
| 206 | N | 72.9 | Confident | 64.6 | Low | 110 Ų | 110 | 107.7 Ų | 107.7 | 59% | 0.588 | 59% | 0.592 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -89.6 | 124.9 | -177.9 | -67.9 | -28.4 | 0 | 0 | 0 | 109.9 | I193 G195 | I193-N206 HydrophobicContact CG2-CB 3.95Å; G195-N206 WeakPolarHBondContact CA-OD1 3.21Å |
| 207 | F | 73.1 | Confident | 64.6 | Low | 88 Ų | 88 | 108.2 Ų | 108.2 | 39% | 0.386 | 59% | 0.591 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -108.7 | 131.5 | 173.2 | -62.4 | -87.1 | 0 | 0 | 0 | 109.1 | I193 Y194 V196 Q205 | I193-F207 WeakPolarHBondContact CA-O 3.26Å; Y194-F207 HydrophobicContact CE1-CB 4.3Å; Y194-F207 PolarHBondContact N-O 3.31Å; Y194-F207 VanDerWaalsContact N-O 3.15Å; Y194-F207 PolarHBondContact O-N 2.92Å; V196-F207 HydrophobicContact CB-CE2 4.23Å; V196-F207 HydrophobicContact CG2-CD2 4.05Å; V196-F207 HydrophobicContact CG2-CE2 4.12Å; Q205-F207 HydrophobicContact CB-CE2 3.98Å; Q205-F207 HydrophobicContact CB-CZ 4.32Å; Q205-F207 HydrophobicContact CG-CE2 4.3Å; Q205-F207 HydrophobicContact CG-CZ 4.18Å; Q205-F207 WeakPolarHBondContact O-CD2 3.39Å |
| 208 | A | 66.3 | Low | 64.7 | Low | 73 Ų | 73 | 105 Ų | 105 | 60% | 0.603 | 58% | 0.58 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -99.8 | 114.8 | 175.1 | 0 | 0 | 0 | 0 | 0 | 109 | I191 I193 | I191-A208 HydrophobicContact CG2-CB 3.91Å; I193-A208 HydrophobicContact CG1-CB 4.41Å |
| 209 | L | 63 | Low | 65 | Low | 81 Ų | 81 | 105.9 Ų | 105.9 | 42% | 0.424 | 58% | 0.578 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -95.3 | 119.3 | 173.4 | -134.3 | 83 | 0 | 0 | 0 | 108.9 | V192 Y194 L211 | V192-L209 PolarHBondContact N-O 3.45Å; V192-L209 VanDerWaalsContact N-O 3.1Å; V192-L209 PolarHBondContact O-N 3.45Å; Y194-L209 HydrophobicContact CE1-CD1 4.18Å; L209-L211 HydrophobicContact CD2-CD2 4.07Å |
| 210 | D | 63 | Low | 65.6 | Low | 89 Ų | 89 | 103.1 Ų | 103.1 | 48% | 0.476 | 56% | 0.559 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -89.5 | 104.3 | 172.1 | -162.3 | -0.6 | 0 | 0 | 0 | 108.8 | T212 | D210-T212 PolarHBondContact O-N 3.22Å |
| 211 | L | 60.2 | Low | 66.4 | Low | 92 Ų | 92 | 97.5 Ų | 97.5 | 48% | 0.482 | 53% | 0.533 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -84.6 | 97.8 | -179.5 | -69.6 | 170.1 | 0 | 0 | 0 | 109.5 | V192 L209 | V192-L211 HydrophobicContact CG2-CD1 3.83Å; L209-L211 HydrophobicContact CD2-CD2 4.07Å |
| 212 | T | 60.8 | Low | 67.3 | Low | 124 Ų | 124 | 99.6 Ų | 99.6 | 76% | 0.761 | 54% | 0.535 | S | S | * | . | P | Polyproline II helix | trans | -61.2 | 126.5 | 170.3 | -50.2 | 0 | 0 | 0 | 0 | 109.4 | D210 | D210-T212 PolarHBondContact O-N 3.22Š|
| 213 | P | 63.2 | Low | 68.3 | Low | 88 Ų | 88 | 99 Ų | 99 | 57% | 0.571 | 53% | 0.528 | S | S | * | . | P | Polyproline II helix | trans | -59.8 | 144 | 175.8 | 23.5 | -31.5 | 0 | 0 | 0 | 110.2 | ||
| 214 | P | 61.9 | Low | 69.4 | Low | 118 Ų | 118 | 90.5 Ų | 90.5 | 77% | 0.766 | 50% | 0.502 | S | S | * | . | P | Polyproline II helix | trans | -59.3 | 137.5 | 178.7 | 24.7 | -32.6 | 0 | 0 | 0 | 109.6 | E216 | P214-E216 PolarHBondContact O-N 2.97Š|
| 215 | P | 63.1 | Low | 70.2 | Confident | 77 Ų | 77 | 91.2 Ų | 91.2 | 50% | 0.5 | 51% | 0.507 | S | S | . | . | P | Polyproline II helix | trans | -62.4 | 139.3 | -179.2 | 25.2 | -32.9 | 0 | 0 | 0 | 110.8 | I177 I217 | I177-P215 HydrophobicContact CG2-CB 3.85Å; I177-P215 HydrophobicContact CG2-CG 4.41Å; P215-I217 PolarHBondContact O-N 2.99Å; P215-I217 VanDerWaalsContact O-N 3.12Å |
| 216 | E | 63.2 | Low | 70.5 | Confident | 120 Ų | 120 | 86.8 Ų | 86.8 | 56% | 0.561 | 49% | 0.488 | S | S | * | . | trans | -67.4 | 109.7 | 171.5 | -167.4 | -169 | 135.5 | 0 | 0 | 108.7 | K178 P214 V218 | K178-E216 PolarHBondContact N-O 2.97Å; K178-E216 IonicContact NZ-OE1 2.85Å; K178-E216 PolarHBondContact NZ-OE1 3.38Å; P214-E216 PolarHBondContact O-N 2.97Å; E216-V218 HydrophobicContact CG-CG2 4.41Å | ||
| 217 | I | 68.4 | Low | 70.5 | Confident | 85 Ų | 85 | 88.2 Ų | 88.2 | 44% | 0.436 | 50% | 0.496 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -87.8 | 115.6 | 176 | -55.9 | 174.3 | 0 | 0 | 0 | 107.5 | P175 P215 Y219 | P175-I217 HydrophobicContact CB-CG2 3.67Å; P215-I217 PolarHBondContact O-N 2.99Å; P215-I217 VanDerWaalsContact O-N 3.12Å; I217-Y219 HydrophobicContact CG2-CE1 4.48Å; I217-Y219 HydrophobicContact CG2-CE2 4.37Å |
| 218 | V | 70.7 | Confident | 70.1 | Confident | 55 Ų | 55 | 85.4 Ų | 85.4 | 33% | 0.333 | 49% | 0.492 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.4 | 125.1 | 170.5 | 179.4 | 0 | 0 | 0 | 0 | 108.7 | V176 K178 E216 | V176-V218 WeakPolarHBondContact CA-O 3.38Å; V176-V218 WeakPolarHBondContact CB-O 3.39Å; V176-V218 PolarHBondContact N-O 2.97Å; V176-V218 PolarHBondContact O-N 3.4Å; K178-V218 HydrophobicContact CD-CG2 3.88Å; K178-V218 VanDerWaalsContact CE-CG2 3.45Å; K178-V218 HydrophobicContact CG-CG2 4.27Å; E216-V218 HydrophobicContact CG-CG2 4.41Å |
| 219 | Y | 71.9 | Confident | 70.2 | Confident | 149 Ų | 149 | 83.7 Ų | 83.7 | 58% | 0.584 | 47% | 0.472 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -79.5 | 127.6 | 176.1 | -65.4 | -82.3 | 0 | 0 | 0 | 110 | T173 P175 I217 | T173-Y219 HydrophobicContact CG2-CD1 3.76Å; T173-Y219 HydrophobicContact CG2-CG 4.11Å; P175-Y219 HydrophobicContact CB-CD1 4.3Å; P175-Y219 HydrophobicContact CB-CE1 4.15Å; I217-Y219 HydrophobicContact CG2-CE1 4.48Å; I217-Y219 HydrophobicContact CG2-CE2 4.37Å |
| 220 | K | 77.3 | Confident | 70.6 | Confident | 109 Ų | 109 | 80.2 Ų | 80.2 | 47% | 0.474 | 45% | 0.454 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -111.9 | 128.8 | 173.8 | -171.4 | -174.7 | 170.7 | -148.4 | 0 | 109 | T174 V176 E222 | T174-K220 PolarHBondContact N-O 3.44Å; T174-K220 PolarHBondContact O-N 3.39Å; T174-K220 PolarHBondContact OG1-O 3.19Å; V176-K220 HydrophobicContact CG2-CB 3.76Å; V176-K220 HydrophobicContact CG2-CD 4.3Å; K220-E222 HydrophobicContact CD-CG 4.35Å; K220-E222 HydrophobicContact CG-CG 4.36Å; K220-E222 IonicContact NZ-OE1 2.83Å; K220-E222 PolarHBondContact NZ-OE1 2.7Å |
| 221 | S | 78.5 | Confident | 70.8 | Confident | 57 Ų | 57 | 76.3 Ų | 76.3 | 40% | 0.399 | 43% | 0.433 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -84.8 | 120.8 | 174.2 | -63.2 | 0 | 0 | 0 | 0 | 109.2 | D147 | D147-S221 PolarHBondContact OD2-OG 3.22Å |
| 222 | E | 80 | Confident | 71.1 | Confident | 72 Ų | 72 | 72.7 Ų | 72.7 | 34% | 0.336 | 41% | 0.414 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.3 | 143.3 | 178.6 | -64.4 | -168.9 | 148.4 | 0 | 0 | 111.1 | K172 K220 G224 | K172-E222 PolarHBondContact N-O 3.07Å; K172-E222 PolarHBondContact O-N 3.11Å; K220-E222 HydrophobicContact CD-CG 4.35Å; K220-E222 HydrophobicContact CG-CG 4.36Å; K220-E222 IonicContact NZ-OE1 2.83Å; K220-E222 PolarHBondContact NZ-OE1 2.7Å; E222-G224 PolarHBondContact O-N 2.91Å |
| 223 | P | 82.3 | Confident | 71.8 | Confident | 106 Ų | 106 | 66.8 Ų | 66.8 | 69% | 0.688 | 38% | 0.378 | S | S | * | . | trans | -57.7 | 130.2 | 173.4 | -22.5 | 33.3 | 0 | 0 | 0 | 110.4 | Y169 | Y169-P223 HydrophobicContact CE2-CB 4.24Å; Y169-P223 WeakPolarHBondContact OH-CA 3.33Å; Y169-P223 WeakPolarHBondContact OH-CB 3.22Å | ||
| 224 | G | 82.3 | Confident | 72.6 | Confident | 19 Ų | 19 | 62.7 Ų | 62.7 | 20% | 0.196 | 35% | 0.351 | C | S | . | . | trans | -140.1 | 165.6 | 176 | 0 | 0 | 0 | 0 | 0 | 111.4 | R170 E222 | R170-G224 CarbonylContact C-O 3.56Å; R170-G224 PolarHBondContact N-O 2.9Å; R170-G224 CarbonylContact O-C 3.5Å; R170-G224 WeakPolarHBondContact O-CA 3.44Å; R170-G224 PolarHBondContact O-N 3.05Å; R170-G224 VanDerWaalsContact O-N 3.15Å; E222-G224 PolarHBondContact O-N 2.91Å | ||
| 225 | T | 82.6 | Confident | 73.1 | Confident | 89 Ų | 89 | 57.7 Ų | 57.7 | 55% | 0.546 | 32% | 0.318 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.9 | 149.9 | 169.9 | 53.7 | 0 | 0 | 0 | 0 | 108.8 | Q168 | Q168-T225 WeakPolarHBondContact O-CA 3.32Å |
| 226 | S | 75.1 | Confident | 73.8 | Confident | 21 Ų | 21 | 55.7 Ų | 55.7 | 15% | 0.147 | 30% | 0.303 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.8 | 143.5 | 169.4 | 58 | 0 | 0 | 0 | 0 | 109.3 | Q168 G228 | Q168-S226 WeakPolarHBondContact CG-OG 3.33Å; Q168-S226 PolarHBondContact N-O 3.21Å; Q168-S226 PolarHBondContact NE2-OG 2.92Å; Q168-S226 PolarHBondContact O-N 2.7Å; S226-G228 PolarHBondContact O-N 2.91Å |
| 227 | D | 73.6 | Confident | 75.1 | Confident | 141 Ų | 141 | 54.4 Ų | 54.4 | 75% | 0.754 | 30% | 0.296 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -70.4 | 128.8 | 176.6 | -63.7 | -35.8 | 0 | 0 | 0 | 109.3 | ||
| 228 | G | 64.9 | Low | 75.8 | Confident | 28 Ų | 28 | 50.3 Ų | 50.3 | 29% | 0.289 | 28% | 0.275 | S | S | . | . | S | Bend | trans | 144 | 143.1 | -172.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | F166 K167 Q168 S226 N230 | F166-G228 CarbonylContact C-O 3.52Å; F166-G228 VanDerWaalsContact C-O 3.24Å; F166-G228 CarbonylContact O-C 3.3Å; F166-G228 PolarHBondContact O-N 3.05Å; K167-G228 CarbonylContact C-O 3.57Å; K167-G228 WeakPolarHBondContact CA-O 3.46Å; K167-G228 PolarHBondContact N-O 3.22Å; K167-G228 VanDerWaalsContact N-O 3.12Å; Q168-G228 PolarHBondContact N-O 3.45Å; S226-G228 PolarHBondContact O-N 2.91Å; G228-N230 PolarHBondContact O-N 3.05Å |
| 229 | M | 68.5 | Low | 76.2 | Confident | 38 Ų | 38 | 48.8 Ų | 48.8 | 19% | 0.187 | 27% | 0.268 | C | S | . | . | trans | -65.7 | 124.6 | 179.6 | -176.7 | 168.4 | 62.1 | 0 | 0 | 111 | I75 L76 A164 T165 V231 I234 | I75-M229 HydrophobicContact CB-CE 3.79Å; I75-M229 HydrophobicContact CD1-CE 4.25Å; I75-M229 HydrophobicContact CG2-CE 3.44Å; I75-M229 VanDerWaalsContact CG2-CE 3.44Å; L76-M229 HydrophobicContact CB-SD 3.87Å; L76-M229 HydrophobicContact CD1-SD 3.97Å; L76-M229 HydrophobicContact CG-SD 4.4Å; A164-M229 CarbonylContact O-C 3.07Å; T165-M229 WeakPolarHBondContact O-CB 3.31Å; T165-M229 WeakPolarHBondContact O-CG 3.45Å; M229-V231 VanDerWaalsContact C-N 3.25Å; M229-V231 HydrophobicContact CB-CG2 4.22Å; M229-V231 HydrophobicContact CE-CG2 3.51Å; M229-V231 HydrophobicContact CG-CG2 3.93Å; M229-V231 WeakPolarHBondContact O-CG2 3.39Å; M229-V231 PolarHBondContact O-N 3.42Å; M229-V231 HydrophobicContact SD-CG2 4.41Å; M229-I234 HydrophobicContact CG-CD1 3.57Å; M229-I234 HydrophobicContact SD-CD1 3.86Å | ||
| 230 | N | 72 | Confident | 76.8 | Confident | 7 Ų | 7 | 45.2 Ų | 45.2 | 4% | 0.037 | 26% | 0.262 | C | S | . | . | trans | -76.2 | 78.5 | 167.8 | 178.5 | 10 | 0 | 0 | 0 | 110.1 | N155 A164 K167 Q168 G228 L232 G233 I234 | N155-N230 PolarHBondContact O-ND2 2.94Å; N155-N230 PolarHBondContact O-OD1 2.96Å; N155-N230 PolarHBondContact OD1-ND2 3.26Å; A164-N230 HydrophobicContact CB-CB 4.11Å; A164-N230 PolarHBondContact O-N 3.35Å; K167-N230 WeakPolarHBondContact O-CB 3.42Å; Q168-N230 HydrophobicContact CB-CB 3.79Å; G228-N230 PolarHBondContact O-N 3.05Å; N230-L232 VanDerWaalsContact C-N 3.29Å; N230-L232 PolarHBondContact O-N 2.89Å; N230-G233 PolarHBondContact O-N 3.21Å; N230-G233 PolarHBondContact OD1-N 3Å; N230-G233 VanDerWaalsContact OD1-N 3.09Å; N230-I234 WeakPolarHBondContact O-CG1 3.49Å; N230-I234 PolarHBondContact O-N 3.27Å | ||
| 231 | V | 66.4 | Low | 77.4 | Confident | 8 Ų | 8 | 42.9 Ų | 42.9 | 5% | 0.048 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -65.9 | -33.3 | -177.6 | -162.7 | 0 | 0 | 0 | 0 | 111.9 | M229 G233 I234 V235 I441 | M229-V231 VanDerWaalsContact C-N 3.25Å; M229-V231 HydrophobicContact CB-CG2 4.22Å; M229-V231 HydrophobicContact CE-CG2 3.51Å; M229-V231 HydrophobicContact CG-CG2 3.93Å; M229-V231 WeakPolarHBondContact O-CG2 3.39Å; M229-V231 PolarHBondContact O-N 3.42Å; M229-V231 HydrophobicContact SD-CG2 4.41Å; V231-G233 PolarHBondContact O-N 2.76Å; V231-I234 WeakPolarHBondContact O-CB 3.09Å; V231-I234 PolarHBondContact O-N 3.27Å; V231-V235 HydrophobicContact CG1-CG2 4.18Å; V231-V235 VanDerWaalsContact O-CG2 3.29Å; V231-V235 WeakPolarHBondContact O-CG2 3.47Å; V231-V235 PolarHBondContact O-N 3.25Å; V231-I441 HydrophobicContact CB-CD1 3.45Å; V231-I441 VanDerWaalsContact CB-CD1 3.45Å; V231-I441 HydrophobicContact CB-CG1 3.53Å; V231-I441 HydrophobicContact CB-CG2 4.33Å; V231-I441 HydrophobicContact CG1-CD1 3.32Å; V231-I441 HydrophobicContact CG1-CG1 3.96Å; V231-I441 HydrophobicContact CG2-CD1 4.01Å; V231-I441 HydrophobicContact CG2-CG1 3.65Å |
| 232 | L | 65.9 | Low | 77.7 | Confident | 15 Ų | 15 | 40.2 Ų | 40.2 | 8% | 0.079 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -59.2 | -47.7 | 179 | 178.5 | 64.3 | 0 | 0 | 0 | 111.6 | L152 M156 N230 I234 V235 I236 A423 I441 | L152-L232 HydrophobicContact CD1-CD2 3.39Å; L152-L232 HydrophobicContact CG-CD2 4.26Å; M156-L232 HydrophobicContact CG-CD2 3.71Å; M156-L232 HydrophobicContact CG-CG 4.09Å; N230-L232 VanDerWaalsContact C-N 3.29Å; N230-L232 PolarHBondContact O-N 2.89Å; L232-I234 VanDerWaalsContact C-N 3.32Å; L232-I234 PolarHBondContact O-N 3.49Å; L232-V235 PolarHBondContact O-N 2.91Å; L232-I236 HydrophobicContact CD1-CD1 3.99Å; L232-I236 HydrophobicContact CG-CD1 4.14Å; L232-I236 WeakPolarHBondContact O-CG1 3.38Å; L232-I236 PolarHBondContact O-N 3.1Å; L232-A423 HydrophobicContact CD1-CB 4.26Å; L232-I441 HydrophobicContact CB-CG2 4.32Å |
| 233 | G | 76.9 | Confident | 77.9 | Confident | 0 Ų | 0 | 40.1 Ų | 40.1 | 0% | 0 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -62.4 | -39.4 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | N155 N230 V231 F237 | N155-G233 WeakPolarHBondContact O-CA 3.36Å; N155-G233 PolarHBondContact O-N 3.21Å; N230-G233 PolarHBondContact O-N 3.21Å; N230-G233 PolarHBondContact OD1-N 3Å; N230-G233 VanDerWaalsContact OD1-N 3.09Å; V231-G233 PolarHBondContact O-N 2.76Å; G233-F237 VanDerWaalsContact O-CB 3.29Å; G233-F237 WeakPolarHBondContact O-CB 3.2Å; G233-F237 PolarHBondContact O-N 3.05Å |
| 234 | I | 79 | Confident | 78.2 | Confident | 3 Ų | 3 | 39.4 Ų | 39.4 | 2% | 0.015 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -63.9 | -46 | 176.4 | -65.4 | 165 | 0 | 0 | 0 | 110.9 | L76 V79 V80 L161 A164 T165 M229 N230 V231 L232 I236 F237 S238 | L76-I234 HydrophobicContact CD1-CD1 3.59Å; L76-I234 HydrophobicContact CD1-CG1 4.46Å; L76-I234 HydrophobicContact CD1-CG2 4.14Å; V79-I234 HydrophobicContact CG1-CG2 4.34Å; V80-I234 HydrophobicContact CG2-CG2 3.47Å; V80-I234 VanDerWaalsContact CG2-CG2 3.47Å; L161-I234 HydrophobicContact CD1-CG1 4.45Å; A164-I234 HydrophobicContact CB-CG1 4.44Å; T165-I234 HydrophobicContact CG2-CD1 4.41Å; M229-I234 HydrophobicContact CG-CD1 3.57Å; M229-I234 HydrophobicContact SD-CD1 3.86Å; N230-I234 WeakPolarHBondContact O-CG1 3.49Å; N230-I234 PolarHBondContact O-N 3.27Å; V231-I234 WeakPolarHBondContact O-CB 3.09Å; V231-I234 PolarHBondContact O-N 3.27Å; L232-I234 VanDerWaalsContact C-N 3.32Å; L232-I234 PolarHBondContact O-N 3.49Å; I234-I236 PolarHBondContact O-N 2.88Å; I234-F237 PolarHBondContact O-N 3.23Å; I234-S238 VanDerWaalsContact O-CB 3.27Å; I234-S238 WeakPolarHBondContact O-CB 3.41Å; I234-S238 PolarHBondContact O-N 2.76Å; I234-S238 PolarHBondContact O-OG 3.07Å; I234-S238 VanDerWaalsContact O-OG 3.09Å |
| 235 | V | 72.8 | Confident | 78.5 | Confident | 12 Ų | 12 | 38.8 Ų | 38.8 | 7% | 0.073 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -58.9 | -49 | 177.8 | 166.8 | 0 | 0 | 0 | 0 | 110.9 | V79 L83 V231 L232 S238 A239 | V79-V235 HydrophobicContact CG1-CG2 3.6Å; L83-V235 HydrophobicContact CD1-CB 4.03Å; L83-V235 HydrophobicContact CD1-CG1 3.8Å; L83-V235 HydrophobicContact CD1-CG2 3.92Å; V231-V235 HydrophobicContact CG1-CG2 4.18Å; V231-V235 VanDerWaalsContact O-CG2 3.29Å; V231-V235 WeakPolarHBondContact O-CG2 3.47Å; V231-V235 PolarHBondContact O-N 3.25Å; L232-V235 PolarHBondContact O-N 2.91Å; V235-S238 PolarHBondContact O-N 3.17Å; V235-A239 WeakPolarHBondContact O-CB 3.36Å; V235-A239 PolarHBondContact O-N 2.93Å |
| 236 | I | 77.9 | Confident | 78.6 | Confident | 36 Ų | 36 | 35.3 Ų | 35.3 | 19% | 0.185 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -65.8 | -42.5 | -178.1 | -70.4 | 170.1 | 0 | 0 | 0 | 111.3 | M156 L232 I234 A239 T240 | M156-I236 HydrophobicContact CB-CD1 3.45Å; M156-I236 VanDerWaalsContact CB-CD1 3.45Å; M156-I236 HydrophobicContact CE-CD1 3.52Å; M156-I236 HydrophobicContact CG-CD1 3.4Å; M156-I236 VanDerWaalsContact CG-CD1 3.4Å; M156-I236 HydrophobicContact SD-CD1 4.27Å; L232-I236 HydrophobicContact CD1-CD1 3.99Å; L232-I236 HydrophobicContact CG-CD1 4.14Å; L232-I236 WeakPolarHBondContact O-CG1 3.38Å; L232-I236 PolarHBondContact O-N 3.1Å; I234-I236 PolarHBondContact O-N 2.88Å; I236-A239 PolarHBondContact O-N 3.15Å; I236-T240 WeakPolarHBondContact O-CB 3.48Å; I236-T240 PolarHBondContact O-N 2.83Å; I236-T240 PolarHBondContact O-OG1 3.05Å |
| 237 | F | 89.4 | Confident | 79 | Confident | 92 Ų | 92 | 42.2 Ų | 42.2 | 40% | 0.404 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -60.9 | -53 | 174.8 | 172.9 | -94.8 | 0 | 0 | 0 | 111.3 | L161 G233 I234 A239 T240 M241 | L161-F237 HydrophobicContact CD1-CB 4.01Å; L161-F237 HydrophobicContact CD1-CD1 3.81Å; L161-F237 HydrophobicContact CD1-CD2 4.46Å; L161-F237 HydrophobicContact CD1-CE1 4.46Å; L161-F237 HydrophobicContact CD1-CG 3.81Å; L161-F237 HydrophobicContact CD2-CD1 3.53Å; L161-F237 HydrophobicContact CD2-CD2 4.35Å; L161-F237 HydrophobicContact CD2-CE1 3.31Å; L161-F237 HydrophobicContact CD2-CE2 4.16Å; L161-F237 HydrophobicContact CD2-CG 4.06Å; L161-F237 HydrophobicContact CD2-CZ 3.65Å; L161-F237 HydrophobicContact CG-CD1 4.34Å; G233-F237 VanDerWaalsContact O-CB 3.29Å; G233-F237 WeakPolarHBondContact O-CB 3.2Å; G233-F237 PolarHBondContact O-N 3.05Å; I234-F237 PolarHBondContact O-N 3.23Å; F237-A239 VanDerWaalsContact C-N 3.28Å; F237-A239 PolarHBondContact O-N 2.97Å; F237-T240 PolarHBondContact O-N 3.23Å; F237-M241 WeakPolarHBondContact O-CB 3.23Å; F237-M241 PolarHBondContact O-N 2.9Å |
| 238 | S | 84.3 | Confident | 79.7 | Confident | 0 Ų | 0 | 40.3 Ų | 40.3 | 0% | 0 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -61.4 | -37 | -179.9 | -69.4 | 0 | 0 | 0 | 0 | 112.2 | V80 M84 I234 V235 G242 | V80-S238 WeakPolarHBondContact CA-OG 3.43Å; M84-S238 WeakPolarHBondContact CG-O 3.24Å; I234-S238 VanDerWaalsContact O-CB 3.27Å; I234-S238 WeakPolarHBondContact O-CB 3.41Å; I234-S238 PolarHBondContact O-N 2.76Å; I234-S238 PolarHBondContact O-OG 3.07Å; I234-S238 VanDerWaalsContact O-OG 3.09Å; V235-S238 PolarHBondContact O-N 3.17Å; S238-G242 PolarHBondContact O-N 2.7Å |
| 239 | A | 77.8 | Confident | 80.6 | Confident | 22 Ų | 22 | 40.9 Ų | 40.9 | 18% | 0.182 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -66.9 | -47.1 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | L87 V235 I236 F237 M241 G242 I243 | L87-A239 HydrophobicContact CD1-CB 3.42Å; L87-A239 VanDerWaalsContact CD1-CB 3.42Å; V235-A239 WeakPolarHBondContact O-CB 3.36Å; V235-A239 PolarHBondContact O-N 2.93Å; I236-A239 PolarHBondContact O-N 3.15Å; F237-A239 VanDerWaalsContact C-N 3.28Å; F237-A239 PolarHBondContact O-N 2.97Å; A239-M241 VanDerWaalsContact C-N 3.33Å; A239-M241 PolarHBondContact O-N 3.27Å; A239-G242 PolarHBondContact O-N 3.38Å; A239-I243 VanDerWaalsContact O-CG1 3.32Å; A239-I243 WeakPolarHBondContact O-CG1 3.11Å; A239-I243 PolarHBondContact O-N 3.49Å |
| 240 | T | 86.1 | Confident | 81.5 | Confident | 75 Ų | 75 | 46.1 Ų | 46.1 | 46% | 0.46 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -60.5 | -45.8 | 176.4 | -55.8 | 0 | 0 | 0 | 0 | 110.5 | I236 F237 I243 M244 | I236-T240 WeakPolarHBondContact O-CB 3.48Å; I236-T240 PolarHBondContact O-N 2.83Å; I236-T240 PolarHBondContact O-OG1 3.05Å; F237-T240 PolarHBondContact O-N 3.23Å; T240-I243 PolarHBondContact O-N 3.33Å; T240-M244 WeakPolarHBondContact O-CG 3.47Å; T240-M244 PolarHBondContact O-N 2.9Å |
| 241 | M | 89.8 | Confident | 82.4 | Confident | 60 Ų | 60 | 50.4 Ų | 50.4 | 30% | 0.296 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -63.7 | -43.2 | 178.6 | -168 | 64.4 | -170.7 | 0 | 0 | 111.8 | M84 F237 A239 I243 M244 L245 L255 | M84-M241 HydrophobicContact CE-CB 4.32Å; M84-M241 HydrophobicContact CE-CG 3.64Å; M84-M241 HydrophobicContact CG-CB 4.46Å; M84-M241 HydrophobicContact SD-CG 4.47Å; F237-M241 WeakPolarHBondContact O-CB 3.23Å; F237-M241 PolarHBondContact O-N 2.9Å; A239-M241 VanDerWaalsContact C-N 3.33Å; A239-M241 PolarHBondContact O-N 3.27Å; M241-I243 PolarHBondContact O-N 2.8Å; M241-M244 PolarHBondContact O-N 3.27Å; M241-L245 HydrophobicContact CE-CD1 4.34Å; M241-L245 HydrophobicContact CE-CD2 4Å; M241-L245 HydrophobicContact CE-CG 4.06Å; M241-L245 HydrophobicContact CG-CD1 4.19Å; M241-L245 HydrophobicContact CG-CG 4.43Å; M241-L245 WeakPolarHBondContact O-CB 3.41Å; M241-L245 VanDerWaalsContact O-CG 3.28Å; M241-L245 WeakPolarHBondContact O-CG 3.49Å; M241-L245 PolarHBondContact O-N 3.21Å; M241-L255 HydrophobicContact CE-CD2 4.05Å |
| 242 | G | 84.8 | Confident | 83.5 | Confident | 0 Ų | 0 | 50.1 Ų | 50.1 | 0% | 0 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -57.4 | -47.7 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | M84 A88 S238 A239 M244 L245 G246 | M84-G242 WeakPolarHBondContact O-CA 3.36Å; A88-G242 WeakPolarHBondContact CA-O 3.43Å; A88-G242 VanDerWaalsContact CB-O 3.29Å; A88-G242 WeakPolarHBondContact CB-O 3.32Å; A88-G242 PolarHBondContact N-O 3.48Å; S238-G242 PolarHBondContact O-N 2.7Å; A239-G242 PolarHBondContact O-N 3.38Å; G242-M244 VanDerWaalsContact C-N 3.34Å; G242-M244 PolarHBondContact O-N 3.26Å; G242-L245 PolarHBondContact O-N 2.96Å; G242-G246 PolarHBondContact O-N 3.37Å |
| 243 | I | 82.8 | Confident | 84.7 | Confident | 71 Ų | 71 | 52.6 Ų | 52.6 | 36% | 0.364 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -63.2 | -40.9 | 177.4 | -62.7 | 163.4 | 0 | 0 | 0 | 111.2 | L87 A239 T240 M241 G246 R247 | L87-I243 HydrophobicContact CB-CG1 4.12Å; A239-I243 VanDerWaalsContact O-CG1 3.32Å; A239-I243 WeakPolarHBondContact O-CG1 3.11Å; A239-I243 PolarHBondContact O-N 3.49Å; T240-I243 PolarHBondContact O-N 3.33Å; M241-I243 PolarHBondContact O-N 2.8Å; I243-G246 PolarHBondContact O-N 3.49Å; I243-R247 WeakPolarHBondContact O-CG 3.25Å; I243-R247 PolarHBondContact O-N 3.21Å; I243-R247 VanDerWaalsContact O-N 3.14Å |
| 244 | M | 89.1 | Confident | 85.5 | Confident | 91 Ų | 91 | 57 Ų | 57 | 45% | 0.448 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -64.4 | -42.9 | 176.7 | -68.9 | -56.2 | 100.2 | 0 | 0 | 111.5 | T240 M241 G242 G246 R247 M248 | T240-M244 WeakPolarHBondContact O-CG 3.47Å; T240-M244 PolarHBondContact O-N 2.9Å; M241-M244 PolarHBondContact O-N 3.27Å; G242-M244 VanDerWaalsContact C-N 3.34Å; G242-M244 PolarHBondContact O-N 3.26Å; M244-G246 PolarHBondContact O-N 2.82Å; M244-R247 CarbonylContact O-C 3.24Å; M244-R247 WeakPolarHBondContact O-CA 3.5Å; M244-R247 WeakPolarHBondContact O-CB 3.45Å; M244-R247 PolarHBondContact O-N 2.88Å; M244-M248 WeakPolarHBondContact O-CG 3.28Å; M244-M248 PolarHBondContact O-N 3.34Å |
| 245 | L | 89.1 | Confident | 86.3 | Confident | 5 Ų | 5 | 60.1 Ų | 60.1 | 3% | 0.026 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -61.6 | -42.2 | 176.9 | -73.1 | 171.2 | 0 | 0 | 0 | 112.4 | M84 A88 M241 G242 R247 M248 L255 V256 | M84-L245 HydrophobicContact CE-CD1 3.68Å; A88-L245 HydrophobicContact CB-CB 4.06Å; M241-L245 HydrophobicContact CE-CD1 4.34Å; M241-L245 HydrophobicContact CE-CD2 4Å; M241-L245 HydrophobicContact CE-CG 4.06Å; M241-L245 HydrophobicContact CG-CD1 4.19Å; M241-L245 HydrophobicContact CG-CG 4.43Å; M241-L245 WeakPolarHBondContact O-CB 3.41Å; M241-L245 VanDerWaalsContact O-CG 3.28Å; M241-L245 WeakPolarHBondContact O-CG 3.49Å; M241-L245 PolarHBondContact O-N 3.21Å; G242-L245 PolarHBondContact O-N 2.96Å; L245-R247 PolarHBondContact O-N 3.36Å; L245-M248 HydrophobicContact CD2-SD 4.09Å; L245-M248 PolarHBondContact O-N 2.86Å; L245-L255 HydrophobicContact CD1-CB 4.35Å; L245-L255 HydrophobicContact CD1-CD2 3.84Å; L245-L255 HydrophobicContact CD1-CG 4.06Å; L245-L255 HydrophobicContact CD2-CB 4.12Å; L245-L255 HydrophobicContact CD2-CD2 3.88Å; L245-L255 HydrophobicContact CD2-CG 4.43Å; L245-L255 HydrophobicContact CG-CD2 4.45Å; L245-V256 HydrophobicContact CB-CG2 3.92Å; L245-V256 HydrophobicContact CD1-CG2 4.37Å |
| 246 | G | 83.5 | Confident | 87 | Confident | 17 Ų | 17 | 60.4 Ų | 60.4 | 18% | 0.175 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -61.5 | -32.2 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | A88 G242 I243 M244 | A88-G246 VanDerWaalsContact O-CA 3.3Å; A88-G246 WeakPolarHBondContact O-CA 3.35Å; G242-G246 PolarHBondContact O-N 3.37Å; I243-G246 PolarHBondContact O-N 3.49Å; M244-G246 PolarHBondContact O-N 2.82Å |
| 247 | R | 85 | Confident | 87.6 | Confident | 166 Ų | 166 | 61.1 Ų | 61.1 | 63% | 0.626 | 34% | 0.343 | S | S | * | . | H | α-helix | trans | -78.1 | -22.2 | 176.3 | -74.5 | -164.9 | 133.5 | 84.3 | 6.4 | 114.6 | A92 I243 M244 L245 G249 | A92-R247 HydrophobicContact CB-CG 4.3Å; I243-R247 WeakPolarHBondContact O-CG 3.25Å; I243-R247 PolarHBondContact O-N 3.21Å; I243-R247 VanDerWaalsContact O-N 3.14Å; M244-R247 CarbonylContact O-C 3.24Å; M244-R247 WeakPolarHBondContact O-CA 3.5Å; M244-R247 WeakPolarHBondContact O-CB 3.45Å; M244-R247 PolarHBondContact O-N 2.88Å; L245-R247 PolarHBondContact O-N 3.36Å; R247-G249 PolarHBondContact O-N 3.09Å |
| 248 | M | 87.9 | Confident | 87.9 | Confident | 101 Ų | 101 | 62.6 Ų | 62.6 | 50% | 0.498 | 35% | 0.35 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -73.1 | -11.3 | 177.6 | -71.6 | 172.6 | 69 | 0 | 0 | 113.1 | M244 L245 D250 S251 | M244-M248 WeakPolarHBondContact O-CG 3.28Å; M244-M248 PolarHBondContact O-N 3.34Å; L245-M248 HydrophobicContact CD2-SD 4.09Å; L245-M248 PolarHBondContact O-N 2.86Å; M248-D250 PolarHBondContact O-N 3.4Å; M248-S251 PolarHBondContact O-N 3.41Å |
| 249 | G | 83.4 | Confident | 88 | Confident | 39 Ų | 39 | 62.9 Ų | 62.9 | 40% | 0.402 | 35% | 0.351 | S | S | . | . | G | 310 helix | trans | 58.7 | -132.1 | -177.9 | 0 | 0 | 0 | 0 | 0 | 111 | R247 S251 G252 T253 | R247-G249 PolarHBondContact O-N 3.09Å; G249-S251 PolarHBondContact O-N 3.16Å; G249-S251 VanDerWaalsContact O-N 3.15Å; G249-G252 PolarHBondContact O-N 3.24Å; G249-T253 PolarHBondContact O-N 3.41Å; G249-T253 PolarHBondContact O-OG1 2.74Å |
| 250 | D | 87.1 | Confident | 88.3 | Confident | 148 Ų | 148 | 65.8 Ų | 65.8 | 79% | 0.791 | 36% | 0.361 | S | S | * | . | G | 310 helix | trans | -58.9 | -31.1 | -174 | -58.3 | -34.3 | 0 | 0 | 0 | 114 | M248 G252 T253 | M248-D250 PolarHBondContact O-N 3.4Å; D250-G252 VanDerWaalsContact C-N 3.27Å; D250-G252 PolarHBondContact O-N 2.73Å; D250-T253 PolarHBondContact O-N 3.01Å; D250-T253 PolarHBondContact O-OG1 3.13Å |
| 251 | S | 91.8 | Very high | 88.5 | Confident | 98 Ų | 98 | 66 Ų | 66 | 69% | 0.685 | 36% | 0.364 | S | S | * | . | G | 310 helix | trans | -69.2 | -25.2 | 176.8 | -56.4 | 0 | 0 | 0 | 0 | 113.1 | M248 G249 | M248-S251 PolarHBondContact O-N 3.41Å; G249-S251 PolarHBondContact O-N 3.16Å; G249-S251 VanDerWaalsContact O-N 3.15Å |
| 252 | G | 89.9 | Confident | 88.4 | Confident | 1 Ų | 1 | 65.9 Ų | 65.9 | 1% | 0.01 | 37% | 0.365 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -84.8 | -22.9 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | G249 D250 P254 L255 V256 | G249-G252 PolarHBondContact O-N 3.24Å; D250-G252 VanDerWaalsContact C-N 3.27Å; D250-G252 PolarHBondContact O-N 2.73Å; G252-P254 VanDerWaalsContact C-CD 3.46Å; G252-L255 PolarHBondContact O-N 2.62Å; G252-L255 VanDerWaalsContact O-N 3.14Å; G252-V256 WeakPolarHBondContact O-CG2 2.96Å; G252-V256 PolarHBondContact O-N 3.02Å; G252-V256 VanDerWaalsContact O-N 3.16Å |
| 253 | T | 89.6 | Confident | 88 | Confident | 67 Ų | 67 | 67.6 Ų | 67.6 | 41% | 0.411 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -51.3 | -45 | -173.9 | -55 | 0 | 0 | 0 | 0 | 114.4 | G249 D250 L255 V256 S257 | G249-T253 PolarHBondContact O-N 3.41Å; G249-T253 PolarHBondContact O-OG1 2.74Å; D250-T253 PolarHBondContact O-N 3.01Å; D250-T253 PolarHBondContact O-OG1 3.13Å; T253-L255 VanDerWaalsContact C-N 3.3Å; T253-L255 PolarHBondContact O-N 3.04Å; T253-V256 PolarHBondContact O-N 3.22Å; T253-S257 PolarHBondContact O-N 3.05Å; T253-S257 PolarHBondContact O-OG 3.3Å; T253-S257 VanDerWaalsContact O-OG 3.12Å |
| 254 | P | 95.4 | Very high | 87.7 | Confident | 92 Ų | 92 | 70.3 Ų | 70.3 | 60% | 0.597 | 39% | 0.385 | S | S | * | . | H | α-helix | trans | -58.7 | -40.7 | -179.2 | -24.9 | 35.2 | 0 | 0 | 0 | 113.2 | G252 F258 | G252-P254 VanDerWaalsContact C-CD 3.46Å; P254-F258 PolarHBondContact O-N 3.38Å |
| 255 | L | 94.1 | Very high | 87.4 | Confident | 69 Ų | 69 | 69 Ų | 69 | 36% | 0.361 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -75.5 | -35.4 | -179.3 | -168.3 | 59.4 | 0 | 0 | 0 | 111.7 | M84 M241 L245 G252 T253 F258 C259 | M84-L255 HydrophobicContact CE-CD2 4.24Å; M84-L255 HydrophobicContact CE-CG 4.47Å; M241-L255 HydrophobicContact CE-CD2 4.05Å; L245-L255 HydrophobicContact CD1-CB 4.35Å; L245-L255 HydrophobicContact CD1-CD2 3.84Å; L245-L255 HydrophobicContact CD1-CG 4.06Å; L245-L255 HydrophobicContact CD2-CB 4.12Å; L245-L255 HydrophobicContact CD2-CD2 3.88Å; L245-L255 HydrophobicContact CD2-CG 4.43Å; L245-L255 HydrophobicContact CG-CD2 4.45Å; G252-L255 PolarHBondContact O-N 2.62Å; G252-L255 VanDerWaalsContact O-N 3.14Å; T253-L255 VanDerWaalsContact C-N 3.3Å; T253-L255 PolarHBondContact O-N 3.04Å; L255-F258 HydrophobicContact CD1-CD1 4.16Å; L255-F258 PolarHBondContact O-N 2.81Å; L255-C259 PolarHBondContact O-N 3.17Å; L255-C259 PolarHBondContact O-SG 3.02Å; L255-C259 VanDerWaalsContact O-SG 3.34Å |
| 256 | V | 88.9 | Confident | 86.7 | Confident | 19 Ų | 19 | 69.1 Ų | 69.1 | 12% | 0.115 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -62.3 | -46.8 | 173.6 | 177.6 | 0 | 0 | 0 | 0 | 110.7 | A88 L245 G252 T253 F258 C259 Q260 | A88-V256 HydrophobicContact CB-CB 4.4Å; A88-V256 HydrophobicContact CB-CG1 4.06Å; A88-V256 HydrophobicContact CB-CG2 3.42Å; A88-V256 VanDerWaalsContact CB-CG2 3.42Å; L245-V256 HydrophobicContact CB-CG2 3.92Å; L245-V256 HydrophobicContact CD1-CG2 4.37Å; G252-V256 WeakPolarHBondContact O-CG2 2.96Å; G252-V256 PolarHBondContact O-N 3.02Å; G252-V256 VanDerWaalsContact O-N 3.16Å; T253-V256 PolarHBondContact O-N 3.22Å; V256-F258 VanDerWaalsContact C-N 3.34Å; V256-F258 PolarHBondContact O-N 3.4Å; V256-C259 PolarHBondContact O-N 3.14Å; V256-Q260 WeakPolarHBondContact O-CG 3.34Å; V256-Q260 PolarHBondContact O-N 3.39Å |
| 257 | S | 90.1 | Very high | 85.9 | Confident | 50 Ų | 50 | 71 Ų | 71 | 35% | 0.35 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -61.5 | -41.6 | 176.5 | -62.2 | 0 | 0 | 0 | 0 | 111.8 | T253 C259 Q260 C261 | T253-S257 PolarHBondContact O-N 3.05Å; T253-S257 PolarHBondContact O-OG 3.3Å; T253-S257 VanDerWaalsContact O-OG 3.12Å; S257-C259 PolarHBondContact O-N 3.24Å; S257-Q260 PolarHBondContact O-N 3.27Å; S257-C261 PolarHBondContact O-N 3.18Å; S257-C261 PolarHBondContact O-SG 3.43Å; S257-C261 VanDerWaalsContact O-SG 3.33Å |
| 258 | F | 94.9 | Very high | 85.4 | Confident | 124 Ų | 124 | 70.1 Ų | 70.1 | 54% | 0.544 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -58 | -48.4 | 172.6 | 171.5 | -95.6 | 0 | 0 | 0 | 111.8 | P254 L255 V256 Q260 C261 L262 | P254-F258 PolarHBondContact O-N 3.38Å; L255-F258 HydrophobicContact CD1-CD1 4.16Å; L255-F258 PolarHBondContact O-N 2.81Å; V256-F258 VanDerWaalsContact C-N 3.34Å; V256-F258 PolarHBondContact O-N 3.4Å; F258-Q260 VanDerWaalsContact C-N 3.31Å; F258-Q260 PolarHBondContact O-N 3.43Å; F258-C261 PolarHBondContact O-N 3.39Å; F258-L262 HydrophobicContact CE1-CD2 4.2Å; F258-L262 HydrophobicContact CZ-CD2 4.42Å; F258-L262 WeakPolarHBondContact O-CB 3.26Å; F258-L262 PolarHBondContact O-N 3.37Å |
| 259 | C | 87.7 | Confident | 84.9 | Confident | 5 Ų | 5 | 69.5 Ų | 69.5 | 3% | 0.034 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -61.5 | -38.2 | 177.5 | -71.3 | 0 | 0 | 0 | 0 | 112.2 | S81 M84 L255 V256 S257 L262 N263 | S81-C259 WeakPolarHBondContact CB-O 3.26Å; M84-C259 HydrophobicContact CB-CB 4.42Å; L255-C259 PolarHBondContact O-N 3.17Å; L255-C259 PolarHBondContact O-SG 3.02Å; L255-C259 VanDerWaalsContact O-SG 3.34Å; V256-C259 PolarHBondContact O-N 3.14Å; S257-C259 PolarHBondContact O-N 3.24Å; C259-L262 PolarHBondContact O-N 3.21Å; C259-N263 WeakPolarHBondContact O-CB 3.5Å; C259-N263 PolarHBondContact O-N 2.98Å |
| 260 | Q | 84.2 | Confident | 83.9 | Confident | 84 Ų | 84 | 68.7 Ų | 68.7 | 39% | 0.393 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -63.4 | -49.2 | 175 | -72 | 173.1 | -11.9 | 0 | 0 | 111.6 | V256 S257 F258 L262 N263 E264 | V256-Q260 WeakPolarHBondContact O-CG 3.34Å; V256-Q260 PolarHBondContact O-N 3.39Å; S257-Q260 PolarHBondContact O-N 3.27Å; F258-Q260 VanDerWaalsContact C-N 3.31Å; F258-Q260 PolarHBondContact O-N 3.43Å; Q260-L262 VanDerWaalsContact C-N 3.31Å; Q260-L262 PolarHBondContact O-N 3.16Å; Q260-N263 PolarHBondContact O-N 3.35Å; Q260-E264 PolarHBondContact O-N 2.94Å |
| 261 | C | 89.2 | Confident | 83 | Confident | 78 Ų | 78 | 64.5 Ų | 64.5 | 53% | 0.527 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -59.7 | -40.7 | 176.8 | -69.7 | 0 | 0 | 0 | 0 | 112.2 | S257 F258 S265 | S257-C261 PolarHBondContact O-N 3.18Å; S257-C261 PolarHBondContact O-SG 3.43Å; S257-C261 VanDerWaalsContact O-SG 3.33Å; F258-C261 PolarHBondContact O-N 3.39Å; C261-S265 WeakPolarHBondContact O-CB 3.41Å; C261-S265 PolarHBondContact O-N 3.38Å; C261-S265 PolarHBondContact O-OG 3.12Å |
| 262 | L | 87.4 | Confident | 82.2 | Confident | 58 Ų | 58 | 64.9 Ų | 64.9 | 30% | 0.304 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -64.1 | -47.2 | 176.1 | 180 | 59.5 | 0 | 0 | 0 | 111 | F258 C259 Q260 E264 S265 V266 | F258-L262 HydrophobicContact CE1-CD2 4.2Å; F258-L262 HydrophobicContact CZ-CD2 4.42Å; F258-L262 WeakPolarHBondContact O-CB 3.26Å; F258-L262 PolarHBondContact O-N 3.37Å; C259-L262 PolarHBondContact O-N 3.21Å; Q260-L262 VanDerWaalsContact C-N 3.31Å; Q260-L262 PolarHBondContact O-N 3.16Å; L262-E264 PolarHBondContact O-N 3.47Å; L262-S265 PolarHBondContact O-N 3.31Å; L262-V266 HydrophobicContact CD1-CG2 4.13Å; L262-V266 HydrophobicContact CG-CG2 4.44Å; L262-V266 VanDerWaalsContact O-CG2 3.25Å; L262-V266 WeakPolarHBondContact O-CG2 3.29Å; L262-V266 PolarHBondContact O-N 3.42Å |
| 263 | N | 77.6 | Confident | 81.2 | Confident | 37 Ų | 37 | 65.2 Ų | 65.2 | 20% | 0.198 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -58 | -49 | 177.5 | -175.2 | 35.4 | 0 | 0 | 0 | 111.3 | L78 S81 C259 Q260 S265 V266 M267 | L78-N263 WeakPolarHBondContact CD1-OD1 3.48Å; S81-N263 WeakPolarHBondContact OG-CA 3.44Å; S81-N263 WeakPolarHBondContact OG-CB 3.47Å; C259-N263 WeakPolarHBondContact O-CB 3.5Å; C259-N263 PolarHBondContact O-N 2.98Å; Q260-N263 PolarHBondContact O-N 3.35Å; N263-S265 VanDerWaalsContact C-N 3.32Å; N263-S265 PolarHBondContact O-N 2.96Å; N263-V266 PolarHBondContact O-N 2.93Å; N263-M267 WeakPolarHBondContact O-CB 3.5Å; N263-M267 WeakPolarHBondContact O-CG 3.24Å; N263-M267 PolarHBondContact O-N 2.97Å |
| 264 | E | 76.9 | Confident | 80.1 | Confident | 127 Ų | 127 | 63 Ų | 63 | 59% | 0.593 | 35% | 0.354 | S | S | * | . | H | α-helix | trans | -60.6 | -39.5 | 176.5 | -73.1 | -173.6 | -170.6 | 0 | 0 | 112.9 | Q260 L262 M267 K268 | Q260-E264 PolarHBondContact O-N 2.94Å; L262-E264 PolarHBondContact O-N 3.47Å; E264-M267 PolarHBondContact O-N 3.22Å; E264-K268 PolarHBondContact O-N 3.49Å; E264-K268 VanDerWaalsContact O-N 3.16Å |
| 265 | S | 81.8 | Confident | 79.2 | Confident | 64 Ų | 64 | 67.1 Ų | 67.1 | 45% | 0.448 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -65.2 | -45.5 | 177.4 | -60.7 | 0 | 0 | 0 | 0 | 111.4 | C261 L262 N263 M267 K268 I269 | C261-S265 WeakPolarHBondContact O-CB 3.41Å; C261-S265 PolarHBondContact O-N 3.38Å; C261-S265 PolarHBondContact O-OG 3.12Å; L262-S265 PolarHBondContact O-N 3.31Å; N263-S265 VanDerWaalsContact C-N 3.32Å; N263-S265 PolarHBondContact O-N 2.96Å; S265-M267 VanDerWaalsContact C-N 3.3Å; S265-M267 PolarHBondContact O-N 3.4Å; S265-K268 WeakPolarHBondContact O-CB 3.38Å; S265-K268 PolarHBondContact O-N 3.33Å; S265-I269 PolarHBondContact O-N 3.2Å |
| 266 | V | 75.3 | Confident | 78.4 | Confident | 7 Ų | 7 | 66.5 Ų | 66.5 | 4% | 0.042 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -62.3 | -39.4 | 176.4 | 175.4 | 0 | 0 | 0 | 0 | 110.7 | L74 P77 L78 L262 N263 K268 I269 V270 | L74-V266 HydrophobicContact CD2-CG1 4.25Å; P77-V266 HydrophobicContact CB-CG2 3.91Å; P77-V266 HydrophobicContact CG-CG1 4.48Å; P77-V266 HydrophobicContact CG-CG2 4.19Å; L78-V266 HydrophobicContact CB-CG1 4.02Å; L78-V266 HydrophobicContact CD1-CG1 4.08Å; L262-V266 HydrophobicContact CD1-CG2 4.13Å; L262-V266 HydrophobicContact CG-CG2 4.44Å; L262-V266 VanDerWaalsContact O-CG2 3.25Å; L262-V266 WeakPolarHBondContact O-CG2 3.29Å; L262-V266 PolarHBondContact O-N 3.42Å; N263-V266 PolarHBondContact O-N 2.93Å; V266-K268 VanDerWaalsContact C-N 3.29Å; V266-K268 PolarHBondContact O-N 3.03Å; V266-I269 WeakPolarHBondContact O-CA 3.34Å; V266-I269 WeakPolarHBondContact O-CB 3.44Å; V266-I269 PolarHBondContact O-N 2.88Å; V266-V270 HydrophobicContact CG1-CG2 4.46Å; V266-V270 WeakPolarHBondContact O-CG2 3.34Å; V266-V270 PolarHBondContact O-N 2.68Å |
| 267 | M | 65.9 | Low | 77.6 | Confident | 56 Ų | 56 | 66.8 Ų | 66.8 | 28% | 0.276 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -61.7 | -34.3 | 176.1 | -72.5 | -68.9 | -65.4 | 0 | 0 | 113 | L78 N263 E264 S265 V270 A271 I431 | L78-M267 HydrophobicContact CD1-CG 4.45Å; L78-M267 HydrophobicContact CD1-SD 4.1Å; N263-M267 WeakPolarHBondContact O-CB 3.5Å; N263-M267 WeakPolarHBondContact O-CG 3.24Å; N263-M267 PolarHBondContact O-N 2.97Å; E264-M267 PolarHBondContact O-N 3.22Å; S265-M267 VanDerWaalsContact C-N 3.3Å; S265-M267 PolarHBondContact O-N 3.4Å; M267-V270 WeakPolarHBondContact O-CB 3.41Å; M267-V270 PolarHBondContact O-N 3Å; M267-A271 PolarHBondContact O-N 3.4Å; M267-I431 HydrophobicContact CE-CG2 3.3Å; M267-I431 HydrophobicContact SD-CG2 3.57Å; M267-I431 VanDerWaalsContact SD-CG2 3.57Å |
| 268 | K | 74.9 | Confident | 76.9 | Confident | 149 Ų | 149 | 64.5 Ų | 64.5 | 65% | 0.648 | 33% | 0.334 | S | S | * | . | H | α-helix | trans | -66.3 | -39.3 | 171.5 | -68.2 | 175.4 | -175.3 | 173.6 | 0 | 111.7 | E264 S265 V266 A271 V272 | E264-K268 PolarHBondContact O-N 3.49Å; E264-K268 VanDerWaalsContact O-N 3.16Å; S265-K268 WeakPolarHBondContact O-CB 3.38Å; S265-K268 PolarHBondContact O-N 3.33Å; V266-K268 VanDerWaalsContact C-N 3.29Å; V266-K268 PolarHBondContact O-N 3.03Å; K268-A271 PolarHBondContact O-N 3.45Å; K268-V272 WeakPolarHBondContact O-CG2 2.99Å; K268-V272 PolarHBondContact O-N 3.48Å; K268-V272 VanDerWaalsContact O-N 3.14Å |
| 269 | I | 76.3 | Confident | 76.5 | Confident | 87 Ų | 87 | 63.7 Ų | 63.7 | 45% | 0.446 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -64.3 | -43.1 | 175.3 | -57.4 | 170.1 | 0 | 0 | 0 | 110.4 | L74 S265 V266 A271 V272 A273 | L74-I269 HydrophobicContact CD2-CB 4.13Å; L74-I269 HydrophobicContact CD2-CG2 3.64Å; S265-I269 PolarHBondContact O-N 3.2Å; V266-I269 WeakPolarHBondContact O-CA 3.34Å; V266-I269 WeakPolarHBondContact O-CB 3.44Å; V266-I269 PolarHBondContact O-N 2.88Å; I269-A271 VanDerWaalsContact C-N 3.3Å; I269-A271 PolarHBondContact O-N 3.34Å; I269-V272 PolarHBondContact O-N 3.44Å; I269-A273 PolarHBondContact O-N 2.93Å |
| 270 | V | 63.6 | Low | 76.1 | Confident | 22 Ų | 22 | 63.4 Ų | 63.4 | 13% | 0.133 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -55.7 | -45.3 | 173.5 | 170.5 | 0 | 0 | 0 | 0 | 110.8 | L74 V266 M267 V272 A273 G274 I431 | L74-V270 HydrophobicContact CD1-CG2 3.78Å; V266-V270 HydrophobicContact CG1-CG2 4.46Å; V266-V270 WeakPolarHBondContact O-CG2 3.34Å; V266-V270 PolarHBondContact O-N 2.68Å; M267-V270 WeakPolarHBondContact O-CB 3.41Å; M267-V270 PolarHBondContact O-N 3Å; V270-V272 VanDerWaalsContact C-N 3.32Å; V270-V272 PolarHBondContact O-N 2.71Å; V270-A273 PolarHBondContact O-N 2.92Å; V270-G274 PolarHBondContact O-N 2.89Å; V270-I431 HydrophobicContact CB-CD1 4.46Å; V270-I431 HydrophobicContact CG1-CB 4.34Å; V270-I431 HydrophobicContact CG1-CD1 3.62Å; V270-I431 HydrophobicContact CG1-CG2 4.33Å; V270-I431 HydrophobicContact CG2-CD1 3.98Å |
| 271 | A | 66.8 | Low | 75.6 | Confident | 61 Ų | 61 | 59.5 Ų | 59.5 | 50% | 0.504 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -61.9 | -39 | 179 | 0 | 0 | 0 | 0 | 0 | 112.5 | M267 K268 I269 G274 W275 | M267-A271 PolarHBondContact O-N 3.4Å; K268-A271 PolarHBondContact O-N 3.45Å; I269-A271 VanDerWaalsContact C-N 3.3Å; I269-A271 PolarHBondContact O-N 3.34Å; A271-G274 PolarHBondContact O-N 3.1Å; A271-W275 VanDerWaalsContact O-CD1 3.28Å |
| 272 | V | 76.5 | Confident | 75.4 | Confident | 106 Ų | 106 | 56.5 Ų | 56.5 | 64% | 0.642 | 29% | 0.29 | S | S | * | . | H | α-helix | trans | -66.2 | -46.4 | 174.2 | 175.6 | 0 | 0 | 0 | 0 | 111 | K268 I269 V270 G274 W275 | K268-V272 WeakPolarHBondContact O-CG2 2.99Å; K268-V272 PolarHBondContact O-N 3.48Å; K268-V272 VanDerWaalsContact O-N 3.14Å; I269-V272 PolarHBondContact O-N 3.44Å; V270-V272 VanDerWaalsContact C-N 3.32Å; V270-V272 PolarHBondContact O-N 2.71Å; V272-G274 PolarHBondContact O-N 3.38Å; V272-W275 WeakPolarHBondContact O-CB 3.4Å; V272-W275 PolarHBondContact O-N 3.3Å |
| 273 | A | 68.8 | Low | 75.3 | Confident | 7 Ų | 7 | 55.7 Ų | 55.7 | 6% | 0.058 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -59.7 | -34 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | M70 L74 I269 V270 W275 Y276 F277 | M70-A273 HydrophobicContact CE-CB 3.74Å; L74-A273 HydrophobicContact CD1-CB 4.35Å; I269-A273 PolarHBondContact O-N 2.93Å; V270-A273 PolarHBondContact O-N 2.92Å; A273-W275 PolarHBondContact O-N 3.03Å; A273-Y276 WeakPolarHBondContact O-CB 3.3Å; A273-Y276 PolarHBondContact O-N 3.48Å; A273-F277 PolarHBondContact O-N 3.18Å |
| 274 | G | 66.1 | Low | 75.1 | Confident | 21 Ų | 21 | 54.4 Ų | 54.4 | 22% | 0.216 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -58.7 | -25.9 | 173.9 | 0 | 0 | 0 | 0 | 0 | 114 | L29 V270 A271 V272 F277 | L29-G274 WeakPolarHBondContact CD1-O 3.29Å; V270-G274 PolarHBondContact O-N 2.89Å; A271-G274 PolarHBondContact O-N 3.1Å; V272-G274 PolarHBondContact O-N 3.38Å; G274-F277 WeakPolarHBondContact O-CB 3.33Å; G274-F277 PolarHBondContact O-N 3.03Å |
| 275 | W | 75.7 | Confident | 75.1 | Confident | 179 Ų | 179 | 48.5 Ų | 48.5 | 68% | 0.678 | 25% | 0.25 | S | C | * | . | H | α-helix | trans | -76.1 | -27.8 | 173.5 | -74.5 | 99.1 | 0 | 0 | 0 | 113.4 | L29 A271 V272 A273 F277 P278 | L29-W275 HydrophobicContact CD1-CE3 4.49Å; A271-W275 VanDerWaalsContact O-CD1 3.28Å; V272-W275 WeakPolarHBondContact O-CB 3.4Å; V272-W275 PolarHBondContact O-N 3.3Å; A273-W275 PolarHBondContact O-N 3.03Å; W275-F277 VanDerWaalsContact C-N 3.27Å; W275-P278 WeakPolarHBondContact O-CD 3.2Å |
| 276 | Y | 79 | Confident | 75.2 | Confident | 55 Ų | 55 | 45.5 Ų | 45.5 | 22% | 0.216 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -74.4 | -23.7 | 172.6 | -174.5 | -105.1 | 0 | 0 | 0 | 112 | P63 L67 M70 A273 F279 G280 | P63-Y276 WeakPolarHBondContact CA-OH 3.05Å; P63-Y276 PolarHBondContact O-OH 3Å; P63-Y276 VanDerWaalsContact O-OH 3.07Å; L67-Y276 HydrophobicContact CB-CD1 4.11Å; L67-Y276 HydrophobicContact CB-CE1 3.85Å; L67-Y276 HydrophobicContact CD1-CD1 4.02Å; M70-Y276 HydrophobicContact SD-CD1 3.87Å; M70-Y276 HydrophobicContact SD-CE1 4.27Å; M70-Y276 HydrophobicContact SD-CG 4.35Å; A273-Y276 WeakPolarHBondContact O-CB 3.3Å; A273-Y276 PolarHBondContact O-N 3.48Å; Y276-F279 HydrophobicContact CD2-CD1 4.14Å; Y276-F279 AromaticContact CE2-CD1 3.46Å; Y276-F279 HydrophobicContact CE2-CD1 3.46Å; Y276-F279 VanDerWaalsContact CE2-CD1 3.46Å; Y276-F279 AromaticContact CE2-CE1 3.95Å; Y276-F279 HydrophobicContact CE2-CE1 3.95Å; Y276-F279 AromaticContact CZ-CD1 3.78Å; Y276-F279 WeakPolarHBondContact O-CB 3.5Å; Y276-F279 PolarHBondContact O-N 3.22Å; Y276-G280 PolarHBondContact O-N 3.37Å |
| 277 | F | 70.5 | Confident | 75.4 | Confident | 25 Ų | 25 | 45.1 Ų | 45.1 | 11% | 0.11 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -52 | -48.6 | -173.1 | 178.5 | -112.6 | 0 | 0 | 0 | 115.1 | L67 A273 G274 W275 F279 G280 I281 Q433 | L67-F277 HydrophobicContact CD1-CB 4.47Å; L67-F277 HydrophobicContact CD1-CD2 4.04Å; L67-F277 HydrophobicContact CD2-CD2 3.79Å; L67-F277 HydrophobicContact CD2-CE2 4.19Å; L67-F277 HydrophobicContact CG-CD2 4.49Å; A273-F277 PolarHBondContact O-N 3.18Å; G274-F277 WeakPolarHBondContact O-CB 3.33Å; G274-F277 PolarHBondContact O-N 3.03Å; W275-F277 VanDerWaalsContact C-N 3.27Å; F277-F279 VanDerWaalsContact C-N 3.28Å; F277-F279 PolarHBondContact O-N 3.04Å; F277-G280 PolarHBondContact O-N 3.34Å; F277-I281 HydrophobicContact CD1-CD1 4.16Å; F277-I281 HydrophobicContact CD2-CD1 4.22Å; F277-I281 HydrophobicContact CD2-CG1 4.23Å; F277-I281 HydrophobicContact CE1-CD1 3.45Å; F277-I281 VanDerWaalsContact CE1-CD1 3.45Å; F277-I281 HydrophobicContact CE1-CG1 4.42Å; F277-I281 HydrophobicContact CE2-CD1 3.4Å; F277-I281 VanDerWaalsContact CE2-CD1 3.4Å; F277-I281 HydrophobicContact CE2-CG1 3.66Å; F277-I281 HydrophobicContact CZ-CD1 3.04Å; F277-I281 HydrophobicContact CZ-CG1 3.88Å; F277-I281 PolarHBondContact O-N 2.9Å; F277-Q433 HydrophobicContact CE2-CG 4.23Å; F277-Q433 HydrophobicContact CZ-CG 3.94Å; F277-Q433 VanDerWaalsContact CZ-OE1 3.28Å |
| 278 | P | 76.3 | Confident | 75.6 | Confident | 2 Ų | 2 | 44.2 Ų | 44.2 | 1% | 0.013 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -64.5 | -34.1 | 179.1 | -22 | 36.8 | 0 | 0 | 0 | 112.3 | L29 L32 S36 W275 | L29-P278 HydrophobicContact CD1-CG 3.85Å; L32-P278 HydrophobicContact CB-CB 4.15Å; L32-P278 HydrophobicContact CB-CG 4.17Å; L32-P278 HydrophobicContact CD2-CB 3.78Å; L32-P278 HydrophobicContact CD2-CG 3.77Å; L32-P278 HydrophobicContact CG-CB 3.55Å; L32-P278 HydrophobicContact CG-CG 3.91Å; S36-P278 WeakPolarHBondContact CB-O 3.18Å; S36-P278 VanDerWaalsContact OG-C 3.22Å; S36-P278 WeakPolarHBondContact OG-CA 3.48Å; S36-P278 WeakPolarHBondContact OG-CB 3.41Å; S36-P278 PolarHBondContact OG-O 3.01Å; W275-P278 WeakPolarHBondContact O-CD 3.2Å |
| 279 | F | 85.3 | Confident | 75.8 | Confident | 107 Ų | 107 | 37.9 Ų | 37.9 | 47% | 0.469 | 19% | 0.194 | S | C | . | . | H | α-helix | trans | -68.3 | -49 | 176.3 | 178.8 | -101.3 | 0 | 0 | 0 | 111.1 | P63 Y276 F277 I281 V282 F283 | P63-F279 HydrophobicContact CB-CD1 4.41Å; P63-F279 HydrophobicContact CB-CE1 3.81Å; P63-F279 HydrophobicContact CG-CE1 4.39Å; Y276-F279 HydrophobicContact CD2-CD1 4.14Å; Y276-F279 AromaticContact CE2-CD1 3.46Å; Y276-F279 HydrophobicContact CE2-CD1 3.46Å; Y276-F279 VanDerWaalsContact CE2-CD1 3.46Å; Y276-F279 AromaticContact CE2-CE1 3.95Å; Y276-F279 HydrophobicContact CE2-CE1 3.95Å; Y276-F279 AromaticContact CZ-CD1 3.78Å; Y276-F279 WeakPolarHBondContact O-CB 3.5Å; Y276-F279 PolarHBondContact O-N 3.22Å; F277-F279 VanDerWaalsContact C-N 3.28Å; F277-F279 PolarHBondContact O-N 3.04Å; F279-I281 VanDerWaalsContact C-N 3.33Å; F279-I281 PolarHBondContact O-N 3.45Å; F279-V282 PolarHBondContact O-N 2.84Å; F279-F283 HydrophobicContact CD1-CE2 4.38Å; F279-F283 AromaticContact CD2-CE2 3.97Å; F279-F283 HydrophobicContact CD2-CE2 3.97Å; F279-F283 HydrophobicContact CE1-CD2 4.38Å; F279-F283 AromaticContact CE1-CE2 3.96Å; F279-F283 HydrophobicContact CE1-CE2 3.96Å; F279-F283 AromaticContact CE2-CE2 3.49Å; F279-F283 HydrophobicContact CE2-CE2 3.49Å; F279-F283 VanDerWaalsContact CE2-CE2 3.49Å; F279-F283 HydrophobicContact CE2-CZ 4.09Å; F279-F283 HydrophobicContact CG-CE2 4.4Å; F279-F283 HydrophobicContact CZ-CD2 4.33Å; F279-F283 AromaticContact CZ-CE2 3.48Å; F279-F283 HydrophobicContact CZ-CE2 3.48Å; F279-F283 VanDerWaalsContact CZ-CE2 3.48Å; F279-F283 HydrophobicContact CZ-CZ 4.05Å; F279-F283 WeakPolarHBondContact O-CD2 3.37Å |
| 280 | G | 79.3 | Confident | 76 | Confident | 0 Ų | 0 | 34.7 Ų | 34.7 | 0% | 0 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -61.4 | -36.7 | 179.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | G64 Y276 F277 V282 F283 L284 | G64-G280 WeakPolarHBondContact CA-O 3.49Å; Y276-G280 PolarHBondContact O-N 3.37Å; F277-G280 PolarHBondContact O-N 3.34Å; G280-V282 VanDerWaalsContact C-N 3.31Å; G280-V282 PolarHBondContact O-N 3.28Å; G280-F283 PolarHBondContact O-N 3.05Å; G280-L284 WeakPolarHBondContact O-CB 3.49Å; G280-L284 PolarHBondContact O-N 3.33Å |
| 281 | I | 74.9 | Confident | 76.6 | Confident | 1 Ų | 1 | 38 Ų | 38 | 1% | 0.005 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -57.9 | -40.8 | 177 | -85.6 | -172.1 | 0 | 0 | 0 | 112.7 | V37 L67 F277 F279 F283 L284 I285 W461 | V37-I281 HydrophobicContact CG2-CG2 3.8Å; L67-I281 HydrophobicContact CD2-CG1 4.44Å; F277-I281 HydrophobicContact CD1-CD1 4.16Å; F277-I281 HydrophobicContact CD2-CD1 4.22Å; F277-I281 HydrophobicContact CD2-CG1 4.23Å; F277-I281 HydrophobicContact CE1-CD1 3.45Å; F277-I281 VanDerWaalsContact CE1-CD1 3.45Å; F277-I281 HydrophobicContact CE1-CG1 4.42Å; F277-I281 HydrophobicContact CE2-CD1 3.4Å; F277-I281 VanDerWaalsContact CE2-CD1 3.4Å; F277-I281 HydrophobicContact CE2-CG1 3.66Å; F277-I281 HydrophobicContact CZ-CD1 3.04Å; F277-I281 HydrophobicContact CZ-CG1 3.88Å; F277-I281 PolarHBondContact O-N 2.9Å; F279-I281 VanDerWaalsContact C-N 3.33Å; F279-I281 PolarHBondContact O-N 3.45Å; I281-F283 VanDerWaalsContact C-N 3.31Å; I281-F283 PolarHBondContact O-N 2.96Å; I281-L284 PolarHBondContact O-N 3.37Å; I281-I285 HydrophobicContact CG2-CD1 3.64Å; I281-I285 HydrophobicContact CG2-CG1 4.21Å; I281-I285 WeakPolarHBondContact O-CB 3.46Å; I281-I285 WeakPolarHBondContact O-CG1 3.29Å; I281-I285 PolarHBondContact O-N 2.93Å; I281-W461 HydrophobicContact CD1-CB 4.42Å |
| 282 | V | 83.7 | Confident | 76.8 | Confident | 16 Ų | 16 | 36.6 Ų | 36.6 | 10% | 0.097 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -56 | -50.8 | -177.4 | 173.4 | 0 | 0 | 0 | 0 | 109.8 | S36 V39 G40 L43 F279 G280 A286 | S36-V282 WeakPolarHBondContact O-CG2 3.48Å; V39-V282 HydrophobicContact CG1-CG1 4.08Å; V39-V282 HydrophobicContact CG1-CG2 4.46Å; G40-V282 WeakPolarHBondContact CA-O 3.1Å; L43-V282 HydrophobicContact CD2-CG1 4.1Å; F279-V282 PolarHBondContact O-N 2.84Å; G280-V282 VanDerWaalsContact C-N 3.31Å; G280-V282 PolarHBondContact O-N 3.28Å; V282-A286 WeakPolarHBondContact O-CB 3.36Å; V282-A286 PolarHBondContact O-N 2.84Å |
| 283 | F | 86.1 | Confident | 76.5 | Confident | 41 Ų | 41 | 39.1 Ų | 39.1 | 18% | 0.18 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -74.7 | -34.2 | -177.3 | -63 | -85.2 | 0 | 0 | 0 | 112.6 | F60 P63 F279 G280 I281 G287 | F60-F283 HydrophobicContact CD2-CD1 4.26Å; F60-F283 HydrophobicContact CD2-CE1 4.45Å; F60-F283 HydrophobicContact CE1-CD1 4.3Å; F60-F283 AromaticContact CE2-CD1 3.82Å; F60-F283 HydrophobicContact CE2-CD1 3.82Å; F60-F283 AromaticContact CE2-CE1 3.91Å; F60-F283 HydrophobicContact CE2-CE1 3.91Å; F60-F283 AromaticContact CZ-CD1 3.83Å; F60-F283 HydrophobicContact CZ-CD1 3.83Å; F60-F283 HydrophobicContact CZ-CE1 4.28Å; F60-F283 WeakPolarHBondContact O-CD1 3.48Å; P63-F283 HydrophobicContact CB-CB 4.08Å; P63-F283 HydrophobicContact CB-CD2 3.65Å; P63-F283 HydrophobicContact CB-CE2 4.26Å; P63-F283 HydrophobicContact CB-CG 3.84Å; P63-F283 HydrophobicContact CG-CB 4.35Å; P63-F283 HydrophobicContact CG-CD1 4.1Å; P63-F283 HydrophobicContact CG-CD2 3.97Å; P63-F283 HydrophobicContact CG-CE1 4.41Å; P63-F283 HydrophobicContact CG-CE2 4.31Å; P63-F283 HydrophobicContact CG-CG 3.86Å; F279-F283 HydrophobicContact CD1-CE2 4.38Å; F279-F283 AromaticContact CD2-CE2 3.97Å; F279-F283 HydrophobicContact CD2-CE2 3.97Å; F279-F283 HydrophobicContact CE1-CD2 4.38Å; F279-F283 AromaticContact CE1-CE2 3.96Å; F279-F283 HydrophobicContact CE1-CE2 3.96Å; F279-F283 AromaticContact CE2-CE2 3.49Å; F279-F283 HydrophobicContact CE2-CE2 3.49Å; F279-F283 VanDerWaalsContact CE2-CE2 3.49Å; F279-F283 HydrophobicContact CE2-CZ 4.09Å; F279-F283 HydrophobicContact CG-CE2 4.4Å; F279-F283 HydrophobicContact CZ-CD2 4.33Å; F279-F283 AromaticContact CZ-CE2 3.48Å; F279-F283 HydrophobicContact CZ-CE2 3.48Å; F279-F283 VanDerWaalsContact CZ-CE2 3.48Å; F279-F283 HydrophobicContact CZ-CZ 4.05Å; F279-F283 WeakPolarHBondContact O-CD2 3.37Å; G280-F283 PolarHBondContact O-N 3.05Å; I281-F283 VanDerWaalsContact C-N 3.31Å; I281-F283 PolarHBondContact O-N 2.96Å; F283-G287 WeakPolarHBondContact O-CA 3.24Å; F283-G287 PolarHBondContact O-N 3.48Å |
| 284 | L | 74.2 | Confident | 76.8 | Confident | 10 Ų | 10 | 42.5 Ų | 42.5 | 5% | 0.052 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -64 | -49.7 | 176.4 | -166.3 | 155.7 | 0 | 0 | 0 | 110.8 | M68 G280 I281 K288 I457 | M68-L284 HydrophobicContact CG-CD1 3.72Å; M68-L284 HydrophobicContact SD-CD1 3.78Å; G280-L284 WeakPolarHBondContact O-CB 3.49Å; G280-L284 PolarHBondContact O-N 3.33Å; I281-L284 PolarHBondContact O-N 3.37Å; L284-K288 HydrophobicContact CD2-CG 4.46Å; L284-K288 VanDerWaalsContact O-CG 3.28Å; L284-K288 WeakPolarHBondContact O-CG 3.35Å; L284-K288 PolarHBondContact O-N 3.45Å; L284-I457 HydrophobicContact CD1-CD1 3.97Å; L284-I457 HydrophobicContact CD1-CG2 4.06Å; L284-I457 HydrophobicContact CD2-CB 3.81Å; L284-I457 HydrophobicContact CD2-CD1 4.11Å; L284-I457 HydrophobicContact CD2-CG2 3.52Å; L284-I457 HydrophobicContact CG-CG2 4.43Å |
| 285 | I | 77.1 | Confident | 77 | Confident | 3 Ų | 3 | 42.6 Ų | 42.6 | 2% | 0.015 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -66.7 | -50.7 | 178.7 | -66.6 | -178.7 | 0 | 0 | 0 | 110.8 | V37 I281 G287 K288 I289 A458 | V37-I285 HydrophobicContact CB-CD1 4.15Å; V37-I285 HydrophobicContact CG1-CD1 3.96Å; V37-I285 HydrophobicContact CG2-CD1 3.86Å; I281-I285 HydrophobicContact CG2-CD1 3.64Å; I281-I285 HydrophobicContact CG2-CG1 4.21Å; I281-I285 WeakPolarHBondContact O-CB 3.46Å; I281-I285 WeakPolarHBondContact O-CG1 3.29Å; I281-I285 PolarHBondContact O-N 2.93Å; I285-G287 VanDerWaalsContact C-N 3.29Å; I285-G287 PolarHBondContact O-N 3.28Å; I285-K288 PolarHBondContact O-N 3.43Å; I285-I289 HydrophobicContact CG2-CD1 3.9Å; I285-I289 WeakPolarHBondContact O-CG1 3.26Å; I285-I289 PolarHBondContact O-N 3.49Å; I285-A458 HydrophobicContact CD1-CB 4.12Å; I285-A458 HydrophobicContact CG1-CB 3.89Å; I285-A458 HydrophobicContact CG2-CB 4.47Å |
| 286 | A | 84 | Confident | 77.1 | Confident | 0 Ų | 0 | 42.6 Ų | 42.6 | 0% | 0 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -59.1 | -44 | -179.2 | 0 | 0 | 0 | 0 | 0 | 111.2 | G40 L43 F60 V282 I289 L290 | G40-A286 WeakPolarHBondContact O-CA 3.4Å; G40-A286 VanDerWaalsContact O-CB 3.31Å; G40-A286 WeakPolarHBondContact O-CB 3.47Å; L43-A286 HydrophobicContact CB-CB 4.34Å; L43-A286 HydrophobicContact CD2-CB 4.48Å; L43-A286 HydrophobicContact CG-CB 4.39Å; F60-A286 HydrophobicContact CE1-CB 3.59Å; F60-A286 HydrophobicContact CZ-CB 3.83Å; V282-A286 WeakPolarHBondContact O-CB 3.36Å; V282-A286 PolarHBondContact O-N 2.84Å; A286-I289 PolarHBondContact O-N 3.09Å; A286-L290 WeakPolarHBondContact O-CG 3.48Å; A286-L290 PolarHBondContact O-N 2.79Å |
| 287 | G | 77.9 | Confident | 76.9 | Confident | 0 Ų | 0 | 41.3 Ų | 41.3 | 0% | 0 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -62.2 | -42.2 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.8 | Q61 F283 I285 L290 E291 | Q61-G287 VanDerWaalsContact CG-CA 3.49Å; Q61-G287 PolarHBondContact NE2-O 3.13Å; F283-G287 WeakPolarHBondContact O-CA 3.24Å; F283-G287 PolarHBondContact O-N 3.48Å; I285-G287 VanDerWaalsContact C-N 3.29Å; I285-G287 PolarHBondContact O-N 3.28Å; G287-L290 WeakPolarHBondContact O-CB 3.49Å; G287-L290 PolarHBondContact O-N 3.05Å; G287-L290 VanDerWaalsContact O-N 3.15Å; G287-E291 PolarHBondContact O-N 2.48Å |
| 288 | K | 71.4 | Confident | 77.2 | Confident | 36 Ų | 36 | 41.9 Ų | 41.9 | 16% | 0.157 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -67.1 | -38.2 | 176.5 | -69.6 | -69.4 | 147.3 | -171.8 | 0 | 111.9 | L284 I285 L290 E291 M292 N454 | L284-K288 HydrophobicContact CD2-CG 4.46Å; L284-K288 VanDerWaalsContact O-CG 3.28Å; L284-K288 WeakPolarHBondContact O-CG 3.35Å; L284-K288 PolarHBondContact O-N 3.45Å; I285-K288 PolarHBondContact O-N 3.43Å; K288-L290 PolarHBondContact O-N 3.09Å; K288-E291 WeakPolarHBondContact CD-OE2 3.38Å; K288-E291 WeakPolarHBondContact CE-OE2 3.47Å; K288-E291 IonicContact NZ-OE1 2.81Å; K288-E291 IonicContact NZ-OE2 2.86Å; K288-E291 PolarHBondContact NZ-OE2 2.99Å; K288-E291 PolarHBondContact O-N 2.85Å; K288-E291 VanDerWaalsContact O-N 3.11Å; K288-M292 WeakPolarHBondContact O-CG 3.43Å; K288-M292 PolarHBondContact O-N 3.49Å; K288-M292 VanDerWaalsContact O-SD 3.39Å; K288-N454 HydrophobicContact CD-CB 3.6Å; K288-N454 VanDerWaalsContact CE-CB 3.41Å; K288-N454 HydrophobicContact CG-CB 4.17Å |
| 289 | I | 78.5 | Confident | 77.3 | Confident | 16 Ų | 16 | 43.7 Ų | 43.7 | 8% | 0.082 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -59.1 | -30.3 | 173.1 | -67.5 | 168.4 | 0 | 0 | 0 | 111.9 | C41 F45 R48 I285 A286 M292 | C41-I289 HydrophobicContact CB-CD1 4.42Å; F45-I289 HydrophobicContact CD1-CG2 4.23Å; F45-I289 HydrophobicContact CD2-CD1 4.48Å; F45-I289 HydrophobicContact CE1-CG2 4.35Å; F45-I289 HydrophobicContact CE2-CD1 4.31Å; F45-I289 HydrophobicContact CG-CG2 4.43Å; R48-I289 PolarHBondContact NH1-O 3.29Å; I285-I289 HydrophobicContact CG2-CD1 3.9Å; I285-I289 WeakPolarHBondContact O-CG1 3.26Å; I285-I289 PolarHBondContact O-N 3.49Å; A286-I289 PolarHBondContact O-N 3.09Å; I289-M292 HydrophobicContact CG1-SD 4.45Å |
| 290 | L | 81.3 | Confident | 77.2 | Confident | 20 Ų | 20 | 43.6 Ų | 43.6 | 11% | 0.105 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -74.2 | -34.5 | 176.3 | -67.2 | 170.9 | 0 | 0 | 0 | 113.4 | L47 R48 L52 I57 F60 A286 G287 K288 | L47-L290 HydrophobicContact CB-CD1 4.08Å; L47-L290 HydrophobicContact CB-CD2 3.74Å; L47-L290 HydrophobicContact CB-CG 4.39Å; L47-L290 HydrophobicContact CD1-CD1 4.25Å; R48-L290 HydrophobicContact CB-CD2 4.02Å; R48-L290 VanDerWaalsContact N-CD2 3.3Å; L52-L290 HydrophobicContact CD1-CD1 4Å; L52-L290 HydrophobicContact CD1-CD2 4.33Å; I57-L290 HydrophobicContact CD1-CB 4.26Å; I57-L290 HydrophobicContact CG1-CB 4.28Å; I57-L290 HydrophobicContact CG1-CD1 4.4Å; I57-L290 HydrophobicContact CG2-CB 4.2Å; F60-L290 HydrophobicContact CD1-CD1 3.97Å; F60-L290 HydrophobicContact CE1-CD1 4.2Å; A286-L290 WeakPolarHBondContact O-CG 3.48Å; A286-L290 PolarHBondContact O-N 2.79Å; G287-L290 WeakPolarHBondContact O-CB 3.49Å; G287-L290 PolarHBondContact O-N 3.05Å; G287-L290 VanDerWaalsContact O-N 3.15Å; K288-L290 PolarHBondContact O-N 3.09Å |
| 291 | E | 74.9 | Confident | 77.4 | Confident | 92 Ų | 92 | 45 Ų | 45 | 43% | 0.43 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -75.7 | -25 | 178.9 | -73.5 | 177.3 | 179.5 | 0 | 0 | 113.9 | I57 Q61 G287 K288 | I57-E291 HydrophobicContact CG2-CG 4.25Å; Q61-E291 PolarHBondContact NE2-OE1 3.3Å; Q61-E291 PolarHBondContact OE1-OE1 2.97Å; Q61-E291 VanDerWaalsContact OE1-OE1 3.09Å; G287-E291 PolarHBondContact O-N 2.48Å; K288-E291 WeakPolarHBondContact CD-OE2 3.38Å; K288-E291 WeakPolarHBondContact CE-OE2 3.47Å; K288-E291 IonicContact NZ-OE1 2.81Å; K288-E291 IonicContact NZ-OE2 2.86Å; K288-E291 PolarHBondContact NZ-OE2 2.99Å; K288-E291 PolarHBondContact O-N 2.85Å; K288-E291 VanDerWaalsContact O-N 3.11Å |
| 292 | M | 71.7 | Confident | 77.9 | Confident | 32 Ų | 32 | 45.8 Ų | 45.8 | 16% | 0.158 | 24% | 0.239 | C | C | . | . | trans | -70.8 | 136.1 | -175.2 | -65.6 | 157.3 | 113.8 | 0 | 0 | 111.2 | R48 K288 I289 V298 L455 | R48-M292 PolarHBondContact NH1-O 3.37Å; R48-M292 PolarHBondContact NH2-O 3.5Å; K288-M292 WeakPolarHBondContact O-CG 3.43Å; K288-M292 PolarHBondContact O-N 3.49Å; K288-M292 VanDerWaalsContact O-SD 3.39Å; I289-M292 HydrophobicContact CG1-SD 4.45Å; M292-V298 HydrophobicContact CE-CB 3.3Å; M292-V298 HydrophobicContact CE-CG1 3.01Å; M292-V298 HydrophobicContact CE-CG2 3.97Å; M292-L455 HydrophobicContact CE-CD2 4.45Å | ||
| 293 | D | 69.7 | Low | 78.1 | Confident | 158 Ų | 158 | 46.8 Ų | 46.8 | 85% | 0.845 | 25% | 0.252 | S | S | * | . | S | Bend | trans | -75.9 | -38.5 | 176.1 | -65 | -51.7 | 0 | 0 | 0 | 113.1 | R48 | R48-D293 VanDerWaalsContact NH2-C 3.34Å; R48-D293 PolarHBondContact NH2-O 2.89Å |
| 294 | D | 74.8 | Confident | 78.3 | Confident | 78 Ų | 78 | 48.9 Ų | 48.9 | 42% | 0.417 | 26% | 0.261 | S | S | . | . | trans | -128.6 | 98.1 | 174.8 | -176.9 | 5.2 | 0 | 0 | 0 | 112.6 | K296 A297 V298 | D294-K296 PolarHBondContact O-N 3.06Å; D294-K296 WeakPolarHBondContact OD1-CB 3.36Å; D294-K296 PolarHBondContact OD1-N 3.13Å; D294-A297 HydrophobicContact CB-CB 4.12Å; D294-A297 PolarHBondContact O-N 2.72Å; D294-A297 PolarHBondContact OD1-N 3.07Å; D294-A297 WeakPolarHBondContact OD2-CB 3.38Å; D294-A297 PolarHBondContact OD2-N 3.32Å; D294-V298 WeakPolarHBondContact O-CG2 3.34Å; D294-V298 PolarHBondContact O-N 3.17Å; D294-V298 VanDerWaalsContact O-N 3.14Å | ||
| 295 | P | 71.4 | Confident | 79.2 | Confident | 23 Ų | 23 | 48.4 Ų | 48.4 | 15% | 0.149 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -61.6 | -27.7 | 178.2 | -24.2 | 34 | 0 | 0 | 0 | 114.2 | F45 R48 G299 | F45-P295 HydrophobicContact CE1-CB 3.68Å; F45-P295 HydrophobicContact CE1-CG 4.29Å; F45-P295 HydrophobicContact CZ-CB 4.21Å; R48-P295 VanDerWaalsContact CZ-CG 3.45Å; P295-G299 WeakPolarHBondContact O-CA 3.36Å; P295-G299 PolarHBondContact O-N 3.08Å |
| 296 | K | 77.1 | Confident | 79.9 | Confident | 180 Ų | 180 | 49.1 Ų | 49.1 | 78% | 0.783 | 27% | 0.265 | S | S | * | . | H | α-helix | trans | -74.5 | -47.5 | -178.7 | -68.4 | -177.1 | -179.1 | 178.5 | 0 | 110.5 | D294 G299 K300 | D294-K296 PolarHBondContact O-N 3.06Å; D294-K296 WeakPolarHBondContact OD1-CB 3.36Å; D294-K296 PolarHBondContact OD1-N 3.13Å; K296-G299 PolarHBondContact O-N 3.31Å; K296-K300 PolarHBondContact O-N 2.92Å |
| 297 | A | 75.3 | Confident | 80.4 | Confident | 28 Ų | 28 | 52.9 Ų | 52.9 | 23% | 0.231 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -62.1 | -45.4 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | D294 K300 K301 | D294-A297 HydrophobicContact CB-CB 4.12Å; D294-A297 PolarHBondContact O-N 2.72Å; D294-A297 PolarHBondContact OD1-N 3.07Å; D294-A297 WeakPolarHBondContact OD2-CB 3.38Å; D294-A297 PolarHBondContact OD2-N 3.32Å; A297-K300 WeakPolarHBondContact O-CB 3.41Å; A297-K300 PolarHBondContact O-N 3.33Å; A297-K301 WeakPolarHBondContact O-CG 3.5Å; A297-K301 PolarHBondContact O-N 3Å |
| 298 | V | 76.6 | Confident | 81.2 | Confident | 36 Ų | 36 | 52.9 Ų | 52.9 | 22% | 0.218 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -72.3 | -37.2 | -179.8 | -172.1 | 0 | 0 | 0 | 0 | 111.9 | M292 D294 K300 K301 L302 | M292-V298 HydrophobicContact CE-CB 3.3Å; M292-V298 HydrophobicContact CE-CG1 3.01Å; M292-V298 HydrophobicContact CE-CG2 3.97Å; D294-V298 WeakPolarHBondContact O-CG2 3.34Å; D294-V298 PolarHBondContact O-N 3.17Å; D294-V298 VanDerWaalsContact O-N 3.14Å; V298-K300 VanDerWaalsContact C-N 3.25Å; V298-K300 PolarHBondContact O-N 3.23Å; V298-K301 PolarHBondContact O-N 3.29Å; V298-L302 WeakPolarHBondContact O-CB 3.48Å; V298-L302 PolarHBondContact O-N 2.96Å |
| 299 | G | 78.9 | Confident | 82.4 | Confident | 40 Ų | 40 | 51.2 Ų | 51.2 | 41% | 0.412 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -57.8 | -39.1 | 172.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | P295 K296 G303 | P295-G299 WeakPolarHBondContact O-CA 3.36Å; P295-G299 PolarHBondContact O-N 3.08Å; K296-G299 PolarHBondContact O-N 3.31Å; G299-G303 PolarHBondContact O-N 3.18Å |
| 300 | K | 83.2 | Confident | 83.2 | Confident | 106 Ų | 106 | 52.6 Ų | 52.6 | 46% | 0.461 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -63.3 | -50.9 | 172.7 | -172.9 | -172.9 | 179 | -161.6 | 0 | 111.5 | A129 K296 A297 V298 L302 G303 F304 | A129-K300 PolarHBondContact O-NZ 2.8Å; K296-K300 PolarHBondContact O-N 2.92Å; A297-K300 WeakPolarHBondContact O-CB 3.41Å; A297-K300 PolarHBondContact O-N 3.33Å; V298-K300 VanDerWaalsContact C-N 3.25Å; V298-K300 PolarHBondContact O-N 3.23Å; K300-L302 VanDerWaalsContact C-N 3.29Å; K300-L302 PolarHBondContact O-N 3.2Å; K300-G303 PolarHBondContact O-N 3.2Å; K300-F304 HydrophobicContact CD-CE2 4.47Å; K300-F304 HydrophobicContact CG-CD2 3.96Å; K300-F304 HydrophobicContact CG-CE2 3.92Å; K300-F304 WeakPolarHBondContact O-CD2 3.46Å; K300-F304 PolarHBondContact O-N 3.41Å |
| 301 | K | 83.6 | Confident | 83.9 | Confident | 28 Ų | 28 | 54 Ų | 54 | 12% | 0.122 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -54.9 | -46.7 | 177.3 | -70.5 | 179.3 | 175.8 | -171 | 0 | 111.2 | G127 A130 A297 V298 F304 Y305 F400 V404 | G127-K301 WeakPolarHBondContact O-CE 3.49Å; A130-K301 HydrophobicContact CB-CD 4.16Å; A130-K301 HydrophobicContact CB-CG 3.63Å; A297-K301 WeakPolarHBondContact O-CG 3.5Å; A297-K301 PolarHBondContact O-N 3Å; V298-K301 PolarHBondContact O-N 3.29Å; K301-F304 PolarHBondContact O-N 2.86Å; K301-Y305 WeakPolarHBondContact O-CB 3.29Å; K301-Y305 PolarHBondContact O-N 2.83Å; K301-F400 HydrophobicContact CB-CE2 4.16Å; K301-F400 HydrophobicContact CB-CZ 4.23Å; K301-V404 HydrophobicContact CD-CG2 4.26Å |
| 302 | L | 84.7 | Confident | 85 | Confident | 19 Ų | 19 | 49.6 Ų | 49.6 | 10% | 0.099 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -68.6 | -34.9 | -179 | -168.4 | 64.2 | 0 | 0 | 0 | 112.6 | V298 K300 Y305 A306 L455 I456 A458 V459 | V298-L302 WeakPolarHBondContact O-CB 3.48Å; V298-L302 PolarHBondContact O-N 2.96Å; K300-L302 VanDerWaalsContact C-N 3.29Å; K300-L302 PolarHBondContact O-N 3.2Å; L302-Y305 HydrophobicContact CD1-CD1 3.87Å; L302-Y305 HydrophobicContact CD1-CE1 4.47Å; L302-Y305 WeakPolarHBondContact O-CB 3.29Å; L302-Y305 PolarHBondContact O-N 3.36Å; L302-A306 WeakPolarHBondContact O-CB 3.38Å; L302-A306 PolarHBondContact O-N 3.48Å; L302-L455 WeakPolarHBondContact CD1-O 3.47Å; L302-I456 HydrophobicContact CD1-CG2 4.19Å; L302-A458 HydrophobicContact CD2-CB 4.45Å; L302-V459 HydrophobicContact CD1-CB 4.48Å; L302-V459 HydrophobicContact CD1-CG2 4.34Å; L302-V459 HydrophobicContact CD2-CB 4.37Å; L302-V459 HydrophobicContact CD2-CG2 3.46Å; L302-V459 VanDerWaalsContact CD2-CG2 3.46Å; L302-V459 HydrophobicContact CG-CB 4.29Å; L302-V459 HydrophobicContact CG-CG2 3.66Å |
| 303 | G | 87.6 | Confident | 86.2 | Confident | 36 Ų | 36 | 48.3 Ų | 48.3 | 37% | 0.371 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -63.5 | -47.6 | 172.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | G299 K300 Y305 A306 V307 | G299-G303 PolarHBondContact O-N 3.18Å; K300-G303 PolarHBondContact O-N 3.2Å; G303-Y305 VanDerWaalsContact C-N 3.31Å; G303-Y305 PolarHBondContact O-N 3.34Å; G303-A306 PolarHBondContact O-N 3.02Å; G303-V307 WeakPolarHBondContact O-CG2 3.47Å; G303-V307 PolarHBondContact O-N 3.34Å |
| 304 | F | 90.3 | Very high | 87.5 | Confident | 86 Ų | 86 | 44.1 Ų | 44.1 | 38% | 0.377 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -62.9 | -38.4 | 175.3 | -87.1 | -81.3 | 0 | 0 | 0 | 112.2 | I124 P126 A129 K300 K301 V307 T308 | I124-F304 HydrophobicContact CG2-CD1 4.17Å; P126-F304 HydrophobicContact CB-CB 3.81Å; A129-F304 HydrophobicContact CB-CD2 4.37Å; K300-F304 HydrophobicContact CD-CE2 4.47Å; K300-F304 HydrophobicContact CG-CD2 3.96Å; K300-F304 HydrophobicContact CG-CE2 3.92Å; K300-F304 WeakPolarHBondContact O-CD2 3.46Å; K300-F304 PolarHBondContact O-N 3.41Å; K301-F304 PolarHBondContact O-N 2.86Å; F304-V307 PolarHBondContact O-N 2.84Å; F304-T308 WeakPolarHBondContact O-CB 3.44Å; F304-T308 PolarHBondContact O-N 3.38Å; F304-T308 PolarHBondContact O-OG1 3.45Å |
| 305 | Y | 92.8 | Very high | 88.6 | Confident | 0 Ų | 0 | 42.5 Ų | 42.5 | 0% | 0 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -58 | -49.7 | 171.7 | 163 | -103.2 | 0 | 0 | 0 | 111.7 | K301 L302 G303 V307 T308 V309 Y393 V396 A397 F400 I456 L463 | K301-Y305 WeakPolarHBondContact O-CB 3.29Å; K301-Y305 PolarHBondContact O-N 2.83Å; L302-Y305 HydrophobicContact CD1-CD1 3.87Å; L302-Y305 HydrophobicContact CD1-CE1 4.47Å; L302-Y305 WeakPolarHBondContact O-CB 3.29Å; L302-Y305 PolarHBondContact O-N 3.36Å; G303-Y305 VanDerWaalsContact C-N 3.31Å; G303-Y305 PolarHBondContact O-N 3.34Å; Y305-V307 VanDerWaalsContact C-N 3.34Å; Y305-V307 PolarHBondContact O-N 3.49Å; Y305-T308 WeakPolarHBondContact O-CB 3.21Å; Y305-T308 PolarHBondContact O-N 3.46Å; Y305-T308 VanDerWaalsContact O-N 3.11Å; Y305-V309 HydrophobicContact CD2-CG2 4.21Å; Y305-V309 HydrophobicContact CE1-CG2 4.44Å; Y305-V309 HydrophobicContact CE2-CG2 3.68Å; Y305-V309 PolarHBondContact O-N 2.63Å; Y305-Y393 WeakPolarHBondContact OH-CD2 3.27Å; Y305-Y393 WeakPolarHBondContact OH-CE2 3.44Å; Y305-V396 HydrophobicContact CD2-CG1 4.11Å; Y305-V396 HydrophobicContact CE2-CG1 3.95Å; Y305-A397 HydrophobicContact CE2-CB 3.61Å; Y305-A397 WeakPolarHBondContact OH-CB 3.31Å; Y305-F400 HydrophobicContact CD2-CB 3.82Å; Y305-F400 AromaticContact CD2-CD1 3.64Å; Y305-F400 HydrophobicContact CD2-CD1 3.64Å; Y305-F400 HydrophobicContact CD2-CD2 4.27Å; Y305-F400 HydrophobicContact CD2-CE1 4.25Å; Y305-F400 AromaticContact CD2-CG 3.64Å; Y305-F400 HydrophobicContact CD2-CG 3.64Å; Y305-F400 HydrophobicContact CE2-CB 4.32Å; Y305-F400 HydrophobicContact CE2-CD1 4.18Å; Y305-F400 HydrophobicContact CE2-CG 4.4Å; Y305-F400 AromaticContact CG-CD1 3.89Å; Y305-F400 HydrophobicContact CG-CD1 3.89Å; Y305-F400 HydrophobicContact CG-CD2 4.44Å; Y305-F400 HydrophobicContact CG-CE1 4.02Å; Y305-F400 HydrophobicContact CG-CG 4.1Å; Y305-F400 HydrophobicContact CG-CZ 4.33Å; Y305-I456 HydrophobicContact CD1-CG2 4.24Å; Y305-I456 HydrophobicContact CE1-CB 4.06Å; Y305-I456 HydrophobicContact CE1-CG2 3.79Å; Y305-L463 HydrophobicContact CD1-CD1 4.4Å; Y305-L463 HydrophobicContact CE1-CD1 3.69Å |
| 306 | A | 92.2 | Very high | 89.8 | Confident | 18 Ų | 18 | 41.4 Ų | 41.4 | 15% | 0.149 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -60.2 | -43.8 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | L302 G303 T308 V309 V310 V459 L463 | L302-A306 WeakPolarHBondContact O-CB 3.38Å; L302-A306 PolarHBondContact O-N 3.48Å; G303-A306 PolarHBondContact O-N 3.02Å; A306-T308 VanDerWaalsContact C-N 3.34Å; A306-T308 PolarHBondContact O-N 3.38Å; A306-V309 PolarHBondContact O-N 2.98Å; A306-V310 WeakPolarHBondContact O-CG2 2.83Å; A306-V310 PolarHBondContact O-N 2.82Å; A306-V459 HydrophobicContact CB-CG1 3.67Å; A306-L463 HydrophobicContact CB-CD2 4.23Å |
| 307 | V | 93.9 | Very high | 90.7 | Very high | 79 Ų | 79 | 32.8 Ų | 32.8 | 48% | 0.479 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -60 | -44.5 | 174.1 | 171.1 | 0 | 0 | 0 | 0 | 110.9 | G303 F304 Y305 V309 V310 C311 | G303-V307 WeakPolarHBondContact O-CG2 3.47Å; G303-V307 PolarHBondContact O-N 3.34Å; F304-V307 PolarHBondContact O-N 2.84Å; Y305-V307 VanDerWaalsContact C-N 3.34Å; Y305-V307 PolarHBondContact O-N 3.49Å; V307-V309 PolarHBondContact O-N 3.33Å; V307-V310 PolarHBondContact O-N 2.92Å; V307-C311 VanDerWaalsContact O-CB 3.26Å; V307-C311 WeakPolarHBondContact O-CB 3.33Å; V307-C311 PolarHBondContact O-N 3.13Å; V307-C311 PolarHBondContact O-SG 3.47Å |
| 308 | T | 95.8 | Very high | 91.6 | Very high | 0 Ų | 0 | 36.2 Ų | 36.2 | 0% | 0 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -58 | -48.2 | 178.4 | -56.5 | 0 | 0 | 0 | 0 | 111.4 | M120 V121 I124 F304 Y305 A306 G312 V396 | M120-T308 HydrophobicContact CB-CG2 4.25Å; M120-T308 HydrophobicContact CG-CG2 3.88Å; V121-T308 HydrophobicContact CB-CG2 3.98Å; V121-T308 HydrophobicContact CG2-CG2 4.38Å; I124-T308 HydrophobicContact CD1-CG2 4.18Å; I124-T308 WeakPolarHBondContact CG2-OG1 3.38Å; F304-T308 WeakPolarHBondContact O-CB 3.44Å; F304-T308 PolarHBondContact O-N 3.38Å; F304-T308 PolarHBondContact O-OG1 3.45Å; Y305-T308 WeakPolarHBondContact O-CB 3.21Å; Y305-T308 PolarHBondContact O-N 3.46Å; Y305-T308 VanDerWaalsContact O-N 3.11Å; A306-T308 VanDerWaalsContact C-N 3.34Å; A306-T308 PolarHBondContact O-N 3.38Å; T308-G312 PolarHBondContact O-N 3.34Å; T308-V396 HydrophobicContact CG2-CG1 3.79Å |
| 309 | V | 96.2 | Very high | 92.5 | Very high | 0 Ų | 0 | 39.6 Ų | 39.6 | 0% | 0 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -62.5 | -50.2 | 178.1 | 175 | 0 | 0 | 0 | 0 | 110.6 | Y305 A306 V307 C311 G312 L313 Y393 V396 L463 | Y305-V309 HydrophobicContact CD2-CG2 4.21Å; Y305-V309 HydrophobicContact CE1-CG2 4.44Å; Y305-V309 HydrophobicContact CE2-CG2 3.68Å; Y305-V309 PolarHBondContact O-N 2.63Å; A306-V309 PolarHBondContact O-N 2.98Å; V307-V309 PolarHBondContact O-N 3.33Å; V309-C311 PolarHBondContact O-N 3.11Å; V309-G312 PolarHBondContact O-N 3.39Å; V309-L313 HydrophobicContact CG1-CD1 3.92Å; V309-L313 HydrophobicContact CG1-CG 4.28Å; V309-L313 VanDerWaalsContact O-CG 3.31Å; V309-L313 WeakPolarHBondContact O-CG 3.2Å; V309-L313 PolarHBondContact O-N 2.98Å; V309-Y393 HydrophobicContact CG1-CD2 4.29Å; V309-Y393 HydrophobicContact CG2-CD2 4.4Å; V309-V396 HydrophobicContact CG2-CB 4.13Å; V309-V396 HydrophobicContact CG2-CG1 3.6Å; V309-L463 HydrophobicContact CB-CD1 4.23Å; V309-L463 HydrophobicContact CB-CD2 4.22Å; V309-L463 HydrophobicContact CG1-CD1 4.27Å; V309-L463 HydrophobicContact CG1-CD2 4.16Å; V309-L463 HydrophobicContact CG2-CD1 4.28Å |
| 310 | V | 95.8 | Very high | 93.3 | Very high | 45 Ų | 45 | 39.8 Ų | 39.8 | 27% | 0.273 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -61.9 | -43.7 | -179.1 | 172.7 | 0 | 0 | 0 | 0 | 111.4 | A306 V307 G312 L313 V314 L463 F466 | A306-V310 WeakPolarHBondContact O-CG2 2.83Å; A306-V310 PolarHBondContact O-N 2.82Å; V307-V310 PolarHBondContact O-N 2.92Å; V310-G312 VanDerWaalsContact C-N 3.35Å; V310-G312 PolarHBondContact O-N 3.28Å; V310-L313 PolarHBondContact O-N 3.05Å; V310-V314 HydrophobicContact CG1-CG2 4.32Å; V310-V314 WeakPolarHBondContact O-CB 3.15Å; V310-V314 VanDerWaalsContact O-CG2 3.28Å; V310-V314 WeakPolarHBondContact O-CG2 3.46Å; V310-V314 PolarHBondContact O-N 3.48Å; V310-L463 HydrophobicContact CG2-CD2 3.64Å; V310-F466 HydrophobicContact CG2-CD2 4.33Å |
| 311 | C | 96.4 | Very high | 94 | Very high | 50 Ų | 50 | 34.8 Ų | 34.8 | 34% | 0.338 | 20% | 0.201 | S | C | . | . | H | α-helix | trans | -60.4 | -44.4 | 175.2 | -74.3 | 0 | 0 | 0 | 0 | 111.6 | M120 V307 V309 V314 V315 | M120-C311 HydrophobicContact CE-CB 4.41Å; M120-C311 HydrophobicContact CG-CB 4.41Å; M120-C311 HydrophobicContact SD-CB 4.2Å; V307-C311 VanDerWaalsContact O-CB 3.26Å; V307-C311 WeakPolarHBondContact O-CB 3.33Å; V307-C311 PolarHBondContact O-N 3.13Å; V307-C311 PolarHBondContact O-SG 3.47Å; V309-C311 PolarHBondContact O-N 3.11Å; C311-V314 PolarHBondContact O-N 3.35Å; C311-V315 VanDerWaalsContact O-CG2 3.31Å; C311-V315 WeakPolarHBondContact O-CG2 3.07Å; C311-V315 PolarHBondContact O-N 3.14Å |
| 312 | G | 97.5 | Very high | 94.6 | Very high | 0 Ų | 0 | 33.8 Ų | 33.8 | 0% | 0 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -59.6 | -47.5 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | T308 V309 V310 V314 V315 H316 L392 | T308-G312 PolarHBondContact O-N 3.34Å; V309-G312 PolarHBondContact O-N 3.39Å; V310-G312 VanDerWaalsContact C-N 3.35Å; V310-G312 PolarHBondContact O-N 3.28Å; G312-V314 VanDerWaalsContact C-N 3.34Å; G312-V314 PolarHBondContact O-N 3.43Å; G312-V315 PolarHBondContact O-N 3.04Å; G312-H316 WeakPolarHBondContact O-CB 3.34Å; G312-H316 PolarHBondContact O-N 3.33Å; G312-L392 VanDerWaalsContact C-CD1 3.48Å; G312-L392 WeakPolarHBondContact O-CD1 3.22Å |
| 313 | L | 96.9 | Very high | 95.1 | Very high | 4 Ų | 4 | 37.4 Ų | 37.4 | 2% | 0.021 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -62.4 | -39.3 | 177.3 | -69.3 | 175.6 | 0 | 0 | 0 | 112.4 | V309 V310 G317 G389 L392 F466 R467 I470 | V309-L313 HydrophobicContact CG1-CD1 3.92Å; V309-L313 HydrophobicContact CG1-CG 4.28Å; V309-L313 VanDerWaalsContact O-CG 3.31Å; V309-L313 WeakPolarHBondContact O-CG 3.2Å; V309-L313 PolarHBondContact O-N 2.98Å; V310-L313 PolarHBondContact O-N 3.05Å; L313-G317 WeakPolarHBondContact O-CA 3.3Å; L313-G317 PolarHBondContact O-N 3.46Å; L313-G389 VanDerWaalsContact CD2-CA 3.43Å; L313-L392 HydrophobicContact CD2-CD1 4.48Å; L313-L392 HydrophobicContact CD2-CD2 4.29Å; L313-L392 HydrophobicContact CG-CD2 4.34Å; L313-F466 HydrophobicContact CD1-CB 3.67Å; L313-R467 HydrophobicContact CD1-CG 4.06Å; L313-I470 HydrophobicContact CB-CG1 4.08Å; L313-I470 HydrophobicContact CD2-CB 4.4Å; L313-I470 HydrophobicContact CD2-CG1 4.15Å |
| 314 | V | 96.3 | Very high | 95.5 | Very high | 71 Ų | 71 | 37.1 Ų | 37.1 | 43% | 0.43 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -65.6 | -45.4 | 175.8 | 165 | 0 | 0 | 0 | 0 | 110.9 | V310 C311 G312 L318 | V310-V314 HydrophobicContact CG1-CG2 4.32Å; V310-V314 WeakPolarHBondContact O-CB 3.15Å; V310-V314 VanDerWaalsContact O-CG2 3.28Å; V310-V314 WeakPolarHBondContact O-CG2 3.46Å; V310-V314 PolarHBondContact O-N 3.48Å; C311-V314 PolarHBondContact O-N 3.35Å; G312-V314 VanDerWaalsContact C-N 3.34Å; G312-V314 PolarHBondContact O-N 3.43Å; V314-L318 HydrophobicContact CG1-CD1 4.21Å; V314-L318 WeakPolarHBondContact O-CA 3.47Å; V314-L318 VanDerWaalsContact O-CB 3.3Å; V314-L318 WeakPolarHBondContact O-CB 3.15Å; V314-L318 PolarHBondContact O-N 3.01Å |
| 315 | V | 97.4 | Very high | 95.8 | Very high | 43 Ų | 43 | 33.7 Ų | 33.7 | 26% | 0.261 | 19% | 0.191 | S | C | . | . | I | π-helix | trans | -62.4 | -48.2 | 177.3 | 169.1 | 0 | 0 | 0 | 0 | 110.6 | V116 M120 C311 G312 L319 I320 | V116-V315 HydrophobicContact CG1-CB 4.32Å; V116-V315 HydrophobicContact CG1-CG1 4Å; M120-V315 HydrophobicContact CE-CG2 3.93Å; C311-V315 VanDerWaalsContact O-CG2 3.31Å; C311-V315 WeakPolarHBondContact O-CG2 3.07Å; C311-V315 PolarHBondContact O-N 3.14Å; G312-V315 PolarHBondContact O-N 3.04Å; V315-L319 HydrophobicContact CG1-CD1 4.46Å; V315-L319 HydrophobicContact CG2-CD1 4.41Å; V315-L319 WeakPolarHBondContact O-CA 3.26Å; V315-L319 VanDerWaalsContact O-CB 3.22Å; V315-L319 WeakPolarHBondContact O-CB 3.31Å; V315-L319 PolarHBondContact O-N 3.19Å; V315-L319 VanDerWaalsContact O-N 3.13Å; V315-I320 HydrophobicContact CG1-CD1 4.16Å; V315-I320 PolarHBondContact O-N 3.37Å; V315-I320 VanDerWaalsContact O-N 3.09Å |
| 316 | H | 97.5 | Very high | 96.1 | Very high | 0 Ų | 0 | 38.3 Ų | 38.3 | 0% | 0 | 21% | 0.211 | C | C | . | . | I | π-helix | trans | -64.2 | -52.5 | 178.8 | -173.9 | 64.9 | 0 | 0 | 0 | 112 | T109 G312 I320 L321 D388 L392 | T109-H316 PolarHBondContact O-CE1 3.48Å; G312-H316 WeakPolarHBondContact O-CB 3.34Å; G312-H316 PolarHBondContact O-N 3.33Å; H316-I320 PolarHBondContact O-N 3.36Å; H316-L321 PolarHBondContact O-N 3.26Å; H316-D388 IonicContact CD2-OD2 2.69Å; H316-D388 IonicContact CE1-OD2 3.53Å; H316-D388 WeakPolarHBondContact NE2-CB 3.44Å; H316-D388 IonicContact NE2-OD2 2.68Å; H316-D388 PolarHBondContact NE2-OD2 3.37Å; H316-L392 HydrophobicContact CB-CD1 4.12Å |
| 317 | G | 95.2 | Very high | 96.3 | Very high | 0 Ų | 0 | 41.6 Ų | 41.6 | 0% | 0 | 23% | 0.226 | C | C | . | . | I | π-helix | trans | -73.4 | -38.9 | -172.6 | 0 | 0 | 0 | 0 | 0 | 115.5 | L313 P322 L473 | L313-G317 WeakPolarHBondContact O-CA 3.3Å; L313-G317 PolarHBondContact O-N 3.46Å; G317-P322 WeakPolarHBondContact O-CD 3.43Å; G317-P322 WeakPolarHBondContact O-CG 3.33Å; G317-L473 VanDerWaalsContact O-CD2 3.3Å; G317-L473 WeakPolarHBondContact O-CD2 3.23Å |
| 318 | L | 94.2 | Very high | 96.3 | Very high | 99 Ų | 99 | 40.7 Ų | 40.7 | 52% | 0.518 | 22% | 0.218 | S | C | . | . | I | π-helix | trans | -101 | -17.1 | -175.4 | -58 | -173.2 | 0 | 0 | 0 | 113.7 | V314 P322 | V314-L318 HydrophobicContact CG1-CD1 4.21Å; V314-L318 WeakPolarHBondContact O-CA 3.47Å; V314-L318 VanDerWaalsContact O-CB 3.3Å; V314-L318 WeakPolarHBondContact O-CB 3.15Å; V314-L318 PolarHBondContact O-N 3.01Å; L318-P322 WeakPolarHBondContact O-CG 3.48Å |
| 319 | L | 95.8 | Very high | 96.3 | Very high | 108 Ų | 108 | 40.9 Ų | 40.9 | 57% | 0.565 | 22% | 0.219 | S | C | * | . | I | π-helix | trans | -112.2 | -57.4 | 178.1 | -50.9 | 176.6 | 0 | 0 | 0 | 111.8 | V315 L323 | V315-L319 HydrophobicContact CG1-CD1 4.46Å; V315-L319 HydrophobicContact CG2-CD1 4.41Å; V315-L319 WeakPolarHBondContact O-CA 3.26Å; V315-L319 VanDerWaalsContact O-CB 3.22Å; V315-L319 WeakPolarHBondContact O-CB 3.31Å; V315-L319 PolarHBondContact O-N 3.19Å; V315-L319 VanDerWaalsContact O-N 3.13Å; L319-L323 WeakPolarHBondContact O-CB 3.48Å; L319-L323 PolarHBondContact O-N 3.01Å |
| 320 | I | 96.9 | Very high | 96.2 | Very high | 44 Ų | 44 | 47.8 Ų | 47.8 | 23% | 0.226 | 25% | 0.249 | C | C | . | . | I | π-helix | trans | -72.5 | -52.5 | -169.8 | -63.1 | 172.6 | 0 | 0 | 0 | 112.1 | L112 V116 V315 H316 L323 L324 | L112-I320 HydrophobicContact CD1-CG2 4.47Å; V116-I320 HydrophobicContact CG2-CD1 3.23Å; V315-I320 HydrophobicContact CG1-CD1 4.16Å; V315-I320 PolarHBondContact O-N 3.37Å; V315-I320 VanDerWaalsContact O-N 3.09Å; H316-I320 PolarHBondContact O-N 3.36Å; I320-L323 PolarHBondContact O-N 2.99Å; I320-L324 WeakPolarHBondContact O-CB 3.36Å; I320-L324 PolarHBondContact O-N 3.35Å |
| 321 | L | 96.5 | Very high | 96.1 | Very high | 0 Ų | 0 | 51.5 Ų | 51.5 | 0% | 0 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -61.8 | -45.1 | 179.7 | -62.9 | 177.1 | 0 | 0 | 0 | 112.5 | T109 H316 L323 L324 Y325 I470 L477 | T109-L321 HydrophobicContact CG2-CD2 3.86Å; H316-L321 PolarHBondContact O-N 3.26Å; L321-L323 PolarHBondContact O-N 2.99Å; L321-L324 PolarHBondContact O-N 2.9Å; L321-Y325 PolarHBondContact O-N 3.37Å; L321-I470 HydrophobicContact CD1-CG2 4.41Å; L321-L477 HydrophobicContact CB-CD1 3.66Å |
| 322 | P | 96.5 | Very high | 96 | Very high | 7 Ų | 7 | 53.5 Ų | 53.5 | 5% | 0.045 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -65.4 | -36.9 | 175.8 | -26.3 | 40.4 | 0 | 0 | 0 | 112.7 | G317 L318 Y325 F326 P333 I337 | G317-P322 WeakPolarHBondContact O-CD 3.43Å; G317-P322 WeakPolarHBondContact O-CG 3.33Å; L318-P322 WeakPolarHBondContact O-CG 3.48Å; P322-Y325 PolarHBondContact O-N 3.36Å; P322-F326 WeakPolarHBondContact O-CB 3.29Å; P322-F326 PolarHBondContact O-N 3.44Å; P322-P333 HydrophobicContact CB-CB 3.77Å; P322-P333 HydrophobicContact CB-CG 3.8Å; P322-P333 WeakPolarHBondContact O-CG 3.27Å; P322-I337 HydrophobicContact CB-CD1 4.37Å; P322-I337 HydrophobicContact CG-CD1 3.89Å |
| 323 | L | 96.5 | Very high | 95.9 | Very high | 95 Ų | 95 | 54.1 Ų | 54.1 | 50% | 0.497 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -63 | -45.3 | 174.6 | 177.4 | 63.7 | 0 | 0 | 0 | 111 | L319 I320 L321 Y325 F326 L327 | L319-L323 WeakPolarHBondContact O-CB 3.48Å; L319-L323 PolarHBondContact O-N 3.01Å; I320-L323 PolarHBondContact O-N 2.99Å; L321-L323 PolarHBondContact O-N 2.99Å; L323-Y325 VanDerWaalsContact C-N 3.34Å; L323-Y325 PolarHBondContact O-N 3.33Å; L323-F326 PolarHBondContact O-N 3.33Å; L323-L327 HydrophobicContact CD1-CD1 4.17Å; L323-L327 HydrophobicContact CD1-CG 4.07Å; L323-L327 HydrophobicContact CG-CD1 3.97Å; L323-L327 HydrophobicContact CG-CG 4.3Å; L323-L327 WeakPolarHBondContact O-CB 3.49Å; L323-L327 VanDerWaalsContact O-CG 3.26Å; L323-L327 WeakPolarHBondContact O-CG 3.4Å; L323-L327 PolarHBondContact O-N 3.41Å |
| 324 | L | 95.6 | Very high | 95.8 | Very high | 31 Ų | 31 | 59.2 Ų | 59.2 | 16% | 0.162 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -60.9 | -44.3 | 177.3 | -173 | 61.8 | 0 | 0 | 0 | 111.2 | Y105 T109 I320 L321 F326 L327 I328 | Y105-L324 HydrophobicContact CD2-CD2 4.33Å; Y105-L324 HydrophobicContact CE2-CD2 3.43Å; Y105-L324 VanDerWaalsContact CE2-CD2 3.43Å; Y105-L324 HydrophobicContact CE2-CG 4.11Å; T109-L324 HydrophobicContact CG2-CD2 3.58Å; I320-L324 WeakPolarHBondContact O-CB 3.36Å; I320-L324 PolarHBondContact O-N 3.35Å; L321-L324 PolarHBondContact O-N 2.9Å; L324-F326 PolarHBondContact O-N 2.68Å; L324-L327 PolarHBondContact O-N 3.42Å; L324-I328 HydrophobicContact CD1-CD1 3.85Å; L324-I328 HydrophobicContact CD1-CG1 4.43Å; L324-I328 HydrophobicContact CG-CD1 3.98Å; L324-I328 WeakPolarHBondContact O-CG1 3.32Å; L324-I328 PolarHBondContact O-N 3.15Å; L324-I328 VanDerWaalsContact O-N 3.11Å |
| 325 | Y | 96.9 | Very high | 95.6 | Very high | 13 Ų | 13 | 60.8 Ų | 60.8 | 5% | 0.051 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -57 | -48.3 | 173 | -179.1 | -83.6 | 0 | 0 | 0 | 111.8 | L321 P322 L323 T329 K331 P333 F336 L477 I481 | L321-Y325 PolarHBondContact O-N 3.37Å; P322-Y325 PolarHBondContact O-N 3.36Å; L323-Y325 VanDerWaalsContact C-N 3.34Å; L323-Y325 PolarHBondContact O-N 3.33Å; Y325-T329 HydrophobicContact CD1-CG2 4.47Å; Y325-T329 WeakPolarHBondContact CD1-OG1 3.37Å; Y325-T329 HydrophobicContact CD2-CG2 4.17Å; Y325-T329 HydrophobicContact CE1-CG2 4.3Å; Y325-T329 WeakPolarHBondContact CE1-OG1 3.15Å; Y325-T329 HydrophobicContact CE2-CG2 3.96Å; Y325-T329 HydrophobicContact CG-CG2 4.41Å; Y325-T329 WeakPolarHBondContact O-CB 3.45Å; Y325-T329 WeakPolarHBondContact O-CG2 3.29Å; Y325-T329 PolarHBondContact O-N 2.63Å; Y325-T329 PolarHBondContact O-OG1 3.49Å; Y325-K331 HydrophobicContact CE1-CB 4.08Å; Y325-P333 HydrophobicContact CD1-CB 3.7Å; Y325-P333 HydrophobicContact CE1-CB 4.42Å; Y325-P333 HydrophobicContact CG-CB 4.28Å; Y325-F336 HydrophobicContact CE1-CB 4.42Å; Y325-F336 HydrophobicContact CE2-CD1 4.46Å; Y325-F336 HydrophobicContact CE2-CD2 4.09Å; Y325-F336 HydrophobicContact CE2-CE2 4.33Å; Y325-F336 HydrophobicContact CE2-CG 4.16Å; Y325-F336 AromaticContact CZ-CD2 3.87Å; Y325-F336 AromaticContact CZ-CG 3.99Å; Y325-F336 VanDerWaalsContact OH-CD2 3.26Å; Y325-F336 WeakPolarHBondContact OH-CD2 3.33Å; Y325-L477 HydrophobicContact CD2-CB 4.39Å; Y325-L477 HydrophobicContact CD2-CD2 3.67Å; Y325-L477 HydrophobicContact CE2-CD2 4.3Å; Y325-L477 HydrophobicContact CG-CD2 3.95Å; Y325-I481 HydrophobicContact CD2-CD1 4.22Å; Y325-I481 HydrophobicContact CD2-CG1 3.72Å; Y325-I481 HydrophobicContact CE2-CG1 4.37Å; Y325-I481 HydrophobicContact CG-CG1 4.42Å |
| 326 | F | 97.4 | Very high | 95.6 | Very high | 97 Ų | 97 | 59.3 Ų | 59.3 | 43% | 0.425 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -63.1 | -43.9 | 178.8 | 176 | -103.3 | 0 | 0 | 0 | 112 | P322 L323 L324 I328 K330 K331 P333 | P322-F326 WeakPolarHBondContact O-CB 3.29Å; P322-F326 PolarHBondContact O-N 3.44Å; L323-F326 PolarHBondContact O-N 3.33Å; L324-F326 PolarHBondContact O-N 2.68Å; F326-I328 VanDerWaalsContact C-N 3.32Å; F326-I328 PolarHBondContact O-N 3.09Å; F326-K330 WeakPolarHBondContact O-CA 3.44Å; F326-K330 PolarHBondContact O-N 2.93Å; F326-K331 WeakPolarHBondContact CD2-O 3.31Å; F326-P333 HydrophobicContact CB-CG 4.42Å |
| 327 | L | 96.6 | Very high | 95.4 | Very high | 88 Ų | 88 | 60.5 Ų | 60.5 | 46% | 0.461 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -62.8 | -39.6 | -177.7 | -73.9 | 175.9 | 0 | 0 | 0 | 112.1 | L323 L324 K330 | L323-L327 HydrophobicContact CD1-CD1 4.17Å; L323-L327 HydrophobicContact CD1-CG 4.07Å; L323-L327 HydrophobicContact CG-CD1 3.97Å; L323-L327 HydrophobicContact CG-CG 4.3Å; L323-L327 WeakPolarHBondContact O-CB 3.49Å; L323-L327 VanDerWaalsContact O-CG 3.26Å; L323-L327 WeakPolarHBondContact O-CG 3.4Å; L323-L327 PolarHBondContact O-N 3.41Å; L324-L327 PolarHBondContact O-N 3.42Å; L327-K330 WeakPolarHBondContact O-CE 3.45Å; L327-K330 PolarHBondContact O-NZ 3.41Å |
| 328 | I | 95.5 | Very high | 95.3 | Very high | 60 Ų | 60 | 70.3 Ų | 70.3 | 31% | 0.308 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -82.7 | -50.6 | -178.1 | -62 | 170.2 | 0 | 0 | 0 | 111.7 | L324 F326 I481 I485 | L324-I328 HydrophobicContact CD1-CD1 3.85Å; L324-I328 HydrophobicContact CD1-CG1 4.43Å; L324-I328 HydrophobicContact CG-CD1 3.98Å; L324-I328 WeakPolarHBondContact O-CG1 3.32Å; L324-I328 PolarHBondContact O-N 3.15Å; L324-I328 VanDerWaalsContact O-N 3.11Å; F326-I328 VanDerWaalsContact C-N 3.32Å; F326-I328 PolarHBondContact O-N 3.09Å; I328-I481 HydrophobicContact CD1-CD1 4.38Å; I328-I481 HydrophobicContact CD1-CG2 4.06Å; I328-I481 HydrophobicContact CG2-CG2 3.94Å; I328-I485 HydrophobicContact CG2-CD1 3.97Å; I328-I485 HydrophobicContact CG2-CG1 4.04Å |
| 329 | T | 94.8 | Very high | 94.9 | Very high | 4 Ų | 4 | 66.1 Ų | 66.1 | 3% | 0.025 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -86.6 | -16.8 | -172.8 | 69.8 | 0 | 0 | 0 | 0 | 113.6 | Y325 K331 I481 H484 | Y325-T329 HydrophobicContact CD1-CG2 4.47Å; Y325-T329 WeakPolarHBondContact CD1-OG1 3.37Å; Y325-T329 HydrophobicContact CD2-CG2 4.17Å; Y325-T329 HydrophobicContact CE1-CG2 4.3Å; Y325-T329 WeakPolarHBondContact CE1-OG1 3.15Å; Y325-T329 HydrophobicContact CE2-CG2 3.96Å; Y325-T329 HydrophobicContact CG-CG2 4.41Å; Y325-T329 WeakPolarHBondContact O-CB 3.45Å; Y325-T329 WeakPolarHBondContact O-CG2 3.29Å; Y325-T329 PolarHBondContact O-N 2.63Å; Y325-T329 PolarHBondContact O-OG1 3.49Å; T329-K331 PolarHBondContact O-N 3.42Å; T329-K331 VanDerWaalsContact O-N 3.13Å; T329-K331 PolarHBondContact OG1-N 3.5Å; T329-I481 HydrophobicContact CG2-CG1 4.03Å; T329-H484 HydrophobicContact CG2-CB 3.82Å |
| 330 | K | 94.6 | Very high | 94.8 | Very high | 145 Ų | 145 | 61 Ų | 61 | 63% | 0.63 | 30% | 0.296 | S | S | * | . | trans | 53.7 | 23.3 | -170 | -54.5 | -59.5 | -174.3 | -163.3 | 0 | 113.6 | F326 L327 | F326-K330 WeakPolarHBondContact O-CA 3.44Å; F326-K330 PolarHBondContact O-N 2.93Å; L327-K330 WeakPolarHBondContact O-CE 3.45Å; L327-K330 PolarHBondContact O-NZ 3.41Å | ||
| 331 | K | 92.9 | Very high | 94.2 | Very high | 122 Ų | 122 | 63 Ų | 63 | 53% | 0.53 | 31% | 0.307 | S | S | . | . | S | Bend | trans | -110.5 | 154.3 | 177.4 | -67.8 | -178.5 | 180 | -175.7 | 0 | 111 | Y325 F326 T329 P333 | Y325-K331 HydrophobicContact CE1-CB 4.08Å; F326-K331 WeakPolarHBondContact CD2-O 3.31Å; T329-K331 PolarHBondContact O-N 3.42Å; T329-K331 VanDerWaalsContact O-N 3.13Å; T329-K331 PolarHBondContact OG1-N 3.5Å; K331-P333 VanDerWaalsContact O-CD 3.29Å; K331-P333 WeakPolarHBondContact O-CD 3.4Å |
| 332 | N | 94.9 | Very high | 93 | Very high | 92 Ų | 92 | 68.1 Ų | 68.1 | 49% | 0.492 | 33% | 0.331 | S | S | . | . | trans | -67.5 | 115.2 | 178.9 | -174.1 | -18.5 | 0 | 0 | 0 | 110.9 | I334 V335 | N332-I334 VanDerWaalsContact C-N 3.31Å; N332-I334 PolarHBondContact O-N 3.22Å; N332-I334 WeakPolarHBondContact OD1-CB 3.14Å; N332-I334 PolarHBondContact OD1-N 2.89Å; N332-V335 HydrophobicContact CB-CG2 4.21Å | ||
| 333 | P | 95.3 | Very high | 92 | Very high | 14 Ų | 14 | 67.8 Ų | 67.8 | 9% | 0.091 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -69.3 | -27.7 | -178.4 | 28.7 | -35.6 | 0 | 0 | 0 | 112.7 | P322 Y325 F326 K331 V335 F336 I337 | P322-P333 HydrophobicContact CB-CB 3.77Å; P322-P333 HydrophobicContact CB-CG 3.8Å; P322-P333 WeakPolarHBondContact O-CG 3.27Å; Y325-P333 HydrophobicContact CD1-CB 3.7Å; Y325-P333 HydrophobicContact CE1-CB 4.42Å; Y325-P333 HydrophobicContact CG-CB 4.28Å; F326-P333 HydrophobicContact CB-CG 4.42Å; K331-P333 VanDerWaalsContact O-CD 3.29Å; K331-P333 WeakPolarHBondContact O-CD 3.4Å; P333-V335 VanDerWaalsContact C-N 3.3Å; P333-V335 PolarHBondContact O-N 2.87Å; P333-F336 WeakPolarHBondContact O-CB 3.34Å; P333-F336 PolarHBondContact O-N 3.03Å; P333-F336 VanDerWaalsContact O-N 3.12Å; P333-I337 VanDerWaalsContact O-CG1 3.29Å; P333-I337 WeakPolarHBondContact O-CG1 3.48Å; P333-I337 PolarHBondContact O-N 2.92Å |
| 334 | I | 94.3 | Very high | 91.5 | Very high | 111 Ų | 111 | 63.8 Ų | 63.8 | 57% | 0.569 | 31% | 0.307 | S | S | * | . | H | α-helix | trans | -65.8 | -36.9 | -176.6 | -54.3 | -56.9 | 0 | 0 | 0 | 111.1 | N332 F336 I337 R338 | N332-I334 VanDerWaalsContact C-N 3.31Å; N332-I334 PolarHBondContact O-N 3.22Å; N332-I334 WeakPolarHBondContact OD1-CB 3.14Å; N332-I334 PolarHBondContact OD1-N 2.89Å; I334-F336 VanDerWaalsContact C-N 3.32Å; I334-I337 PolarHBondContact O-N 3.29Å; I334-R338 WeakPolarHBondContact O-CB 3.32Å; I334-R338 PolarHBondContact O-N 2.89Å |
| 335 | V | 93.5 | Very high | 90.4 | Very high | 103 Ų | 103 | 67.3 Ų | 67.3 | 62% | 0.624 | 33% | 0.326 | S | S | * | . | H | α-helix | trans | -64.7 | -41.2 | 175.1 | -180 | 0 | 0 | 0 | 0 | 110.4 | N332 P333 R338 G339 | N332-V335 HydrophobicContact CB-CG2 4.21Å; P333-V335 VanDerWaalsContact C-N 3.3Å; P333-V335 PolarHBondContact O-N 2.87Å; V335-R338 PolarHBondContact O-N 2.92Å; V335-G339 PolarHBondContact O-N 3.23Å |
| 336 | F | 95.7 | Very high | 89 | Confident | 13 Ų | 13 | 69.1 Ų | 69.1 | 6% | 0.057 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -64.3 | -46.7 | 176.7 | -170.6 | -84.2 | 0 | 0 | 0 | 111.7 | Y325 P333 I334 R338 G339 V340 L364 N368 I370 A476 L477 | Y325-F336 HydrophobicContact CE1-CB 4.42Å; Y325-F336 HydrophobicContact CE2-CD1 4.46Å; Y325-F336 HydrophobicContact CE2-CD2 4.09Å; Y325-F336 HydrophobicContact CE2-CE2 4.33Å; Y325-F336 HydrophobicContact CE2-CG 4.16Å; Y325-F336 AromaticContact CZ-CD2 3.87Å; Y325-F336 AromaticContact CZ-CG 3.99Å; Y325-F336 VanDerWaalsContact OH-CD2 3.26Å; Y325-F336 WeakPolarHBondContact OH-CD2 3.33Å; P333-F336 WeakPolarHBondContact O-CB 3.34Å; P333-F336 PolarHBondContact O-N 3.03Å; P333-F336 VanDerWaalsContact O-N 3.12Å; I334-F336 VanDerWaalsContact C-N 3.32Å; F336-R338 VanDerWaalsContact C-N 3.29Å; F336-R338 PolarHBondContact O-N 3.46Å; F336-G339 PolarHBondContact O-N 2.91Å; F336-G339 VanDerWaalsContact O-N 3.14Å; F336-V340 PolarHBondContact O-N 3.28Å; F336-L364 HydrophobicContact CE1-CD2 4.07Å; F336-L364 HydrophobicContact CE2-CD2 4.46Å; F336-L364 HydrophobicContact CZ-CD2 3.59Å; F336-N368 VanDerWaalsContact CD1-ND2 3.33Å; F336-N368 WeakPolarHBondContact CD1-ND2 3.29Å; F336-N368 HydrophobicContact CD2-CB 4.15Å; F336-N368 WeakPolarHBondContact CD2-ND2 3.09Å; F336-N368 WeakPolarHBondContact CE1-ND2 3.48Å; F336-N368 HydrophobicContact CE2-CB 3.82Å; F336-N368 WeakPolarHBondContact CE2-ND2 3.34Å; F336-N368 WeakPolarHBondContact CG-ND2 3.14Å; F336-N368 HydrophobicContact CZ-CB 4.37Å; F336-N368 VanDerWaalsContact CZ-ND2 3.3Å; F336-N368 WeakPolarHBondContact CZ-ND2 3.01Å; F336-N368 PolarHBondContact O-ND2 3.43Å; F336-I370 HydrophobicContact CE2-CD1 4.08Å; F336-I370 HydrophobicContact CE2-CG1 4.25Å; F336-A476 HydrophobicContact CE1-CB 4.35Å; F336-A476 VanDerWaalsContact CE1-O 3.26Å; F336-A476 WeakPolarHBondContact CE1-O 3.2Å; F336-A476 VanDerWaalsContact CZ-O 3.22Å; F336-A476 WeakPolarHBondContact CZ-O 2.97Å; F336-L477 HydrophobicContact CD1-CD2 3.68Å; F336-L477 HydrophobicContact CE1-CD2 4.08Å |
| 337 | I | 94.4 | Very high | 88 | Confident | 24 Ų | 24 | 64.5 Ų | 64.5 | 12% | 0.123 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -61.7 | -38.8 | 178.6 | -66.9 | 171.4 | 0 | 0 | 0 | 110.9 | P322 P333 I334 G339 V340 L341 L344 L473 L477 | P322-I337 HydrophobicContact CB-CD1 4.37Å; P322-I337 HydrophobicContact CG-CD1 3.89Å; P333-I337 VanDerWaalsContact O-CG1 3.29Å; P333-I337 WeakPolarHBondContact O-CG1 3.48Å; P333-I337 PolarHBondContact O-N 2.92Å; I334-I337 PolarHBondContact O-N 3.29Å; I337-G339 PolarHBondContact O-N 3.41Å; I337-V340 CarbonylContact O-C 3.57Å; I337-V340 WeakPolarHBondContact O-CG2 3.46Å; I337-V340 PolarHBondContact O-N 2.9Å; I337-V340 VanDerWaalsContact O-N 3.09Å; I337-L341 PolarHBondContact O-N 3.5Å; I337-L344 HydrophobicContact CG2-CD1 4.12Å; I337-L473 HydrophobicContact CD1-CD1 4.2Å; I337-L473 HydrophobicContact CG1-CD1 3.86Å; I337-L473 HydrophobicContact CG2-CD1 4.46Å; I337-L477 HydrophobicContact CG1-CD2 4.32Å |
| 338 | R | 92.6 | Very high | 87 | Confident | 207 Ų | 207 | 62.7 Ų | 62.7 | 78% | 0.781 | 31% | 0.306 | S | S | * | . | H | α-helix | trans | -57.9 | -37.1 | 176.3 | -173.7 | 177.9 | 178.3 | 174.9 | -0.3 | 112.3 | I334 V335 F336 V340 L341 | I334-R338 WeakPolarHBondContact O-CB 3.32Å; I334-R338 PolarHBondContact O-N 2.89Å; V335-R338 PolarHBondContact O-N 2.92Å; F336-R338 VanDerWaalsContact C-N 3.29Å; F336-R338 PolarHBondContact O-N 3.46Å; R338-V340 VanDerWaalsContact C-N 3.34Å; R338-L341 WeakPolarHBondContact O-CB 3.36Å; R338-L341 PolarHBondContact O-N 3.19Å |
| 339 | G | 86.7 | Confident | 85.3 | Confident | 11 Ų | 11 | 61.3 Ų | 61.3 | 11% | 0.113 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -75.2 | -19.2 | 178.5 | 0 | 0 | 0 | 0 | 0 | 114.6 | V335 F336 I337 C363 N367 N368 | V335-G339 PolarHBondContact O-N 3.23Å; F336-G339 PolarHBondContact O-N 2.91Å; F336-G339 VanDerWaalsContact O-N 3.14Å; I337-G339 PolarHBondContact O-N 3.41Å; G339-C363 WeakPolarHBondContact O-CB 3.47Å; G339-N367 WeakPolarHBondContact O-CB 3.29Å; G339-N367 PolarHBondContact O-ND2 3.03Å; G339-N368 VanDerWaalsContact CA-OD1 3.23Å; G339-N368 WeakPolarHBondContact CA-OD1 3.48Å |
| 340 | V | 91.9 | Very high | 83.8 | Confident | 1 Ų | 1 | 63.9 Ų | 63.9 | 1% | 0.006 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -102.6 | 1.4 | 173.3 | -64.5 | 0 | 0 | 0 | 0 | 114 | F336 I337 R338 Q342 A343 L344 C363 L364 A476 | F336-V340 PolarHBondContact O-N 3.28Å; I337-V340 CarbonylContact O-C 3.57Å; I337-V340 WeakPolarHBondContact O-CG2 3.46Å; I337-V340 PolarHBondContact O-N 2.9Å; I337-V340 VanDerWaalsContact O-N 3.09Å; R338-V340 VanDerWaalsContact C-N 3.34Å; V340-Q342 PolarHBondContact O-N 2.94Å; V340-Q342 VanDerWaalsContact O-N 3.12Å; V340-A343 WeakPolarHBondContact O-CB 3.4Å; V340-A343 PolarHBondContact O-N 3.33Å; V340-L344 HydrophobicContact CG2-CD1 4.41Å; V340-L344 PolarHBondContact O-N 3.03Å; V340-C363 HydrophobicContact CB-CB 4.49Å; V340-C363 HydrophobicContact CG1-CB 4.07Å; V340-L364 HydrophobicContact CG1-CD2 3.61Å; V340-L364 HydrophobicContact CG1-CG 4.35Å; V340-A476 HydrophobicContact CB-CB 4.45Å; V340-A476 HydrophobicContact CG1-CB 4.11Å; V340-A476 HydrophobicContact CG2-CB 4.28Å |
| 341 | L | 85.6 | Confident | 82.7 | Confident | 85 Ų | 85 | 57.3 Ų | 57.3 | 45% | 0.445 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -53.8 | -37.4 | -175.9 | -177.6 | 62.9 | 0 | 0 | 0 | 113.2 | I337 R338 A343 L344 L345 | I337-L341 PolarHBondContact O-N 3.5Å; R338-L341 WeakPolarHBondContact O-CB 3.36Å; R338-L341 PolarHBondContact O-N 3.19Å; L341-A343 VanDerWaalsContact C-N 3.34Å; L341-A343 PolarHBondContact O-N 3.47Å; L341-L344 PolarHBondContact O-N 2.91Å; L341-L345 HydrophobicContact CD1-CG 4.44Å; L341-L345 HydrophobicContact CG-CD1 4.3Å; L341-L345 HydrophobicContact CG-CG 4.5Å; L341-L345 WeakPolarHBondContact O-CG 3.42Å; L341-L345 PolarHBondContact O-N 3.23Å |
| 342 | Q | 70.9 | Confident | 81.8 | Confident | 108 Ų | 108 | 52 Ų | 52 | 51% | 0.505 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -59.6 | -44.4 | 176.4 | -178.9 | 178.9 | -9.2 | 0 | 0 | 111.9 | V340 L345 I346 I359 | V340-Q342 PolarHBondContact O-N 2.94Å; V340-Q342 VanDerWaalsContact O-N 3.12Å; Q342-L345 PolarHBondContact O-N 3.16Å; Q342-I346 HydrophobicContact CG-CD1 4.11Å; Q342-I346 VanDerWaalsContact O-CG1 3.3Å; Q342-I346 WeakPolarHBondContact O-CG1 3.07Å; Q342-I346 PolarHBondContact O-N 3.14Å; Q342-I346 VanDerWaalsContact O-N 3.14Å; Q342-I359 HydrophobicContact CG-CG2 4.29Å |
| 343 | A | 76.4 | Confident | 81.1 | Confident | 0 Ų | 0 | 47.8 Ų | 47.8 | 0% | 0 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -65.9 | -38.9 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | V340 L341 I346 A347 I359 T360 | V340-A343 WeakPolarHBondContact O-CB 3.4Å; V340-A343 PolarHBondContact O-N 3.33Å; L341-A343 VanDerWaalsContact C-N 3.34Å; L341-A343 PolarHBondContact O-N 3.47Å; A343-I346 PolarHBondContact O-N 3.41Å; A343-A347 WeakPolarHBondContact O-CB 3.33Å; A343-A347 PolarHBondContact O-N 3.37Å; A343-I359 HydrophobicContact CB-CG2 4.24Å; A343-T360 WeakPolarHBondContact CB-OG1 3.49Å |
| 344 | L | 84.9 | Confident | 80 | Confident | 11 Ų | 11 | 49.1 Ų | 49.1 | 6% | 0.058 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -63.6 | -42.5 | 177.3 | -59.9 | 180 | 0 | 0 | 0 | 112.5 | I337 V340 L341 I346 A347 L348 M469 V472 L473 | I337-L344 HydrophobicContact CG2-CD1 4.12Å; V340-L344 HydrophobicContact CG2-CD1 4.41Å; V340-L344 PolarHBondContact O-N 3.03Å; L341-L344 PolarHBondContact O-N 2.91Å; L344-I346 VanDerWaalsContact C-N 3.32Å; L344-I346 PolarHBondContact O-N 2.75Å; L344-A347 PolarHBondContact O-N 3.46Å; L344-L348 WeakPolarHBondContact O-CB 3.43Å; L344-L348 PolarHBondContact O-N 2.9Å; L344-M469 HydrophobicContact CB-CG 4.01Å; L344-M469 HydrophobicContact CB-SD 4.5Å; L344-M469 HydrophobicContact CD2-CG 4.24Å; L344-V472 HydrophobicContact CD2-CB 4.37Å; L344-V472 HydrophobicContact CD2-CG1 4.13Å; L344-L473 HydrophobicContact CD1-CD1 4.16Å; L344-L473 HydrophobicContact CD2-CB 3.75Å; L344-L473 HydrophobicContact CD2-CD1 4.47Å |
| 345 | L | 73.3 | Confident | 78.4 | Confident | 104 Ų | 104 | 46.7 Ų | 46.7 | 55% | 0.545 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -64.7 | -38.1 | 176.2 | -70.5 | 174 | 0 | 0 | 0 | 111.9 | L341 Q342 A349 | L341-L345 HydrophobicContact CD1-CG 4.44Å; L341-L345 HydrophobicContact CG-CD1 4.3Å; L341-L345 HydrophobicContact CG-CG 4.5Å; L341-L345 WeakPolarHBondContact O-CG 3.42Å; L341-L345 PolarHBondContact O-N 3.23Å; Q342-L345 PolarHBondContact O-N 3.16Å; L345-A349 PolarHBondContact O-N 3.29Å; L345-A349 VanDerWaalsContact O-N 3.14Å |
| 346 | I | 67.1 | Low | 77.3 | Confident | 52 Ų | 52 | 41.8 Ų | 41.8 | 27% | 0.267 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -68.7 | -40.6 | 174.9 | -65.6 | 167.1 | 0 | 0 | 0 | 110.1 | Q342 A343 L344 L348 A349 T350 T356 I359 | Q342-I346 HydrophobicContact CG-CD1 4.11Å; Q342-I346 VanDerWaalsContact O-CG1 3.3Å; Q342-I346 WeakPolarHBondContact O-CG1 3.07Å; Q342-I346 PolarHBondContact O-N 3.14Å; Q342-I346 VanDerWaalsContact O-N 3.14Å; A343-I346 PolarHBondContact O-N 3.41Å; L344-I346 VanDerWaalsContact C-N 3.32Å; L344-I346 PolarHBondContact O-N 2.75Å; I346-L348 VanDerWaalsContact C-N 3.32Å; I346-L348 PolarHBondContact O-N 3.28Å; I346-A349 CarbonylContact O-C 2.99Å; I346-A349 WeakPolarHBondContact O-CA 3.44Å; I346-A349 WeakPolarHBondContact O-CB 3.38Å; I346-A349 PolarHBondContact O-N 3.49Å; I346-T350 HydrophobicContact CG2-CG2 3.87Å; I346-T350 WeakPolarHBondContact O-CG2 3.39Å; I346-T350 PolarHBondContact O-N 3.41Å; I346-T350 PolarHBondContact O-OG1 2.93Å; I346-T350 VanDerWaalsContact O-OG1 3.06Å; I346-T356 HydrophobicContact CB-CG2 4.43Å; I346-T356 HydrophobicContact CG2-CG2 3.9Å; I346-I359 HydrophobicContact CD1-CB 4.31Å; I346-I359 HydrophobicContact CD1-CG1 4.06Å; I346-I359 HydrophobicContact CD1-CG2 3.83Å |
| 347 | A | 75.4 | Confident | 76.2 | Confident | 0 Ų | 0 | 43.5 Ų | 43.5 | 0% | 0 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -62.8 | -39.5 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | A343 L344 A349 S351 T356 T468 V472 | A343-A347 WeakPolarHBondContact O-CB 3.33Å; A343-A347 PolarHBondContact O-N 3.37Å; L344-A347 PolarHBondContact O-N 3.46Å; A347-A349 VanDerWaalsContact C-N 3.27Å; A347-A349 PolarHBondContact O-N 3.29Å; A347-S351 WeakPolarHBondContact O-CA 3.21Å; A347-S351 PolarHBondContact O-N 3.01Å; A347-T356 HydrophobicContact CB-CG2 3.62Å; A347-T468 HydrophobicContact CB-CG2 4.07Å; A347-V472 HydrophobicContact CB-CB 4.22Å; A347-V472 HydrophobicContact CB-CG2 3.83Å |
| 348 | L | 76.9 | Confident | 74.7 | Confident | 50 Ų | 50 | 46.5 Ų | 46.5 | 26% | 0.262 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -62.9 | -34.2 | 172.4 | -170.9 | 75.9 | 0 | 0 | 0 | 112.1 | L344 I346 R465 F466 M469 | L344-L348 WeakPolarHBondContact O-CB 3.43Å; L344-L348 PolarHBondContact O-N 2.9Å; I346-L348 VanDerWaalsContact C-N 3.32Å; I346-L348 PolarHBondContact O-N 3.28Å; L348-R465 HydrophobicContact CD1-CB 3.83Å; L348-R465 HydrophobicContact CG-CB 4.41Å; L348-R465 WeakPolarHBondContact O-CB 3.34Å; L348-R465 VanDerWaalsContact O-CG 3.3Å; L348-R465 WeakPolarHBondContact O-CG 3.46Å; L348-R465 PolarHBondContact O-NH1 3.2Å; L348-F466 HydrophobicContact CD1-CD1 3.87Å; L348-F466 HydrophobicContact CD1-CE1 3.98Å; L348-F466 HydrophobicContact CD1-CG 4.38Å; L348-M469 HydrophobicContact CB-SD 4.36Å; L348-M469 HydrophobicContact CD1-CB 4.47Å; L348-M469 HydrophobicContact CD1-SD 4.12Å |
| 349 | A | 60 | Low | 73.7 | Confident | 30 Ų | 30 | 39.1 Ų | 39.1 | 25% | 0.248 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -76.8 | -49.6 | 177 | 0 | 0 | 0 | 0 | 0 | 111.9 | L30 L345 I346 A347 R465 | L30-A349 HydrophobicContact CD1-CB 3.99Å; L30-A349 WeakPolarHBondContact CD1-O 3.26Å; L345-A349 PolarHBondContact O-N 3.29Å; L345-A349 VanDerWaalsContact O-N 3.14Å; I346-A349 CarbonylContact O-C 2.99Å; I346-A349 WeakPolarHBondContact O-CA 3.44Å; I346-A349 WeakPolarHBondContact O-CB 3.38Å; I346-A349 PolarHBondContact O-N 3.49Å; A347-A349 VanDerWaalsContact C-N 3.27Å; A347-A349 PolarHBondContact O-N 3.29Å; A349-R465 PolarHBondContact O-NH1 3.45Å |
| 350 | T | 61.8 | Low | 73.3 | Confident | 58 Ų | 58 | 38.8 Ų | 38.8 | 36% | 0.356 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -79.2 | -23 | -173 | 60.3 | 0 | 0 | 0 | 0 | 113.7 | I346 S352 T356 | I346-T350 HydrophobicContact CG2-CG2 3.87Å; I346-T350 WeakPolarHBondContact O-CG2 3.39Å; I346-T350 PolarHBondContact O-N 3.41Å; I346-T350 PolarHBondContact O-OG1 2.93Å; I346-T350 VanDerWaalsContact O-OG1 3.06Å; T350-S352 PolarHBondContact O-N 3.44Å; T350-S352 PolarHBondContact OG1-N 2.94Å; T350-S352 PolarHBondContact OG1-O 3.25Å; T350-T356 WeakPolarHBondContact OG1-CG2 3.28Å |
| 351 | S | 73.1 | Confident | 72.5 | Confident | 7 Ų | 7 | 41 Ų | 41 | 5% | 0.049 | 24% | 0.236 | C | C | . | . | trans | 53.6 | 28.8 | -168.3 | -54 | 0 | 0 | 0 | 0 | 113.3 | A347 P432 D464 R465 T468 | A347-S351 WeakPolarHBondContact O-CA 3.21Å; A347-S351 PolarHBondContact O-N 3.01Å; S351-P432 VanDerWaalsContact O-CA 3.32Å; S351-P432 WeakPolarHBondContact O-CA 3.25Å; S351-D464 WeakPolarHBondContact CB-OD2 3.47Å; S351-R465 WeakPolarHBondContact OG-CG 3.34Å; S351-T468 WeakPolarHBondContact CA-OG1 3.25Å; S351-T468 PolarHBondContact O-OG1 3.25Å | ||
| 352 | S | 73.3 | Confident | 71.8 | Confident | 11 Ų | 11 | 41.9 Ų | 41.9 | 8% | 0.077 | 24% | 0.236 | C | C | . | . | trans | -138.7 | 116.4 | 180 | 173.4 | 0 | 0 | 0 | 0 | 112.2 | T350 A355 T356 G430 T468 | T350-S352 PolarHBondContact O-N 3.44Å; T350-S352 PolarHBondContact OG1-N 2.94Å; T350-S352 PolarHBondContact OG1-O 3.25Å; S352-A355 PolarHBondContact O-N 3.14Å; S352-A355 WeakPolarHBondContact OG-CB 3.42Å; S352-A355 PolarHBondContact OG-N 2.89Å; S352-A355 VanDerWaalsContact OG-N 3.08Å; S352-T356 WeakPolarHBondContact O-CG2 3.48Å; S352-T356 PolarHBondContact O-N 2.89Å; S352-G430 CarbonylContact C-O 3.37Å; S352-G430 WeakPolarHBondContact CA-O 3.29Å; S352-G430 WeakPolarHBondContact CB-O 3.38Å; S352-G430 PolarHBondContact OG-O 3.19Å; S352-T468 VanDerWaalsContact C-CG2 3.42Å; S352-T468 VanDerWaalsContact N-CG2 3.3Å | ||
| 353 | S | 81 | Confident | 72.2 | Confident | 4 Ų | 4 | 36.9 Ų | 36.9 | 3% | 0.028 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -64.3 | -42.8 | 176 | -55.6 | 0 | 0 | 0 | 0 | 110.5 | A355 T356 L357 G430 T468 | S353-A355 PolarHBondContact O-N 3.31Å; S353-T356 PolarHBondContact O-N 3.48Å; S353-T356 VanDerWaalsContact O-N 3.15Å; S353-T356 PolarHBondContact O-OG1 2.96Å; S353-L357 PolarHBondContact O-N 2.82Å; S353-G430 PolarHBondContact N-O 2.98Å; S353-G430 VanDerWaalsContact N-O 3.11Å; S353-T468 VanDerWaalsContact N-CG2 3.3Å |
| 354 | S | 71.5 | Confident | 72.8 | Confident | 41 Ų | 41 | 36.9 Ų | 36.9 | 29% | 0.287 | 21% | 0.213 | S | C | . | . | H | α-helix | trans | -65.2 | -38.6 | 179.2 | -55.2 | 0 | 0 | 0 | 0 | 112.6 | T356 L357 G430 | S354-T356 PolarHBondContact O-N 3.19Å; S354-L357 VanDerWaalsContact O-CB 3.3Å; S354-L357 WeakPolarHBondContact O-CB 3.39Å; S354-L357 PolarHBondContact O-N 3.46Å; S354-G430 PolarHBondContact N-O 3.42Å; S354-G430 VanDerWaalsContact N-O 3.11Å; S354-G430 WeakPolarHBondContact OG-CA 3.34Å; S354-G430 PolarHBondContact OG-O 3.5Å |
| 355 | A | 61.1 | Low | 72.6 | Confident | 60 Ų | 60 | 38.7 Ų | 38.7 | 50% | 0.496 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -67.1 | -27.1 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | S352 S353 | S352-A355 PolarHBondContact O-N 3.14Å; S352-A355 WeakPolarHBondContact OG-CB 3.42Å; S352-A355 PolarHBondContact OG-N 2.89Å; S352-A355 VanDerWaalsContact OG-N 3.08Å; S353-A355 PolarHBondContact O-N 3.31Å |
| 356 | T | 69.6 | Low | 73.1 | Confident | 1 Ų | 1 | 39 Ų | 39 | 1% | 0.006 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -86 | -14.3 | 179.7 | 65.1 | 0 | 0 | 0 | 0 | 114.2 | I346 A347 T350 S352 S353 S354 P358 I359 T360 V472 | I346-T356 HydrophobicContact CB-CG2 4.43Å; I346-T356 HydrophobicContact CG2-CG2 3.9Å; A347-T356 HydrophobicContact CB-CG2 3.62Å; T350-T356 WeakPolarHBondContact OG1-CG2 3.28Å; S352-T356 WeakPolarHBondContact O-CG2 3.48Å; S352-T356 PolarHBondContact O-N 2.89Å; S353-T356 PolarHBondContact O-N 3.48Å; S353-T356 VanDerWaalsContact O-N 3.15Å; S353-T356 PolarHBondContact O-OG1 2.96Å; S354-T356 PolarHBondContact O-N 3.19Å; T356-P358 VanDerWaalsContact C-CD 3.45Å; T356-I359 PolarHBondContact O-N 3.24Å; T356-T360 PolarHBondContact O-N 3.45Å; T356-T360 PolarHBondContact O-OG1 3.36Å; T356-V472 VanDerWaalsContact OG1-CG2 3.32Å; T356-V472 WeakPolarHBondContact OG1-CG2 3.44Å |
| 357 | L | 71.9 | Confident | 74.2 | Confident | 48 Ų | 48 | 40.5 Ų | 40.5 | 25% | 0.251 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -48.6 | -45.8 | -173.4 | -173.5 | 71.9 | 0 | 0 | 0 | 114 | S353 S354 I359 T360 F361 L379 P380 A383 | S353-L357 PolarHBondContact O-N 2.82Å; S354-L357 VanDerWaalsContact O-CB 3.3Å; S354-L357 WeakPolarHBondContact O-CB 3.39Å; S354-L357 PolarHBondContact O-N 3.46Å; L357-I359 VanDerWaalsContact C-N 3.33Å; L357-I359 PolarHBondContact O-N 3.49Å; L357-T360 PolarHBondContact O-N 2.88Å; L357-F361 VanDerWaalsContact O-CB 3.32Å; L357-F361 WeakPolarHBondContact O-CB 3.38Å; L357-F361 PolarHBondContact O-N 3.36Å; L357-L379 HydrophobicContact CD1-CB 3.53Å; L357-P380 HydrophobicContact CD2-CB 4.35Å; L357-P380 HydrophobicContact CD2-CG 4.25Å; L357-A383 HydrophobicContact CD1-CB 4.43Å |
| 358 | P | 63.3 | Low | 74.9 | Confident | 88 Ų | 88 | 41.8 Ų | 41.8 | 57% | 0.571 | 24% | 0.236 | S | C | * | . | H | α-helix | trans | -64.7 | -34.7 | 179.3 | -21.4 | 34.7 | 0 | 0 | 0 | 113.4 | T356 K362 | T356-P358 VanDerWaalsContact C-CD 3.45Å; P358-K362 PolarHBondContact O-N 3.25Å |
| 359 | I | 71.6 | Confident | 75.7 | Confident | 51 Ų | 51 | 46.8 Ų | 46.8 | 26% | 0.262 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -76.9 | -40.2 | 179.1 | -54.6 | -60.7 | 0 | 0 | 0 | 110.6 | Q342 A343 I346 T356 L357 F361 K362 C363 | Q342-I359 HydrophobicContact CG-CG2 4.29Å; A343-I359 HydrophobicContact CB-CG2 4.24Å; I346-I359 HydrophobicContact CD1-CB 4.31Å; I346-I359 HydrophobicContact CD1-CG1 4.06Å; I346-I359 HydrophobicContact CD1-CG2 3.83Å; T356-I359 PolarHBondContact O-N 3.24Å; L357-I359 VanDerWaalsContact C-N 3.33Å; L357-I359 PolarHBondContact O-N 3.49Å; I359-F361 VanDerWaalsContact C-N 3.27Å; I359-F361 PolarHBondContact O-N 3.34Å; I359-K362 PolarHBondContact O-N 2.83Å; I359-C363 WeakPolarHBondContact O-CB 3.14Å; I359-C363 PolarHBondContact O-N 2.96Å; I359-C363 PolarHBondContact O-SG 2.74Å |
| 360 | T | 79.6 | Confident | 77.1 | Confident | 4 Ų | 4 | 46.2 Ų | 46.2 | 3% | 0.025 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -57.4 | -44.6 | 172.2 | -52.2 | 0 | 0 | 0 | 0 | 110.4 | A343 T356 L357 C363 L364 L379 V472 A476 | A343-T360 WeakPolarHBondContact CB-OG1 3.49Å; T356-T360 PolarHBondContact O-N 3.45Å; T356-T360 PolarHBondContact O-OG1 3.36Å; L357-T360 PolarHBondContact O-N 2.88Å; T360-C363 PolarHBondContact O-N 3.47Å; T360-L364 WeakPolarHBondContact O-CG 3.47Å; T360-L364 PolarHBondContact O-N 3.27Å; T360-L379 HydrophobicContact CG2-CD1 3.92Å; T360-L379 HydrophobicContact CG2-CD2 3.89Å; T360-V472 HydrophobicContact CG2-CG1 4.2Å; T360-V472 WeakPolarHBondContact OG1-CG1 3.45Å; T360-A476 HydrophobicContact CG2-CB 4.39Å |
| 361 | F | 75 | Confident | 78.2 | Confident | 49 Ų | 49 | 46.1 Ų | 46.1 | 22% | 0.215 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -58.9 | -48.7 | 176.1 | -169.6 | -95.1 | 0 | 0 | 0 | 112.2 | L357 I359 C363 L364 L365 R372 A375 R376 L379 | L357-F361 VanDerWaalsContact O-CB 3.32Å; L357-F361 WeakPolarHBondContact O-CB 3.38Å; L357-F361 PolarHBondContact O-N 3.36Å; I359-F361 VanDerWaalsContact C-N 3.27Å; I359-F361 PolarHBondContact O-N 3.34Å; F361-C363 PolarHBondContact O-N 3.03Å; F361-L364 PolarHBondContact O-N 3.36Å; F361-L365 HydrophobicContact CD1-CD1 3.68Å; F361-L365 HydrophobicContact CD1-CG 4.47Å; F361-L365 HydrophobicContact CE1-CD1 3.22Å; F361-L365 HydrophobicContact CE1-CG 4.23Å; F361-L365 HydrophobicContact CZ-CD1 3.78Å; F361-L365 WeakPolarHBondContact O-CG 3.4Å; F361-L365 PolarHBondContact O-N 3.15Å; F361-L365 VanDerWaalsContact O-N 3.15Å; F361-R372 HydrophobicContact CZ-CG 3.82Å; F361-A375 HydrophobicContact CD2-CB 3.91Å; F361-A375 HydrophobicContact CE2-CB 3.67Å; F361-R376 HydrophobicContact CE2-CB 4.21Å; F361-R376 HydrophobicContact CE2-CG 3.42Å; F361-R376 VanDerWaalsContact CE2-CG 3.42Å; F361-R376 HydrophobicContact CZ-CG 3.51Å; F361-L379 HydrophobicContact CB-CD1 4.12Å; F361-L379 HydrophobicContact CD2-CD1 4.15Å |
| 362 | K | 69.1 | Low | 78.4 | Confident | 103 Ų | 103 | 52.2 Ų | 52.2 | 45% | 0.448 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -58.6 | -48 | 176.1 | -174.9 | -179.9 | 177.5 | 178.3 | 0 | 111.9 | P358 I359 L364 L365 E366 | P358-K362 PolarHBondContact O-N 3.25Å; I359-K362 PolarHBondContact O-N 2.83Å; K362-L364 VanDerWaalsContact C-N 3.32Å; K362-L364 PolarHBondContact O-N 3.2Å; K362-L365 PolarHBondContact O-N 2.77Å; K362-E366 WeakPolarHBondContact CE-OE1 3.25Å; K362-E366 WeakPolarHBondContact CE-OE2 3.33Å; K362-E366 HydrophobicContact CG-CG 4.31Å; K362-E366 WeakPolarHBondContact CG-OE1 3.33Å; K362-E366 IonicContact NZ-OE2 3.77Å; K362-E366 WeakPolarHBondContact O-CB 3.46Å; K362-E366 PolarHBondContact O-N 3.02Å |
| 363 | C | 79.4 | Confident | 78.5 | Confident | 3 Ų | 3 | 56 Ų | 56 | 2% | 0.02 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -60.4 | -41.6 | 179.7 | -67.5 | 0 | 0 | 0 | 0 | 111.9 | G339 V340 I359 T360 F361 N367 N368 | G339-C363 WeakPolarHBondContact O-CB 3.47Å; V340-C363 HydrophobicContact CB-CB 4.49Å; V340-C363 HydrophobicContact CG1-CB 4.07Å; I359-C363 WeakPolarHBondContact O-CB 3.14Å; I359-C363 PolarHBondContact O-N 2.96Å; I359-C363 PolarHBondContact O-SG 2.74Å; T360-C363 PolarHBondContact O-N 3.47Å; F361-C363 PolarHBondContact O-N 3.03Å; C363-N367 WeakPolarHBondContact O-CA 3.4Å; C363-N367 VanDerWaalsContact O-CB 3.26Å; C363-N367 WeakPolarHBondContact O-CB 3.18Å; C363-N367 PolarHBondContact O-N 3.27Å; C363-N368 PolarHBondContact O-N 3.29Å |
| 364 | L | 89.3 | Confident | 78.5 | Confident | 0 Ų | 0 | 55.9 Ų | 55.9 | 0% | 0 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -66 | -38.5 | 178.8 | -74.3 | -168.9 | 0 | 0 | 0 | 113.3 | F336 V340 T360 F361 K362 N368 H369 I370 A375 L379 A476 A479 | F336-L364 HydrophobicContact CE1-CD2 4.07Å; F336-L364 HydrophobicContact CE2-CD2 4.46Å; F336-L364 HydrophobicContact CZ-CD2 3.59Å; V340-L364 HydrophobicContact CG1-CD2 3.61Å; V340-L364 HydrophobicContact CG1-CG 4.35Å; T360-L364 WeakPolarHBondContact O-CG 3.47Å; T360-L364 PolarHBondContact O-N 3.27Å; F361-L364 PolarHBondContact O-N 3.36Å; K362-L364 VanDerWaalsContact C-N 3.32Å; K362-L364 PolarHBondContact O-N 3.2Å; L364-N368 HydrophobicContact CD2-CB 4.36Å; L364-N368 CarbonylContact O-C 3.6Å; L364-H369 PolarHBondContact O-N 3.22Å; L364-I370 HydrophobicContact CB-CB 4.26Å; L364-I370 HydrophobicContact CB-CG1 4.36Å; L364-I370 HydrophobicContact CD2-CG1 4.28Å; L364-I370 PolarHBondContact O-N 3.21Å; L364-A375 HydrophobicContact CD1-CB 4.5Å; L364-L379 HydrophobicContact CD1-CD1 3.77Å; L364-L379 HydrophobicContact CD1-CD2 3.89Å; L364-L379 HydrophobicContact CD1-CG 4.02Å; L364-A476 HydrophobicContact CD2-CB 4.26Å; L364-A479 HydrophobicContact CD1-CB 3.56Å |
| 365 | L | 80.9 | Confident | 78.8 | Confident | 48 Ų | 48 | 53.9 Ų | 53.9 | 25% | 0.251 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -75 | -49.5 | 179.7 | -70.7 | 177.3 | 0 | 0 | 0 | 112.4 | F361 K362 H369 I370 R372 | F361-L365 HydrophobicContact CD1-CD1 3.68Å; F361-L365 HydrophobicContact CD1-CG 4.47Å; F361-L365 HydrophobicContact CE1-CD1 3.22Å; F361-L365 HydrophobicContact CE1-CG 4.23Å; F361-L365 HydrophobicContact CZ-CD1 3.78Å; F361-L365 WeakPolarHBondContact O-CG 3.4Å; F361-L365 PolarHBondContact O-N 3.15Å; F361-L365 VanDerWaalsContact O-N 3.15Å; K362-L365 PolarHBondContact O-N 2.77Å; L365-H369 WeakPolarHBondContact O-CA 3.44Å; L365-H369 PolarHBondContact O-N 3.4Å; L365-I370 WeakPolarHBondContact CD2-O 3.48Å; L365-R372 HydrophobicContact CD1-CG 4.37Å; L365-R372 HydrophobicContact CD2-CB 3.88Å; L365-R372 HydrophobicContact CD2-CG 4.26Å |
| 366 | E | 84.7 | Confident | 79.3 | Confident | 112 Ų | 112 | 57.9 Ų | 57.9 | 52% | 0.523 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -83.5 | -42.3 | -170.8 | -66.5 | 179.1 | -171.8 | 0 | 0 | 112.3 | K362 H369 | K362-E366 WeakPolarHBondContact CE-OE1 3.25Å; K362-E366 WeakPolarHBondContact CE-OE2 3.33Å; K362-E366 HydrophobicContact CG-CG 4.31Å; K362-E366 WeakPolarHBondContact CG-OE1 3.33Å; K362-E366 IonicContact NZ-OE2 3.77Å; K362-E366 WeakPolarHBondContact O-CB 3.46Å; K362-E366 PolarHBondContact O-N 3.02Å; E366-H369 PolarHBondContact O-CE1 3.1Å; E366-H369 PolarHBondContact O-ND1 3.33Å |
| 367 | N | 89 | Confident | 79.5 | Confident | 83 Ų | 83 | 59.4 Ų | 59.4 | 44% | 0.444 | 28% | 0.276 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -94.8 | -36.4 | -174 | -56.6 | -24.9 | 0 | 0 | 0 | 112.5 | G339 C363 | G339-N367 WeakPolarHBondContact O-CB 3.29Å; G339-N367 PolarHBondContact O-ND2 3.03Å; C363-N367 WeakPolarHBondContact O-CA 3.4Å; C363-N367 VanDerWaalsContact O-CB 3.26Å; C363-N367 WeakPolarHBondContact O-CB 3.18Å; C363-N367 PolarHBondContact O-N 3.27Å |
| 368 | N | 91.4 | Very high | 80.1 | Confident | 26 Ų | 26 | 57.1 Ų | 57.1 | 14% | 0.139 | 26% | 0.264 | C | S | . | . | S | Bend | trans | -106.5 | -4.9 | -174.4 | -64.4 | 24.6 | 0 | 0 | 0 | 113.3 | F336 G339 C363 L364 I370 | F336-N368 VanDerWaalsContact CD1-ND2 3.33Å; F336-N368 WeakPolarHBondContact CD1-ND2 3.29Å; F336-N368 HydrophobicContact CD2-CB 4.15Å; F336-N368 WeakPolarHBondContact CD2-ND2 3.09Å; F336-N368 WeakPolarHBondContact CE1-ND2 3.48Å; F336-N368 HydrophobicContact CE2-CB 3.82Å; F336-N368 WeakPolarHBondContact CE2-ND2 3.34Å; F336-N368 WeakPolarHBondContact CG-ND2 3.14Å; F336-N368 HydrophobicContact CZ-CB 4.37Å; F336-N368 VanDerWaalsContact CZ-ND2 3.3Å; F336-N368 WeakPolarHBondContact CZ-ND2 3.01Å; F336-N368 PolarHBondContact O-ND2 3.43Å; G339-N368 VanDerWaalsContact CA-OD1 3.23Å; G339-N368 WeakPolarHBondContact CA-OD1 3.48Å; C363-N368 PolarHBondContact O-N 3.29Å; L364-N368 HydrophobicContact CD2-CB 4.36Å; L364-N368 CarbonylContact O-C 3.6Å; N368-I370 VanDerWaalsContact C-N 3.29Å; N368-I370 HydrophobicContact CB-CG1 4.21Å; N368-I370 PolarHBondContact O-N 3.04Å |
| 369 | H | 92.1 | Very high | 80.9 | Confident | 155 Ų | 155 | 53 Ų | 53 | 72% | 0.718 | 24% | 0.237 | S | C | * | . | trans | 52.1 | 42.1 | 177.5 | -51.3 | -53.7 | 0 | 0 | 0 | 114 | L364 L365 E366 | L364-H369 PolarHBondContact O-N 3.22Å; L365-H369 WeakPolarHBondContact O-CA 3.44Å; L365-H369 PolarHBondContact O-N 3.4Å; E366-H369 PolarHBondContact O-CE1 3.1Å; E366-H369 PolarHBondContact O-ND1 3.33Å | ||
| 370 | I | 90.3 | Very high | 80.8 | Confident | 18 Ų | 18 | 53.2 Ų | 53.2 | 9% | 0.092 | 24% | 0.243 | C | C | . | . | trans | -78.5 | 140.8 | 173.6 | -61.5 | -56.8 | 0 | 0 | 0 | 110 | F336 L364 L365 N368 R372 I374 A375 A483 | F336-I370 HydrophobicContact CE2-CD1 4.08Å; F336-I370 HydrophobicContact CE2-CG1 4.25Å; L364-I370 HydrophobicContact CB-CB 4.26Å; L364-I370 HydrophobicContact CB-CG1 4.36Å; L364-I370 HydrophobicContact CD2-CG1 4.28Å; L364-I370 PolarHBondContact O-N 3.21Å; L365-I370 WeakPolarHBondContact CD2-O 3.48Å; N368-I370 VanDerWaalsContact C-N 3.29Å; N368-I370 HydrophobicContact CB-CG1 4.21Å; N368-I370 PolarHBondContact O-N 3.04Å; I370-R372 PolarHBondContact O-N 3.42Å; I370-I374 HydrophobicContact CG2-CB 4.38Å; I370-I374 HydrophobicContact CG2-CG2 4.49Å; I370-A375 HydrophobicContact CG2-CB 4.38Å; I370-A483 HydrophobicContact CD1-CB 3.76Å; I370-A483 HydrophobicContact CG2-CB 4.21Å | ||
| 371 | D | 85 | Confident | 80.7 | Confident | 56 Ų | 56 | 53.6 Ų | 53.6 | 30% | 0.299 | 25% | 0.245 | S | C | . | . | trans | -59.4 | 133 | 176.8 | -173.7 | -64.5 | 0 | 0 | 0 | 110.9 | R373 I374 A375 | D371-R373 PolarHBondContact O-N 2.83Å; D371-R373 WeakPolarHBondContact OD1-CB 3.41Å; D371-R373 WeakPolarHBondContact OD1-CG 3.05Å; D371-R373 IonicContact OD1-CZ 3.07Å; D371-R373 PolarHBondContact OD1-N 3.25Å; D371-R373 IonicContact OD1-NE 2.97Å; D371-R373 PolarHBondContact OD1-NE 2.95Å; D371-R373 VanDerWaalsContact OD1-NE 3.09Å; D371-R373 IonicContact OD1-NH2 3.89Å; D371-R373 IonicContact OD2-CZ 3.37Å; D371-R373 IonicContact OD2-NE 3.17Å; D371-R373 PolarHBondContact OD2-NE 3.34Å; D371-R373 IonicContact OD2-NH2 2.7Å; D371-R373 PolarHBondContact OD2-NH2 3.47Å; D371-I374 HydrophobicContact CB-CD1 4.2Å; D371-I374 HydrophobicContact CB-CG1 4.22Å; D371-I374 PolarHBondContact O-N 3.3Å; D371-I374 VanDerWaalsContact O-N 3.12Å; D371-A375 PolarHBondContact O-N 3.05Å | ||
| 372 | R | 76.3 | Confident | 81 | Confident | 135 Ų | 135 | 51.2 Ų | 51.2 | 51% | 0.509 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -57.6 | -35 | -176.7 | -167.4 | 178.2 | 178.8 | 174.9 | 1.1 | 112.7 | F361 L365 I370 I374 R376 | F361-R372 HydrophobicContact CZ-CG 3.82Å; L365-R372 HydrophobicContact CD1-CG 4.37Å; L365-R372 HydrophobicContact CD2-CB 3.88Å; L365-R372 HydrophobicContact CD2-CG 4.26Å; I370-R372 PolarHBondContact O-N 3.42Å; R372-I374 VanDerWaalsContact C-N 3.35Å; R372-R376 HydrophobicContact CG-CG 4.38Å; R372-R376 VanDerWaalsContact O-CB 3.29Å; R372-R376 WeakPolarHBondContact O-CB 3.5Å; R372-R376 VanDerWaalsContact O-CG 3.27Å; R372-R376 WeakPolarHBondContact O-CG 3.28Å; R372-R376 PolarHBondContact O-N 3.02Å |
| 373 | R | 75.4 | Confident | 81.3 | Confident | 90 Ų | 90 | 46.6 Ų | 46.6 | 34% | 0.34 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -64.7 | -42.4 | 179.8 | -62.6 | 171.7 | -73.8 | -167.5 | -4.7 | 110.6 | D371 F377 | D371-R373 PolarHBondContact O-N 2.83Å; D371-R373 WeakPolarHBondContact OD1-CB 3.41Å; D371-R373 WeakPolarHBondContact OD1-CG 3.05Å; D371-R373 IonicContact OD1-CZ 3.07Å; D371-R373 PolarHBondContact OD1-N 3.25Å; D371-R373 IonicContact OD1-NE 2.97Å; D371-R373 PolarHBondContact OD1-NE 2.95Å; D371-R373 VanDerWaalsContact OD1-NE 3.09Å; D371-R373 IonicContact OD1-NH2 3.89Å; D371-R373 IonicContact OD2-CZ 3.37Å; D371-R373 IonicContact OD2-NE 3.17Å; D371-R373 PolarHBondContact OD2-NE 3.34Å; D371-R373 IonicContact OD2-NH2 2.7Å; D371-R373 PolarHBondContact OD2-NH2 3.47Å; R373-F377 WeakPolarHBondContact O-CB 3.39Å; R373-F377 PolarHBondContact O-N 2.83Å |
| 374 | I | 82.9 | Confident | 81 | Confident | 2 Ų | 2 | 48 Ų | 48 | 1% | 0.01 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -68.7 | -48.9 | 178.2 | -56.4 | -178.9 | 0 | 0 | 0 | 110.1 | I370 D371 R372 R376 F377 V378 M482 A483 F490 | I370-I374 HydrophobicContact CG2-CB 4.38Å; I370-I374 HydrophobicContact CG2-CG2 4.49Å; D371-I374 HydrophobicContact CB-CD1 4.2Å; D371-I374 HydrophobicContact CB-CG1 4.22Å; D371-I374 PolarHBondContact O-N 3.3Å; D371-I374 VanDerWaalsContact O-N 3.12Å; R372-I374 VanDerWaalsContact C-N 3.35Å; I374-R376 VanDerWaalsContact C-N 3.29Å; I374-R376 PolarHBondContact O-N 3.11Å; I374-F377 PolarHBondContact O-N 3.27Å; I374-F377 VanDerWaalsContact O-N 3.16Å; I374-V378 HydrophobicContact CG2-CG2 3.76Å; I374-V378 WeakPolarHBondContact O-CB 3.36Å; I374-V378 VanDerWaalsContact O-CG2 3.31Å; I374-V378 WeakPolarHBondContact O-CG2 3.19Å; I374-V378 PolarHBondContact O-N 3.49Å; I374-M482 HydrophobicContact CG2-CB 3.99Å; I374-A483 VanDerWaalsContact CD1-CA 3.41Å; I374-A483 HydrophobicContact CD1-CB 3.78Å; I374-F490 HydrophobicContact CD1-CD2 3.83Å; I374-F490 HydrophobicContact CD1-CE2 3.41Å; I374-F490 VanDerWaalsContact CD1-CE2 3.41Å; I374-F490 HydrophobicContact CD1-CZ 4.17Å; I374-F490 HydrophobicContact CG1-CD2 4.29Å; I374-F490 HydrophobicContact CG1-CE2 3.55Å; I374-F490 HydrophobicContact CG1-CZ 3.78Å |
| 375 | A | 77.8 | Confident | 80.6 | Confident | 0 Ų | 0 | 48.4 Ų | 48.4 | 0% | 0 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -61.1 | -37.1 | 179.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | F361 L364 I370 D371 F377 L379 | F361-A375 HydrophobicContact CD2-CB 3.91Å; F361-A375 HydrophobicContact CE2-CB 3.67Å; L364-A375 HydrophobicContact CD1-CB 4.5Å; I370-A375 HydrophobicContact CG2-CB 4.38Å; D371-A375 PolarHBondContact O-N 3.05Å; A375-F377 VanDerWaalsContact C-N 3.27Å; A375-F377 PolarHBondContact O-N 3.02Å; A375-L379 WeakPolarHBondContact O-CB 3.49Å; A375-L379 PolarHBondContact O-N 3.25Å |
| 376 | R | 70.6 | Confident | 81 | Confident | 143 Ų | 143 | 46.1 Ų | 46.1 | 54% | 0.54 | 21% | 0.214 | S | C | . | . | H | α-helix | trans | -69.5 | -26.6 | 178.9 | -82.7 | -177.2 | 162.9 | 173.4 | -16.8 | 113.1 | F361 R372 I374 P380 | F361-R376 HydrophobicContact CE2-CB 4.21Å; F361-R376 HydrophobicContact CE2-CG 3.42Å; F361-R376 VanDerWaalsContact CE2-CG 3.42Å; F361-R376 HydrophobicContact CZ-CG 3.51Å; R372-R376 HydrophobicContact CG-CG 4.38Å; R372-R376 VanDerWaalsContact O-CB 3.29Å; R372-R376 WeakPolarHBondContact O-CB 3.5Å; R372-R376 VanDerWaalsContact O-CG 3.27Å; R372-R376 WeakPolarHBondContact O-CG 3.28Å; R372-R376 PolarHBondContact O-N 3.02Å; I374-R376 VanDerWaalsContact C-N 3.29Å; I374-R376 PolarHBondContact O-N 3.11Å; R376-P380 VanDerWaalsContact O-CD 3.27Å; R376-P380 WeakPolarHBondContact O-CD 3.46Å; R376-P380 VanDerWaalsContact O-CG 3.31Å; R376-P380 WeakPolarHBondContact O-CG 3.38Å |
| 377 | F | 74.2 | Confident | 81.3 | Confident | 33 Ų | 33 | 41 Ų | 41 | 15% | 0.145 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -90 | -52.3 | 179.6 | -177.9 | -90.6 | 0 | 0 | 0 | 111.3 | L90 L98 G99 R373 I374 A375 V381 | L90-F377 HydrophobicContact CD2-CE1 4.37Å; L90-F377 HydrophobicContact CD2-CE2 4.02Å; L90-F377 HydrophobicContact CD2-CZ 3.5Å; L90-F377 VanDerWaalsContact CD2-CZ 3.5Å; L98-F377 HydrophobicContact CD2-CB 4.17Å; L98-F377 HydrophobicContact CD2-CD1 3.74Å; L98-F377 HydrophobicContact CD2-CE1 4.41Å; L98-F377 HydrophobicContact CD2-CG 4.02Å; L98-F377 HydrophobicContact CG-CD1 3.93Å; L98-F377 HydrophobicContact CG-CE1 4.19Å; G99-F377 VanDerWaalsContact CA-CZ 3.48Å; R373-F377 WeakPolarHBondContact O-CB 3.39Å; R373-F377 PolarHBondContact O-N 2.83Å; I374-F377 PolarHBondContact O-N 3.27Å; I374-F377 VanDerWaalsContact O-N 3.16Å; A375-F377 VanDerWaalsContact C-N 3.27Å; A375-F377 PolarHBondContact O-N 3.02Å; F377-V381 WeakPolarHBondContact O-CG2 3.19Å |
| 378 | V | 84.5 | Confident | 81.6 | Confident | 0 Ų | 0 | 37 Ų | 37 | 0% | 0 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -70.4 | -42.9 | -169.3 | 176.7 | 0 | 0 | 0 | 0 | 112.2 | L98 T102 Y106 I374 G382 A478 A479 M482 | L98-V378 HydrophobicContact CD1-CG2 4.48Å; T102-V378 HydrophobicContact CG2-CB 4.47Å; T102-V378 HydrophobicContact CG2-CG1 4.02Å; T102-V378 HydrophobicContact CG2-CG2 4.21Å; Y106-V378 WeakPolarHBondContact OH-CG1 3.22Å; Y106-V378 PolarHBondContact OH-O 2.85Å; I374-V378 HydrophobicContact CG2-CG2 3.76Å; I374-V378 WeakPolarHBondContact O-CB 3.36Å; I374-V378 VanDerWaalsContact O-CG2 3.31Å; I374-V378 WeakPolarHBondContact O-CG2 3.19Å; I374-V378 PolarHBondContact O-N 3.49Å; V378-G382 PolarHBondContact O-N 3.37Å; V378-A478 HydrophobicContact CG1-CB 4.12Å; V378-A479 HydrophobicContact CB-CB 4.22Å; V378-A479 HydrophobicContact CG1-CB 3.94Å; V378-M482 HydrophobicContact CG2-CB 4.23Å; V378-M482 HydrophobicContact CG2-CG 4.12Å |
| 379 | L | 79.9 | Confident | 81.7 | Confident | 1 Ų | 1 | 35.8 Ų | 35.8 | 1% | 0.005 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -70.5 | -47.1 | -172.8 | -65.7 | -178.8 | 0 | 0 | 0 | 114.1 | L357 T360 F361 L364 A375 V381 G382 A383 D475 A479 | L357-L379 HydrophobicContact CD1-CB 3.53Å; T360-L379 HydrophobicContact CG2-CD1 3.92Å; T360-L379 HydrophobicContact CG2-CD2 3.89Å; F361-L379 HydrophobicContact CB-CD1 4.12Å; F361-L379 HydrophobicContact CD2-CD1 4.15Å; L364-L379 HydrophobicContact CD1-CD1 3.77Å; L364-L379 HydrophobicContact CD1-CD2 3.89Å; L364-L379 HydrophobicContact CD1-CG 4.02Å; A375-L379 WeakPolarHBondContact O-CB 3.49Å; A375-L379 PolarHBondContact O-N 3.25Å; L379-V381 VanDerWaalsContact C-N 3.31Å; L379-V381 PolarHBondContact O-N 3.03Å; L379-G382 PolarHBondContact O-N 2.84Å; L379-A383 PolarHBondContact O-N 2.97Å; L379-D475 HydrophobicContact CD2-CB 3.83Å; L379-A479 HydrophobicContact CD2-CB 4.49Å |
| 380 | P | 70.1 | Confident | 81.8 | Confident | 57 Ų | 57 | 28.6 Ų | 28.6 | 37% | 0.37 | 13% | 0.129 | S | C | . | . | H | α-helix | trans | -64.7 | -36.8 | 178.8 | -22.6 | 35.6 | 0 | 0 | 0 | 112.6 | L357 R376 | L357-P380 HydrophobicContact CD2-CB 4.35Å; L357-P380 HydrophobicContact CD2-CG 4.25Å; R376-P380 VanDerWaalsContact O-CD 3.27Å; R376-P380 WeakPolarHBondContact O-CD 3.46Å; R376-P380 VanDerWaalsContact O-CG 3.31Å; R376-P380 WeakPolarHBondContact O-CG 3.38Å |
| 381 | V | 77 | Confident | 82 | Confident | 11 Ų | 11 | 27.8 Ų | 27.8 | 7% | 0.067 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -65.4 | -44.1 | 174.6 | 176.6 | 0 | 0 | 0 | 0 | 110.3 | L90 Y106 F377 L379 T384 I385 | L90-V381 HydrophobicContact CD2-CG1 4.35Å; L90-V381 HydrophobicContact CD2-CG2 4.03Å; Y106-V381 HydrophobicContact CE2-CG1 4.19Å; F377-V381 WeakPolarHBondContact O-CG2 3.19Å; L379-V381 VanDerWaalsContact C-N 3.31Å; L379-V381 PolarHBondContact O-N 3.03Å; V381-T384 PolarHBondContact O-N 3.35Å; V381-I385 HydrophobicContact CG1-CD1 3.64Å; V381-I385 HydrophobicContact CG1-CG1 4.27Å; V381-I385 WeakPolarHBondContact O-CB 3.4Å; V381-I385 WeakPolarHBondContact O-CG1 3.29Å; V381-I385 PolarHBondContact O-N 2.86Å |
| 382 | G | 81.4 | Confident | 82.6 | Confident | 0 Ų | 0 | 25.1 Ų | 25.1 | 0% | 0 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -60.8 | -44.9 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | Y106 V378 L379 T384 I385 N386 D475 | Y106-G382 VanDerWaalsContact CE2-CA 3.45Å; Y106-G382 WeakPolarHBondContact OH-CA 3.3Å; V378-G382 PolarHBondContact O-N 3.37Å; L379-G382 PolarHBondContact O-N 2.84Å; G382-T384 PolarHBondContact O-N 3.09Å; G382-I385 PolarHBondContact O-N 2.85Å; G382-N386 WeakPolarHBondContact O-CA 3.41Å; G382-N386 WeakPolarHBondContact O-CB 3.39Å; G382-N386 PolarHBondContact O-N 3.24Å; G382-D475 VanDerWaalsContact C-OD2 3.27Å; G382-D475 VanDerWaalsContact CA-OD1 3.27Å; G382-D475 WeakPolarHBondContact CA-OD1 3.36Å |
| 383 | A | 76 | Confident | 83.5 | Confident | 5 Ų | 5 | 18.7 Ų | 18.7 | 4% | 0.041 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -59 | -16.5 | 179.4 | 0 | 0 | 0 | 0 | 0 | 114.3 | L357 L379 M387 D475 | L357-A383 HydrophobicContact CD1-CB 4.43Å; L379-A383 PolarHBondContact O-N 2.97Å; A383-M387 WeakPolarHBondContact O-CE 3.28Å; A383-D475 PolarHBondContact N-OD2 3.36Å |
| 384 | T | 73 | Confident | 84.4 | Confident | 32 Ų | 32 | 14.4 Ų | 14.4 | 20% | 0.196 | 7% | 0.07 | C | C | . | . | H | α-helix | trans | -104.6 | -47.9 | 174.6 | -48.5 | 0 | 0 | 0 | 0 | 112 | V381 G382 | V381-T384 PolarHBondContact O-N 3.35Å; G382-T384 PolarHBondContact O-N 3.09Å |
| 385 | I | 81.1 | Confident | 85 | Confident | 9 Ų | 9 | 14.3 Ų | 14.3 | 5% | 0.046 | 7% | 0.07 | C | C | . | . | H | α-helix | trans | -89.1 | -39.7 | -169.7 | -59.9 | -175.5 | 0 | 0 | 0 | 112.3 | L87 Y106 V381 G382 M387 I426 | L87-I385 HydrophobicContact CD2-CD1 3.88Å; Y106-I385 HydrophobicContact CD2-CB 4.46Å; Y106-I385 HydrophobicContact CD2-CG2 4.37Å; V381-I385 HydrophobicContact CG1-CD1 3.64Å; V381-I385 HydrophobicContact CG1-CG1 4.27Å; V381-I385 WeakPolarHBondContact O-CB 3.4Å; V381-I385 WeakPolarHBondContact O-CG1 3.29Å; V381-I385 PolarHBondContact O-N 2.86Å; G382-I385 PolarHBondContact O-N 2.85Å; I385-M387 PolarHBondContact O-N 2.84Å; I385-I426 HydrophobicContact CB-CG2 4.42Å; I385-I426 HydrophobicContact CG1-CG2 4.28Å; I385-I426 HydrophobicContact CG2-CG1 4.26Å; I385-I426 HydrophobicContact CG2-CG2 4.13Å |
| 386 | N | 88.1 | Confident | 85.9 | Confident | 1 Ų | 1 | 14.3 Ų | 14.3 | 1% | 0.005 | 7% | 0.07 | C | C | . | . | trans | -93.4 | 76.8 | -166.2 | -173.5 | 43.4 | 0 | 0 | 0 | 112 | Y106 G382 D388 D475 | Y106-N386 HydrophobicContact CD1-CB 3.41Å; Y106-N386 VanDerWaalsContact CD1-CB 3.41Å; Y106-N386 WeakPolarHBondContact CD1-ND2 3.11Å; Y106-N386 WeakPolarHBondContact CD1-OD1 3.4Å; Y106-N386 HydrophobicContact CD2-CB 3.89Å; Y106-N386 HydrophobicContact CE1-CB 3.62Å; Y106-N386 VanDerWaalsContact CE1-CG 3.49Å; Y106-N386 WeakPolarHBondContact CE1-ND2 3.37Å; Y106-N386 HydrophobicContact CE2-CB 4.08Å; Y106-N386 HydrophobicContact CG-CB 3.55Å; G382-N386 WeakPolarHBondContact O-CA 3.41Å; G382-N386 WeakPolarHBondContact O-CB 3.39Å; G382-N386 PolarHBondContact O-N 3.24Å; N386-D388 PolarHBondContact OD1-OD1 3.42Å; N386-D475 VanDerWaalsContact CB-OD1 3.26Å; N386-D475 WeakPolarHBondContact CB-OD1 3.3Å; N386-D475 PolarHBondContact ND2-N 3.42Å; N386-D475 PolarHBondContact ND2-OD1 2.82Å | ||
| 387 | M | 90.9 | Very high | 87 | Confident | 3 Ų | 3 | 7.5 Ų | 7.5 | 2% | 0.015 | 4% | 0.044 | C | C | . | . | trans | -108.3 | 51.5 | -173.3 | -71.8 | -121 | 171.1 | 0 | 0 | 112.8 | A383 I385 G389 T390 A391 S425 A428 A429 | A383-M387 WeakPolarHBondContact O-CE 3.28Å; I385-M387 PolarHBondContact O-N 2.84Å; M387-G389 VanDerWaalsContact C-N 3.34Å; M387-G389 PolarHBondContact O-N 3.4Å; M387-T390 WeakPolarHBondContact O-CA 3.24Å; M387-T390 WeakPolarHBondContact O-CB 3.44Å; M387-T390 PolarHBondContact O-N 2.98Å; M387-T390 PolarHBondContact SD-OG1 3.33Å; M387-A391 PolarHBondContact O-N 2.96Å; M387-S425 VanDerWaalsContact CB-O 3.23Å; M387-S425 WeakPolarHBondContact CB-O 3.48Å; M387-S425 VanDerWaalsContact CG-O 3.26Å; M387-S425 WeakPolarHBondContact CG-O 3.25Å; M387-A428 HydrophobicContact CE-CB 4.48Å; M387-A428 WeakPolarHBondContact CE-O 3.41Å; M387-A428 HydrophobicContact SD-CB 3.55Å; M387-A428 VanDerWaalsContact SD-CB 3.55Å; M387-A428 VanDerWaalsContact SD-O 3.42Å; M387-A429 VanDerWaalsContact CE-C 3.41Å | ||
| 388 | D | 95.1 | Very high | 87.9 | Confident | 0 Ų | 0 | 5.9 Ų | 5.9 | 0% | 0 | 4% | 0.037 | C | C | . | . | H | α-helix | trans | -48.7 | -49.3 | -177.6 | -73.5 | -1.1 | 0 | 0 | 0 | 114.3 | T110 A113 H316 N386 T390 A391 L392 I470 N471 | T110-D388 WeakPolarHBondContact CA-OD1 3.34Å; T110-D388 WeakPolarHBondContact CB-OD1 3.27Å; T110-D388 PolarHBondContact N-OD1 3.22Å; T110-D388 PolarHBondContact OG1-OD1 3.11Å; A113-D388 HydrophobicContact CB-CB 4.02Å; A113-D388 WeakPolarHBondContact CB-O 3.46Å; H316-D388 IonicContact CD2-OD2 2.69Å; H316-D388 IonicContact CE1-OD2 3.53Å; H316-D388 WeakPolarHBondContact NE2-CB 3.44Å; H316-D388 IonicContact NE2-OD2 2.68Å; H316-D388 PolarHBondContact NE2-OD2 3.37Å; N386-D388 PolarHBondContact OD1-OD1 3.42Å; D388-T390 VanDerWaalsContact C-N 3.29Å; D388-T390 PolarHBondContact O-N 3.45Å; D388-A391 PolarHBondContact O-N 2.87Å; D388-L392 WeakPolarHBondContact O-CB 3.34Å; D388-L392 PolarHBondContact O-N 3.37Å; D388-I470 HydrophobicContact CB-CG2 4.45Å; D388-N471 PolarHBondContact N-OD1 2.98Å |
| 389 | G | 94.4 | Very high | 88.4 | Confident | 0 Ų | 0 | 6.3 Ų | 6.3 | 0% | 0 | 4% | 0.039 | C | C | . | . | H | α-helix | trans | -67 | -32.7 | -179.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | L313 M387 Y393 R467 N471 | L313-G389 VanDerWaalsContact CD2-CA 3.43Å; M387-G389 VanDerWaalsContact C-N 3.34Å; M387-G389 PolarHBondContact O-N 3.4Å; G389-Y393 VanDerWaalsContact O-CB 3.24Å; G389-Y393 WeakPolarHBondContact O-CB 3.45Å; G389-Y393 PolarHBondContact O-N 3.49Å; G389-Y393 VanDerWaalsContact O-N 3.13Å; G389-R467 WeakPolarHBondContact O-CD 3.3Å; G389-R467 WeakPolarHBondContact O-CG 3.44Å; G389-N471 WeakPolarHBondContact CA-OD1 3.28Å; G389-N471 PolarHBondContact N-OD1 3.2Å |
| 390 | T | 93.3 | Very high | 89 | Confident | 5 Ų | 5 | 6.5 Ų | 6.5 | 3% | 0.031 | 4% | 0.04 | C | C | . | . | H | α-helix | trans | -69.5 | -47.4 | 174.7 | -49.5 | 0 | 0 | 0 | 0 | 110.6 | M387 D388 L392 Y393 E394 A428 N471 | M387-T390 WeakPolarHBondContact O-CA 3.24Å; M387-T390 WeakPolarHBondContact O-CB 3.44Å; M387-T390 PolarHBondContact O-N 2.98Å; M387-T390 PolarHBondContact SD-OG1 3.33Å; D388-T390 VanDerWaalsContact C-N 3.29Å; D388-T390 PolarHBondContact O-N 3.45Å; T390-L392 PolarHBondContact O-N 3.44Å; T390-Y393 WeakPolarHBondContact O-CB 3.35Å; T390-Y393 PolarHBondContact O-N 3.21Å; T390-E394 HydrophobicContact CG2-CG 4.5Å; T390-E394 WeakPolarHBondContact O-CB 3.36Å; T390-E394 WeakPolarHBondContact O-CG 3.32Å; T390-E394 PolarHBondContact O-N 3.25Å; T390-A428 HydrophobicContact CG2-CB 4.04Å; T390-N471 PolarHBondContact OG1-ND2 2.95Å |
| 391 | A | 95.4 | Very high | 89.9 | Confident | 0 Ų | 0 | 3.9 Ų | 3.9 | 0% | 0 | 2% | 0.023 | C | C | . | . | H | α-helix | trans | -63.2 | -43.9 | -179.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | T110 V114 M387 D388 E394 A395 | T110-A391 HydrophobicContact CG2-CB 3.46Å; T110-A391 VanDerWaalsContact CG2-CB 3.46Å; V114-A391 HydrophobicContact CG2-CB 3.49Å; V114-A391 VanDerWaalsContact CG2-CB 3.49Å; M387-A391 PolarHBondContact O-N 2.96Å; D388-A391 PolarHBondContact O-N 2.87Å; A391-E394 PolarHBondContact O-N 3.5Å; A391-A395 PolarHBondContact O-N 3.03Å; A391-A395 VanDerWaalsContact O-N 3.09Å |
| 392 | L | 97.2 | Very high | 90.5 | Very high | 0 Ų | 0 | 3.4 Ų | 3.4 | 0% | 0 | 2% | 0.02 | C | C | . | . | H | α-helix | trans | -59 | -49.5 | 174.6 | -175.7 | 156 | 0 | 0 | 0 | 110.9 | A113 V116 G312 L313 H316 D388 T390 E394 A395 V396 | A113-L392 HydrophobicContact CB-CB 4.17Å; A113-L392 WeakPolarHBondContact O-CD1 3.44Å; A113-L392 WeakPolarHBondContact O-CG 3.21Å; V116-L392 HydrophobicContact CB-CD1 4.4Å; V116-L392 HydrophobicContact CG1-CD1 4.18Å; G312-L392 VanDerWaalsContact C-CD1 3.48Å; G312-L392 WeakPolarHBondContact O-CD1 3.22Å; L313-L392 HydrophobicContact CD2-CD1 4.48Å; L313-L392 HydrophobicContact CD2-CD2 4.29Å; L313-L392 HydrophobicContact CG-CD2 4.34Å; H316-L392 HydrophobicContact CB-CD1 4.12Å; D388-L392 WeakPolarHBondContact O-CB 3.34Å; D388-L392 PolarHBondContact O-N 3.37Å; T390-L392 PolarHBondContact O-N 3.44Å; L392-E394 VanDerWaalsContact C-N 3.3Å; L392-E394 PolarHBondContact O-N 3.41Å; L392-A395 PolarHBondContact O-N 3.25Å; L392-V396 HydrophobicContact CD2-CG2 4.02Å; L392-V396 VanDerWaalsContact O-CG2 3.27Å; L392-V396 WeakPolarHBondContact O-CG2 3.41Å; L392-V396 PolarHBondContact O-N 2.88Å |
| 393 | Y | 95.2 | Very high | 90.8 | Very high | 0 Ų | 0 | 4.4 Ų | 4.4 | 0% | 0 | 3% | 0.025 | C | C | . | . | H | α-helix | trans | -57.8 | -44 | 176.9 | 159.8 | -88.1 | 0 | 0 | 0 | 111.9 | Y305 V309 G389 T390 A395 V396 A397 L436 M439 I456 D460 L463 R467 | Y305-Y393 WeakPolarHBondContact OH-CD2 3.27Å; Y305-Y393 WeakPolarHBondContact OH-CE2 3.44Å; V309-Y393 HydrophobicContact CG1-CD2 4.29Å; V309-Y393 HydrophobicContact CG2-CD2 4.4Å; G389-Y393 VanDerWaalsContact O-CB 3.24Å; G389-Y393 WeakPolarHBondContact O-CB 3.45Å; G389-Y393 PolarHBondContact O-N 3.49Å; G389-Y393 VanDerWaalsContact O-N 3.13Å; T390-Y393 WeakPolarHBondContact O-CB 3.35Å; T390-Y393 PolarHBondContact O-N 3.21Å; Y393-A395 PolarHBondContact O-N 3.43Å; Y393-V396 PolarHBondContact O-N 3.12Å; Y393-A397 PolarHBondContact O-N 3.38Å; Y393-L436 VanDerWaalsContact OH-CD2 3.22Å; Y393-L436 WeakPolarHBondContact OH-CD2 3.39Å; Y393-M439 HydrophobicContact CD1-CE 3.96Å; Y393-M439 HydrophobicContact CE1-CE 3.41Å; Y393-M439 VanDerWaalsContact CE1-CE 3.41Å; Y393-I456 WeakPolarHBondContact OH-CD1 3.48Å; Y393-D460 WeakPolarHBondContact CE2-OD1 3.39Å; Y393-D460 PolarHBondContact OH-OD1 3.32Å; Y393-D460 VanDerWaalsContact OH-OD1 3.09Å; Y393-L463 HydrophobicContact CE2-CD1 4.5Å; Y393-R467 VanDerWaalsContact CB-CD 3.47Å; Y393-R467 VanDerWaalsContact CD2-NH1 3.26Å |
| 394 | E | 94.4 | Very high | 91.2 | Very high | 0 Ų | 0 | 5.4 Ų | 5.4 | 0% | 0 | 3% | 0.03 | C | C | . | . | H | α-helix | trans | -60.7 | -47.2 | -178.2 | -81.7 | 175.7 | -172.9 | 0 | 0 | 112.2 | T390 A391 L392 A397 A398 A421 A424 T438 M439 V442 | T390-E394 HydrophobicContact CG2-CG 4.5Å; T390-E394 WeakPolarHBondContact O-CB 3.36Å; T390-E394 WeakPolarHBondContact O-CG 3.32Å; T390-E394 PolarHBondContact O-N 3.25Å; A391-E394 PolarHBondContact O-N 3.5Å; L392-E394 VanDerWaalsContact C-N 3.3Å; L392-E394 PolarHBondContact O-N 3.41Å; E394-A397 PolarHBondContact O-N 3.16Å; E394-A398 WeakPolarHBondContact O-CB 3.32Å; E394-A398 PolarHBondContact O-N 3.07Å; E394-A421 HydrophobicContact CB-CB 3.93Å; E394-A421 WeakPolarHBondContact OE2-CA 3.43Å; E394-A424 WeakPolarHBondContact OE2-CB 3.4Å; E394-T438 WeakPolarHBondContact OE1-CB 3.44Å; E394-T438 PolarHBondContact OE1-OG1 3.36Å; E394-M439 VanDerWaalsContact CA-CE 3.48Å; E394-M439 HydrophobicContact CB-CE 4.27Å; E394-M439 HydrophobicContact CG-CE 4.12Å; E394-V442 HydrophobicContact CB-CG2 4.17Å; E394-V442 HydrophobicContact CG-CG2 4.42Å |
| 395 | A | 95.7 | Very high | 91.6 | Very high | 0 Ų | 0 | 6.1 Ų | 6.1 | 0% | 0 | 3% | 0.033 | C | C | . | . | H | α-helix | trans | -62.9 | -44 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112 | V114 I118 A391 L392 Y393 I399 I417 A421 | V114-A395 HydrophobicContact CG1-CB 3.98Å; I118-A395 HydrophobicContact CG1-CB 4Å; A391-A395 PolarHBondContact O-N 3.03Å; A391-A395 VanDerWaalsContact O-N 3.09Å; L392-A395 PolarHBondContact O-N 3.25Å; Y393-A395 PolarHBondContact O-N 3.43Å; A395-I399 WeakPolarHBondContact O-CG1 3.28Å; A395-I399 PolarHBondContact O-N 2.93Å; A395-I417 HydrophobicContact CB-CG2 4.15Å; A395-A421 HydrophobicContact CB-CB 4.36Å |
| 396 | V | 96.4 | Very high | 91.6 | Very high | 0 Ų | 0 | 9.8 Ų | 9.8 | 0% | 0 | 5% | 0.053 | C | C | . | . | H | α-helix | trans | -63.9 | -45.3 | 178.9 | 173.3 | 0 | 0 | 0 | 0 | 111.2 | G117 V121 Y305 T308 V309 L392 Y393 F400 | G117-V396 WeakPolarHBondContact O-CG2 3.31Å; V121-V396 HydrophobicContact CB-CB 4.48Å; V121-V396 HydrophobicContact CB-CG1 4.1Å; V121-V396 HydrophobicContact CB-CG2 4.31Å; V121-V396 HydrophobicContact CG2-CG1 4.11Å; Y305-V396 HydrophobicContact CD2-CG1 4.11Å; Y305-V396 HydrophobicContact CE2-CG1 3.95Å; T308-V396 HydrophobicContact CG2-CG1 3.79Å; V309-V396 HydrophobicContact CG2-CB 4.13Å; V309-V396 HydrophobicContact CG2-CG1 3.6Å; L392-V396 HydrophobicContact CD2-CG2 4.02Å; L392-V396 VanDerWaalsContact O-CG2 3.27Å; L392-V396 WeakPolarHBondContact O-CG2 3.41Å; L392-V396 PolarHBondContact O-N 2.88Å; Y393-V396 PolarHBondContact O-N 3.12Å; V396-F400 VanDerWaalsContact O-CB 3.25Å; V396-F400 WeakPolarHBondContact O-CB 3.4Å; V396-F400 PolarHBondContact O-N 3.12Å |
| 397 | A | 93.8 | Very high | 91.2 | Very high | 0 Ų | 0 | 11.4 Ų | 11.4 | 0% | 0 | 6% | 0.059 | C | C | . | . | H | α-helix | trans | -73.4 | -34.9 | -178.2 | 0 | 0 | 0 | 0 | 0 | 113 | Y305 Y393 E394 I399 F400 I401 M439 I456 | Y305-A397 HydrophobicContact CE2-CB 3.61Å; Y305-A397 WeakPolarHBondContact OH-CB 3.31Å; Y393-A397 PolarHBondContact O-N 3.38Å; E394-A397 PolarHBondContact O-N 3.16Å; A397-I399 VanDerWaalsContact C-N 3.35Å; A397-I399 PolarHBondContact O-N 3.13Å; A397-F400 PolarHBondContact O-N 3.3Å; A397-I401 WeakPolarHBondContact O-CB 3.46Å; A397-I401 VanDerWaalsContact O-CG1 3.29Å; A397-I401 WeakPolarHBondContact O-CG1 3.45Å; A397-I401 PolarHBondContact O-N 3.34Å; A397-M439 HydrophobicContact CB-CE 3.16Å; A397-M439 HydrophobicContact CB-SD 4.24Å; A397-I456 HydrophobicContact CB-CD1 3.68Å |
| 398 | A | 93.1 | Very high | 90.7 | Very high | 0 Ų | 0 | 19.5 Ų | 19.5 | 0% | 0 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -59.8 | -46.5 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | E394 I401 A402 I417 V442 L443 | E394-A398 WeakPolarHBondContact O-CB 3.32Å; E394-A398 PolarHBondContact O-N 3.07Å; A398-I401 PolarHBondContact O-N 3.21Å; A398-A402 PolarHBondContact O-N 2.95Å; A398-I417 HydrophobicContact CB-CD1 4.22Å; A398-I417 HydrophobicContact CB-CG1 4.35Å; A398-I417 HydrophobicContact CB-CG2 4.1Å; A398-V442 HydrophobicContact CB-CG1 3.77Å; A398-L443 HydrophobicContact CB-CD2 4Å |
| 399 | I | 94 | Very high | 90 | Very high | 9 Ų | 9 | 21.3 Ų | 21.3 | 5% | 0.046 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -68.7 | -39.2 | 177.2 | -64.4 | 169 | 0 | 0 | 0 | 111 | I118 V121 A395 A397 A402 Q403 L409 I417 | I118-I399 HydrophobicContact CB-CD1 4.28Å; I118-I399 HydrophobicContact CG1-CD1 3.87Å; I118-I399 HydrophobicContact CG2-CD1 4.08Å; V121-I399 HydrophobicContact CB-CG2 4.49Å; V121-I399 HydrophobicContact CG1-CB 3.82Å; V121-I399 HydrophobicContact CG1-CD1 3.61Å; V121-I399 HydrophobicContact CG1-CG1 4.3Å; V121-I399 HydrophobicContact CG1-CG2 3.72Å; V121-I399 HydrophobicContact CG2-CB 4.16Å; V121-I399 HydrophobicContact CG2-CG2 3.92Å; A395-I399 WeakPolarHBondContact O-CG1 3.28Å; A395-I399 PolarHBondContact O-N 2.93Å; A397-I399 VanDerWaalsContact C-N 3.35Å; A397-I399 PolarHBondContact O-N 3.13Å; I399-A402 WeakPolarHBondContact O-CB 3.18Å; I399-A402 PolarHBondContact O-N 3.44Å; I399-Q403 HydrophobicContact CG2-CG 4.37Å; I399-Q403 VanDerWaalsContact O-CG 3.27Å; I399-Q403 WeakPolarHBondContact O-CG 3.49Å; I399-Q403 PolarHBondContact O-N 2.86Å; I399-L409 HydrophobicContact CB-CD1 4.36Å; I399-L409 HydrophobicContact CG1-CD1 3.93Å; I399-L409 HydrophobicContact CG2-CD1 4.39Å; I399-I417 HydrophobicContact CG1-CD1 4.08Å |
| 400 | F | 93.1 | Very high | 89.4 | Confident | 5 Ų | 5 | 25.1 Ų | 25.1 | 2% | 0.022 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -60.6 | -46 | 174.7 | 168.5 | -111.1 | 0 | 0 | 0 | 112.2 | P126 K301 Y305 V396 A397 A402 Q403 V404 I456 | P126-F400 HydrophobicContact CB-CD2 3.93Å; P126-F400 HydrophobicContact CB-CE2 4.23Å; P126-F400 HydrophobicContact CG-CB 4.46Å; P126-F400 HydrophobicContact CG-CD2 3.82Å; K301-F400 HydrophobicContact CB-CE2 4.16Å; K301-F400 HydrophobicContact CB-CZ 4.23Å; Y305-F400 HydrophobicContact CD2-CB 3.82Å; Y305-F400 AromaticContact CD2-CD1 3.64Å; Y305-F400 HydrophobicContact CD2-CD1 3.64Å; Y305-F400 HydrophobicContact CD2-CD2 4.27Å; Y305-F400 HydrophobicContact CD2-CE1 4.25Å; Y305-F400 AromaticContact CD2-CG 3.64Å; Y305-F400 HydrophobicContact CD2-CG 3.64Å; Y305-F400 HydrophobicContact CE2-CB 4.32Å; Y305-F400 HydrophobicContact CE2-CD1 4.18Å; Y305-F400 HydrophobicContact CE2-CG 4.4Å; Y305-F400 AromaticContact CG-CD1 3.89Å; Y305-F400 HydrophobicContact CG-CD1 3.89Å; Y305-F400 HydrophobicContact CG-CD2 4.44Å; Y305-F400 HydrophobicContact CG-CE1 4.02Å; Y305-F400 HydrophobicContact CG-CG 4.1Å; Y305-F400 HydrophobicContact CG-CZ 4.33Å; V396-F400 VanDerWaalsContact O-CB 3.25Å; V396-F400 WeakPolarHBondContact O-CB 3.4Å; V396-F400 PolarHBondContact O-N 3.12Å; A397-F400 PolarHBondContact O-N 3.3Å; F400-A402 VanDerWaalsContact C-N 3.3Å; F400-A402 PolarHBondContact O-N 2.69Å; F400-Q403 WeakPolarHBondContact O-CB 3.27Å; F400-Q403 PolarHBondContact O-N 2.91Å; F400-V404 HydrophobicContact CD1-CG2 4.42Å; F400-V404 HydrophobicContact CD2-CG2 3.84Å; F400-V404 HydrophobicContact CE1-CG2 4.02Å; F400-V404 HydrophobicContact CE2-CG2 3.4Å; F400-V404 VanDerWaalsContact CE2-CG2 3.4Å; F400-V404 HydrophobicContact CG-CG2 4.35Å; F400-V404 HydrophobicContact CZ-CG2 3.51Å; F400-V404 VanDerWaalsContact O-CG2 3.31Å; F400-V404 WeakPolarHBondContact O-CG2 3.45Å; F400-V404 PolarHBondContact O-N 3.17Å; F400-I456 HydrophobicContact CD1-CG2 4.01Å; F400-I456 HydrophobicContact CE1-CG2 3.84Å |
| 401 | I | 89.3 | Confident | 88.8 | Confident | 2 Ų | 2 | 32 Ų | 32 | 1% | 0.01 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -61.4 | -41.2 | 176.9 | -73.3 | 168.2 | 0 | 0 | 0 | 110.3 | A397 A398 V404 N405 L443 D452 I456 | A397-I401 WeakPolarHBondContact O-CB 3.46Å; A397-I401 VanDerWaalsContact O-CG1 3.29Å; A397-I401 WeakPolarHBondContact O-CG1 3.45Å; A397-I401 PolarHBondContact O-N 3.34Å; A398-I401 PolarHBondContact O-N 3.21Å; I401-V404 PolarHBondContact O-N 3.29Å; I401-N405 WeakPolarHBondContact O-CB 3.32Å; I401-N405 PolarHBondContact O-N 2.83Å; I401-N405 PolarHBondContact O-ND2 3.33Å; I401-L443 HydrophobicContact CB-CD2 4.37Å; I401-L443 HydrophobicContact CD1-CD1 3.79Å; I401-L443 HydrophobicContact CD1-CD2 4.01Å; I401-L443 HydrophobicContact CG2-CD2 4.32Å; I401-D452 HydrophobicContact CD1-CB 4.34Å; I401-D452 HydrophobicContact CG1-CB 4.27Å; I401-D452 HydrophobicContact CG2-CB 3.75Å; I401-I456 HydrophobicContact CD1-CD1 4.31Å |
| 402 | A | 88.8 | Confident | 87.8 | Confident | 1 Ų | 1 | 32.9 Ų | 32.9 | 1% | 0.008 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -58.7 | -48.8 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | A398 I399 F400 V404 N405 N406 Y407 L409 L448 | A398-A402 PolarHBondContact O-N 2.95Å; I399-A402 WeakPolarHBondContact O-CB 3.18Å; I399-A402 PolarHBondContact O-N 3.44Å; F400-A402 VanDerWaalsContact C-N 3.3Å; F400-A402 PolarHBondContact O-N 2.69Å; A402-V404 PolarHBondContact O-N 3.3Å; A402-N405 PolarHBondContact O-N 3.11Å; A402-N406 PolarHBondContact O-N 3.46Å; A402-Y407 PolarHBondContact O-N 3.42Å; A402-L409 HydrophobicContact CB-CD1 3.56Å; A402-L409 HydrophobicContact CB-CD2 3.95Å; A402-L409 HydrophobicContact CB-CG 3.66Å; A402-L448 HydrophobicContact CB-CD1 4.06Å; A402-L448 HydrophobicContact CB-CD2 4.12Å |
| 403 | Q | 89.6 | Confident | 87.1 | Confident | 20 Ų | 20 | 33 Ų | 33 | 9% | 0.093 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -61.3 | -43.2 | 178.2 | -69.4 | 170.8 | 0.5 | 0 | 0 | 112.6 | H125 I399 F400 N405 N406 | H125-Q403 PolarHBondContact CE1-NE2 2.8Å; H125-Q403 PolarHBondContact ND1-NE2 2.88Å; I399-Q403 HydrophobicContact CG2-CG 4.37Å; I399-Q403 VanDerWaalsContact O-CG 3.27Å; I399-Q403 WeakPolarHBondContact O-CG 3.49Å; I399-Q403 PolarHBondContact O-N 2.86Å; F400-Q403 WeakPolarHBondContact O-CB 3.27Å; F400-Q403 PolarHBondContact O-N 2.91Å; Q403-N405 PolarHBondContact O-N 3.18Å; Q403-N406 PolarHBondContact O-N 2.86Å |
| 404 | V | 82.9 | Confident | 86.7 | Confident | 26 Ų | 26 | 35.3 Ų | 35.3 | 16% | 0.158 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -63 | -34.2 | -179.5 | 170.9 | 0 | 0 | 0 | 0 | 111.8 | K301 F400 I401 A402 | K301-V404 HydrophobicContact CD-CG2 4.26Å; F400-V404 HydrophobicContact CD1-CG2 4.42Å; F400-V404 HydrophobicContact CD2-CG2 3.84Å; F400-V404 HydrophobicContact CE1-CG2 4.02Å; F400-V404 HydrophobicContact CE2-CG2 3.4Å; F400-V404 VanDerWaalsContact CE2-CG2 3.4Å; F400-V404 HydrophobicContact CG-CG2 4.35Å; F400-V404 HydrophobicContact CZ-CG2 3.51Å; F400-V404 VanDerWaalsContact O-CG2 3.31Å; F400-V404 WeakPolarHBondContact O-CG2 3.45Å; F400-V404 PolarHBondContact O-N 3.17Å; I401-V404 PolarHBondContact O-N 3.29Å; A402-V404 PolarHBondContact O-N 3.3Å |
| 405 | N | 81.3 | Confident | 86.3 | Confident | 48 Ų | 48 | 38.6 Ų | 38.6 | 26% | 0.257 | 19% | 0.194 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -91.6 | 5.1 | 179.7 | -74.4 | -70.2 | 0 | 0 | 0 | 114.5 | I401 A402 Q403 Y407 D452 | I401-N405 WeakPolarHBondContact O-CB 3.32Å; I401-N405 PolarHBondContact O-N 2.83Å; I401-N405 PolarHBondContact O-ND2 3.33Å; A402-N405 PolarHBondContact O-N 3.11Å; Q403-N405 PolarHBondContact O-N 3.18Å; N405-Y407 HydrophobicContact CB-CD2 3.36Å; N405-Y407 HydrophobicContact CB-CE2 3.28Å; N405-Y407 HydrophobicContact CB-CG 4.28Å; N405-Y407 PolarHBondContact O-N 3.26Å; N405-D452 PolarHBondContact ND2-OD2 2.97Å; N405-D452 PolarHBondContact OD1-OD2 3.48Å |
| 406 | N | 80.9 | Confident | 85.6 | Confident | 86 Ų | 86 | 38.6 Ų | 38.6 | 46% | 0.46 | 19% | 0.194 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 58.8 | 29.6 | -173.9 | -59.6 | -64.8 | 0 | 0 | 0 | 114.4 | Q131 A402 Q403 E408 | Q131-N406 PolarHBondContact NE2-ND2 2.94Å; Q131-N406 VanDerWaalsContact NE2-ND2 3.11Å; Q131-N406 PolarHBondContact NE2-OD1 2.98Å; Q131-N406 PolarHBondContact OE1-OD1 3.13Å; A402-N406 PolarHBondContact O-N 3.46Å; Q403-N406 PolarHBondContact O-N 2.86Å; N406-E408 PolarHBondContact O-N 3.1Å |
| 407 | Y | 81.4 | Confident | 85.3 | Confident | 35 Ų | 35 | 38.6 Ų | 38.6 | 14% | 0.137 | 19% | 0.194 | C | C | . | . | P | Polyproline II helix | trans | -80.4 | 117.8 | 168.8 | -63.4 | -58.4 | 0 | 0 | 0 | 109.2 | K140 V142 A402 N405 L409 L448 P449 | K140-Y407 HydrophobicContact CB-CE1 4.28Å; V142-Y407 HydrophobicContact CG2-CD1 4Å; A402-Y407 PolarHBondContact O-N 3.42Å; N405-Y407 HydrophobicContact CB-CD2 3.36Å; N405-Y407 HydrophobicContact CB-CE2 3.28Å; N405-Y407 HydrophobicContact CB-CG 4.28Å; N405-Y407 PolarHBondContact O-N 3.26Å; Y407-L409 PolarHBondContact O-N 2.94Å; Y407-L448 HydrophobicContact CD2-CD2 3.31Å; Y407-L448 HydrophobicContact CE2-CD2 3.91Å; Y407-L448 HydrophobicContact CG-CD2 3.87Å; Y407-P449 HydrophobicContact CE2-CG 4.05Å |
| 408 | E | 78.6 | Confident | 85.2 | Confident | 173 Ų | 173 | 39.1 Ų | 39.1 | 81% | 0.808 | 20% | 0.198 | S | C | * | . | P | Polyproline II helix | trans | -74.9 | 116.8 | 167.7 | -66.3 | -172.4 | 167.8 | 0 | 0 | 108.6 | N406 | N406-E408 PolarHBondContact O-N 3.1Š|
| 409 | L | 81.6 | Confident | 84.8 | Confident | 37 Ų | 37 | 43 Ų | 43 | 19% | 0.194 | 22% | 0.218 | C | C | . | . | P | Polyproline II helix | trans | -87.9 | 123.9 | 175.4 | -66.3 | 174.7 | 0 | 0 | 0 | 109.5 | I399 A402 Y407 Q413 I414 I417 | I399-L409 HydrophobicContact CB-CD1 4.36Å; I399-L409 HydrophobicContact CG1-CD1 3.93Å; I399-L409 HydrophobicContact CG2-CD1 4.39Å; A402-L409 HydrophobicContact CB-CD1 3.56Å; A402-L409 HydrophobicContact CB-CD2 3.95Å; A402-L409 HydrophobicContact CB-CG 3.66Å; Y407-L409 PolarHBondContact O-N 2.94Å; L409-Q413 HydrophobicContact CD2-CB 4.2Å; L409-I414 HydrophobicContact CB-CG1 4.27Å; L409-I417 HydrophobicContact CD1-CD1 3.79Å; L409-I417 HydrophobicContact CD2-CD1 4.43Å |
| 410 | D | 80.9 | Confident | 84.3 | Confident | 80 Ų | 80 | 42.6 Ų | 42.6 | 43% | 0.428 | 22% | 0.216 | S | C | . | . | P | Polyproline II helix | trans | -74.8 | 160.5 | 170.3 | -178.6 | 47.4 | 0 | 0 | 0 | 111.5 | S145 G412 Q413 I414 | S145-D410 WeakPolarHBondContact CB-OD2 3.31Å; S145-D410 VanDerWaalsContact OG-CB 3.26Å; S145-D410 WeakPolarHBondContact OG-CB 3.35Å; S145-D410 PolarHBondContact OG-OD2 3.17Å; D410-G412 PolarHBondContact O-N 3.35Å; D410-G412 PolarHBondContact OD2-N 3.43Å; D410-Q413 WeakPolarHBondContact O-CB 3.47Å; D410-Q413 PolarHBondContact O-N 3.41Å; D410-I414 PolarHBondContact O-N 2.91Å; D410-I414 VanDerWaalsContact O-N 3.07Å |
| 411 | F | 81.2 | Confident | 84.2 | Confident | 149 Ų | 149 | 42.4 Ų | 42.4 | 65% | 0.654 | 22% | 0.215 | S | C | * | . | H | α-helix | trans | -52.2 | -40 | 176.5 | -177 | -107.1 | 0 | 0 | 0 | 112.7 | Q413 I414 I415 | F411-Q413 VanDerWaalsContact C-N 3.33Å; F411-Q413 PolarHBondContact O-N 3.03Å; F411-I414 PolarHBondContact O-N 2.87Å; F411-I415 HydrophobicContact CD1-CD1 3.86Å; F411-I415 HydrophobicContact CE1-CD1 3.35Å; F411-I415 HydrophobicContact CE1-CG1 4.31Å; F411-I415 HydrophobicContact CZ-CD1 3.75Å; F411-I415 HydrophobicContact CZ-CG1 4.36Å; F411-I415 PolarHBondContact O-N 3.45Å; F411-I415 VanDerWaalsContact O-N 3.12Å |
| 412 | G | 75.4 | Confident | 84.2 | Confident | 19 Ų | 19 | 43.1 Ų | 43.1 | 20% | 0.196 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -62.9 | -38 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113 | D410 I415 T416 | D410-G412 PolarHBondContact O-N 3.35Å; D410-G412 PolarHBondContact OD2-N 3.43Å; G412-I415 PolarHBondContact O-N 2.71Å; G412-T416 PolarHBondContact O-N 2.97Å; G412-T416 PolarHBondContact O-OG1 3.43Å |
| 413 | Q | 81.1 | Confident | 83.8 | Confident | 4 Ų | 4 | 44.2 Ų | 44.2 | 2% | 0.019 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -70.7 | -34.5 | 177.7 | -64.3 | 176.9 | -65.5 | 0 | 0 | 112 | L409 D410 F411 I415 T416 I417 V446 | L409-Q413 HydrophobicContact CD2-CB 4.2Å; D410-Q413 WeakPolarHBondContact O-CB 3.47Å; D410-Q413 PolarHBondContact O-N 3.41Å; F411-Q413 VanDerWaalsContact C-N 3.33Å; F411-Q413 PolarHBondContact O-N 3.03Å; Q413-I415 VanDerWaalsContact C-N 3.33Å; Q413-T416 PolarHBondContact O-N 3.2Å; Q413-I417 WeakPolarHBondContact O-CG1 3.49Å; Q413-I417 PolarHBondContact O-N 2.9Å; Q413-V446 HydrophobicContact CB-CG1 4.01Å; Q413-V446 HydrophobicContact CG-CG1 4.48Å |
| 414 | I | 88.2 | Confident | 83.4 | Confident | 47 Ų | 47 | 43.4 Ų | 43.4 | 24% | 0.241 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -62.9 | -42 | 173.4 | -63.8 | 172.8 | 0 | 0 | 0 | 110.6 | I118 L409 D410 F411 I417 S418 | I118-I414 HydrophobicContact CD1-CG2 4.13Å; I118-I414 HydrophobicContact CG2-CG2 3.86Å; L409-I414 HydrophobicContact CB-CG1 4.27Å; D410-I414 PolarHBondContact O-N 2.91Å; D410-I414 VanDerWaalsContact O-N 3.07Å; F411-I414 PolarHBondContact O-N 2.87Å; I414-I417 PolarHBondContact O-N 2.74Å; I414-S418 WeakPolarHBondContact O-CB 3.35Å; I414-S418 PolarHBondContact O-N 2.77Å |
| 415 | I | 85.4 | Confident | 83.5 | Confident | 69 Ų | 69 | 42.2 Ų | 42.2 | 35% | 0.354 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -62.8 | -45 | 173.9 | -68.5 | 172 | 0 | 0 | 0 | 110.7 | F411 G412 Q413 I417 S418 I419 | F411-I415 HydrophobicContact CD1-CD1 3.86Å; F411-I415 HydrophobicContact CE1-CD1 3.35Å; F411-I415 HydrophobicContact CE1-CG1 4.31Å; F411-I415 HydrophobicContact CZ-CD1 3.75Å; F411-I415 HydrophobicContact CZ-CG1 4.36Å; F411-I415 PolarHBondContact O-N 3.45Å; F411-I415 VanDerWaalsContact O-N 3.12Å; G412-I415 PolarHBondContact O-N 2.71Å; Q413-I415 VanDerWaalsContact C-N 3.33Å; I415-I417 PolarHBondContact O-N 2.62Å; I415-S418 WeakPolarHBondContact O-CB 3.16Å; I415-S418 PolarHBondContact O-N 3.18Å; I415-S418 VanDerWaalsContact O-N 3.1Å; I415-I419 HydrophobicContact CG2-CD1 3.78Å; I415-I419 HydrophobicContact CG2-CG1 4.38Å; I415-I419 WeakPolarHBondContact O-CG1 3.5Å; I415-I419 PolarHBondContact O-N 3.07Å |
| 416 | T | 80.6 | Confident | 83.4 | Confident | 0 Ų | 0 | 41.3 Ų | 41.3 | 0% | 0 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -58.3 | -47.5 | 176 | -64.3 | 0 | 0 | 0 | 0 | 111.4 | L152 G412 Q413 S418 I419 T420 V446 | L152-T416 HydrophobicContact CD1-CG2 4.26Å; L152-T416 HydrophobicContact CD2-CG2 4.17Å; G412-T416 PolarHBondContact O-N 2.97Å; G412-T416 PolarHBondContact O-OG1 3.43Å; Q413-T416 PolarHBondContact O-N 3.2Å; T416-S418 VanDerWaalsContact C-N 3.27Å; T416-S418 PolarHBondContact O-N 3.1Å; T416-I419 PolarHBondContact O-N 3.24Å; T416-T420 HydrophobicContact CG2-CG2 4.23Å; T416-T420 WeakPolarHBondContact O-CB 3.29Å; T416-T420 VanDerWaalsContact O-CG2 3.29Å; T416-T420 WeakPolarHBondContact O-CG2 3.4Å; T416-T420 PolarHBondContact O-N 3.24Å; T416-T420 PolarHBondContact O-OG1 3.11Å; T416-V446 HydrophobicContact CG2-CG1 3.78Å |
| 417 | I | 89.9 | Confident | 82.6 | Confident | 0 Ų | 0 | 37.4 Ų | 37.4 | 0% | 0 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -55.7 | -46 | 173.4 | -71.2 | 165.1 | 0 | 0 | 0 | 110 | A395 A398 I399 L409 Q413 I414 I415 I419 T420 A421 V442 V446 | A395-I417 HydrophobicContact CB-CG2 4.15Å; A398-I417 HydrophobicContact CB-CD1 4.22Å; A398-I417 HydrophobicContact CB-CG1 4.35Å; A398-I417 HydrophobicContact CB-CG2 4.1Å; I399-I417 HydrophobicContact CG1-CD1 4.08Å; L409-I417 HydrophobicContact CD1-CD1 3.79Å; L409-I417 HydrophobicContact CD2-CD1 4.43Å; Q413-I417 WeakPolarHBondContact O-CG1 3.49Å; Q413-I417 PolarHBondContact O-N 2.9Å; I414-I417 PolarHBondContact O-N 2.74Å; I415-I417 PolarHBondContact O-N 2.62Å; I417-I419 PolarHBondContact O-N 3.22Å; I417-T420 WeakPolarHBondContact CA-OG1 3.38Å; I417-T420 PolarHBondContact O-N 3.22Å; I417-T420 PolarHBondContact O-OG1 3.11Å; I417-A421 WeakPolarHBondContact O-CB 3.43Å; I417-A421 PolarHBondContact O-N 2.68Å; I417-V442 HydrophobicContact CG1-CG1 4.46Å; I417-V442 HydrophobicContact CG2-CG1 4Å; I417-V446 HydrophobicContact CD1-CG1 4.2Å; I417-V446 HydrophobicContact CD1-CG2 4.23Å; I417-V446 HydrophobicContact CG1-CB 4.45Å; I417-V446 HydrophobicContact CG1-CG1 3.64Å; I417-V446 HydrophobicContact CG1-CG2 4.03Å |
| 418 | S | 91.9 | Very high | 82.1 | Confident | 11 Ų | 11 | 35.9 Ų | 35.9 | 8% | 0.077 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -60.8 | -47.5 | -178.3 | -173.8 | 0 | 0 | 0 | 0 | 113.1 | V114 I414 I415 T416 T422 | V114-S418 VanDerWaalsContact CG1-OG 3.29Å; V114-S418 WeakPolarHBondContact CG1-OG 3.44Å; I414-S418 WeakPolarHBondContact O-CB 3.35Å; I414-S418 PolarHBondContact O-N 2.77Å; I415-S418 WeakPolarHBondContact O-CB 3.16Å; I415-S418 PolarHBondContact O-N 3.18Å; I415-S418 VanDerWaalsContact O-N 3.1Å; T416-S418 VanDerWaalsContact C-N 3.27Å; T416-S418 PolarHBondContact O-N 3.1Å; S418-T422 PolarHBondContact O-N 3.23Å; S418-T422 PolarHBondContact O-OG1 3.26Å |
| 419 | I | 85.5 | Confident | 81.4 | Confident | 82 Ų | 82 | 28.1 Ų | 28.1 | 42% | 0.421 | 15% | 0.153 | S | C | . | . | H | α-helix | trans | -69.1 | -45.3 | -179.4 | -66 | 171.5 | 0 | 0 | 0 | 110 | I415 T416 I417 T422 A423 | I415-I419 HydrophobicContact CG2-CD1 3.78Å; I415-I419 HydrophobicContact CG2-CG1 4.38Å; I415-I419 WeakPolarHBondContact O-CG1 3.5Å; I415-I419 PolarHBondContact O-N 3.07Å; T416-I419 PolarHBondContact O-N 3.24Å; I417-I419 PolarHBondContact O-N 3.22Å; I419-T422 PolarHBondContact O-N 3.34Å; I419-A423 WeakPolarHBondContact O-CB 3.5Å; I419-A423 PolarHBondContact O-N 3.43Å |
| 420 | T | 83 | Confident | 80.6 | Confident | 1 Ų | 1 | 26.6 Ų | 26.6 | 1% | 0.006 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -68.2 | -38.7 | -178.6 | 55.6 | 0 | 0 | 0 | 0 | 113.3 | L152 T416 I417 T422 A423 A424 S445 | L152-T420 HydrophobicContact CD1-CG2 3.24Å; L152-T420 HydrophobicContact CG-CG2 4.5Å; T416-T420 HydrophobicContact CG2-CG2 4.23Å; T416-T420 WeakPolarHBondContact O-CB 3.29Å; T416-T420 VanDerWaalsContact O-CG2 3.29Å; T416-T420 WeakPolarHBondContact O-CG2 3.4Å; T416-T420 PolarHBondContact O-N 3.24Å; T416-T420 PolarHBondContact O-OG1 3.11Å; I417-T420 WeakPolarHBondContact CA-OG1 3.38Å; I417-T420 PolarHBondContact O-N 3.22Å; I417-T420 PolarHBondContact O-OG1 3.11Å; T420-T422 VanDerWaalsContact C-N 3.33Å; T420-T422 PolarHBondContact O-N 3.18Å; T420-A423 PolarHBondContact O-N 3.25Å; T420-A424 WeakPolarHBondContact O-CA 3.41Å; T420-A424 WeakPolarHBondContact O-CB 3.37Å; T420-A424 PolarHBondContact O-N 2.96Å; T420-S445 PolarHBondContact OG1-OG 3.25Å |
| 421 | A | 91.2 | Very high | 79.8 | Confident | 0 Ų | 0 | 23.9 Ų | 23.9 | 0% | 0 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -63.3 | -40.4 | 174 | 0 | 0 | 0 | 0 | 0 | 111.6 | V114 E394 A395 I417 A423 S425 V442 | V114-A421 HydrophobicContact CG2-CB 4.14Å; E394-A421 HydrophobicContact CB-CB 3.93Å; E394-A421 WeakPolarHBondContact OE2-CA 3.43Å; A395-A421 HydrophobicContact CB-CB 4.36Å; I417-A421 WeakPolarHBondContact O-CB 3.43Å; I417-A421 PolarHBondContact O-N 2.68Å; A421-A423 PolarHBondContact O-N 2.91Å; A421-S425 VanDerWaalsContact O-CB 3.3Å; A421-S425 WeakPolarHBondContact O-CB 3.28Å; A421-S425 PolarHBondContact O-N 3.35Å; A421-S425 PolarHBondContact O-OG 3.46Å; A421-V442 HydrophobicContact CB-CG1 4.46Å; A421-V442 HydrophobicContact CB-CG2 4.16Å |
| 422 | T | 89.5 | Confident | 78.9 | Confident | 18 Ų | 18 | 19.4 Ų | 19.4 | 11% | 0.11 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -64.3 | -40.2 | 175.2 | -52.8 | 0 | 0 | 0 | 0 | 111.7 | T110 S418 I419 T420 S425 I426 | T110-T422 HydrophobicContact CG2-CG2 3.98Å; S418-T422 PolarHBondContact O-N 3.23Å; S418-T422 PolarHBondContact O-OG1 3.26Å; I419-T422 PolarHBondContact O-N 3.34Å; T420-T422 VanDerWaalsContact C-N 3.33Å; T420-T422 PolarHBondContact O-N 3.18Å; T422-S425 PolarHBondContact O-OG 3.09Å; T422-I426 WeakPolarHBondContact O-CG1 3.3Å |
| 423 | A | 79.8 | Confident | 78.5 | Confident | 24 Ų | 24 | 19 Ų | 19 | 20% | 0.198 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -74.7 | -40.6 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | L232 I419 T420 A421 S425 I426 | L232-A423 HydrophobicContact CD1-CB 4.26Å; I419-A423 WeakPolarHBondContact O-CB 3.5Å; I419-A423 PolarHBondContact O-N 3.43Å; T420-A423 PolarHBondContact O-N 3.25Å; A421-A423 PolarHBondContact O-N 2.91Å; A423-S425 VanDerWaalsContact C-N 3.35Å; A423-I426 PolarHBondContact O-N 3.07Å |
| 424 | A | 79.9 | Confident | 77.8 | Confident | 3 Ų | 3 | 19.4 Ų | 19.4 | 3% | 0.025 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -66.5 | -37.5 | -179.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | E394 T420 I426 G427 A428 T438 I441 V442 | E394-A424 WeakPolarHBondContact OE2-CB 3.4Å; T420-A424 WeakPolarHBondContact O-CA 3.41Å; T420-A424 WeakPolarHBondContact O-CB 3.37Å; T420-A424 PolarHBondContact O-N 2.96Å; A424-I426 VanDerWaalsContact C-N 3.26Å; A424-I426 PolarHBondContact O-N 3.24Å; A424-G427 WeakPolarHBondContact O-CA 3.45Å; A424-G427 PolarHBondContact O-N 3.44Å; A424-A428 PolarHBondContact O-N 3.47Å; A424-T438 WeakPolarHBondContact O-CG2 3.42Å; A424-I441 HydrophobicContact CB-CB 4.25Å; A424-I441 HydrophobicContact CB-CD1 3.96Å; A424-I441 HydrophobicContact CB-CG2 4.45Å; A424-V442 HydrophobicContact CB-CG2 3.99Å |
| 425 | S | 85.7 | Confident | 77 | Confident | 0 Ų | 0 | 17.2 Ų | 17.2 | 0% | 0 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -62.4 | -30.9 | 177.4 | 71.1 | 0 | 0 | 0 | 0 | 113.3 | T110 M387 A421 T422 A423 G427 A428 | T110-S425 VanDerWaalsContact CG2-OG 3.31Å; T110-S425 WeakPolarHBondContact CG2-OG 3.5Å; M387-S425 VanDerWaalsContact CB-O 3.23Å; M387-S425 WeakPolarHBondContact CB-O 3.48Å; M387-S425 VanDerWaalsContact CG-O 3.26Å; M387-S425 WeakPolarHBondContact CG-O 3.25Å; A421-S425 VanDerWaalsContact O-CB 3.3Å; A421-S425 WeakPolarHBondContact O-CB 3.28Å; A421-S425 PolarHBondContact O-N 3.35Å; A421-S425 PolarHBondContact O-OG 3.46Å; T422-S425 PolarHBondContact O-OG 3.09Å; A423-S425 VanDerWaalsContact C-N 3.35Å; S425-G427 PolarHBondContact O-N 2.84Å; S425-A428 WeakPolarHBondContact O-CB 3.5Å; S425-A428 PolarHBondContact O-N 3.06Å |
| 426 | I | 80.1 | Confident | 76.4 | Confident | 30 Ų | 30 | 14.3 Ų | 14.3 | 15% | 0.154 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -66.2 | -31 | 174.9 | -58.8 | 167.6 | 0 | 0 | 0 | 111.2 | L83 L107 I385 T422 A423 A424 | L83-I426 HydrophobicContact CD2-CG2 3.78Å; L107-I426 HydrophobicContact CD2-CD1 3.59Å; I385-I426 HydrophobicContact CB-CG2 4.42Å; I385-I426 HydrophobicContact CG1-CG2 4.28Å; I385-I426 HydrophobicContact CG2-CG1 4.26Å; I385-I426 HydrophobicContact CG2-CG2 4.13Å; T422-I426 WeakPolarHBondContact O-CG1 3.3Å; A423-I426 PolarHBondContact O-N 3.07Å; A424-I426 VanDerWaalsContact C-N 3.26Å; A424-I426 PolarHBondContact O-N 3.24Å |
| 427 | G | 64.6 | Low | 75.7 | Confident | 4 Ų | 4 | 15.8 Ų | 15.8 | 4% | 0.041 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -84.3 | -8.3 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | A424 S425 A429 | A424-G427 WeakPolarHBondContact O-CA 3.45Å; A424-G427 PolarHBondContact O-N 3.44Å; S425-G427 PolarHBondContact O-N 2.84Å; G427-A429 PolarHBondContact O-N 3.39Å |
| 428 | A | 70.8 | Confident | 75.2 | Confident | 2 Ų | 2 | 15.8 Ų | 15.8 | 2% | 0.017 | 10% | 0.098 | C | C | . | . | S | Bend | trans | -74.5 | 125.1 | 175.4 | 0 | 0 | 0 | 0 | 0 | 109 | M387 T390 A424 S425 A434 T438 | M387-A428 HydrophobicContact CE-CB 4.48Å; M387-A428 WeakPolarHBondContact CE-O 3.41Å; M387-A428 HydrophobicContact SD-CB 3.55Å; M387-A428 VanDerWaalsContact SD-CB 3.55Å; M387-A428 VanDerWaalsContact SD-O 3.42Å; T390-A428 HydrophobicContact CG2-CB 4.04Å; A424-A428 PolarHBondContact O-N 3.47Å; S425-A428 WeakPolarHBondContact O-CB 3.5Å; S425-A428 PolarHBondContact O-N 3.06Å; A428-A434 HydrophobicContact CB-CB 4.17Å; A428-T438 HydrophobicContact CB-CG2 3.86Å |
| 429 | A | 63.9 | Low | 74.9 | Confident | 10 Ų | 10 | 15.3 Ų | 15.3 | 8% | 0.083 | 9% | 0.094 | C | C | . | . | trans | -75.9 | 151.6 | 175 | 0 | 0 | 0 | 0 | 0 | 111.1 | L78 M387 G427 I431 A434 | L78-A429 HydrophobicContact CD1-CB 4.15Å; L78-A429 HydrophobicContact CD2-CB 3.38Å; L78-A429 HydrophobicContact CG-CB 3.83Å; M387-A429 VanDerWaalsContact CE-C 3.41Å; G427-A429 PolarHBondContact O-N 3.39Å; A429-I431 HydrophobicContact CB-CD1 4.16Å; A429-I431 HydrophobicContact CB-CG1 3.94Å; A429-I431 PolarHBondContact O-N 2.78Å; A429-A434 WeakPolarHBondContact O-CB 3.37Å | ||
| 430 | G | 63.7 | Low | 74.3 | Confident | 6 Ų | 6 | 13.2 Ų | 13.2 | 6% | 0.062 | 9% | 0.085 | C | C | . | . | S | Bend | trans | -69.7 | 38 | -179.8 | 0 | 0 | 0 | 0 | 0 | 115.2 | S352 S353 S354 | S352-G430 CarbonylContact C-O 3.37Å; S352-G430 WeakPolarHBondContact CA-O 3.29Å; S352-G430 WeakPolarHBondContact CB-O 3.38Å; S352-G430 PolarHBondContact OG-O 3.19Å; S353-G430 PolarHBondContact N-O 2.98Å; S353-G430 VanDerWaalsContact N-O 3.11Å; S354-G430 PolarHBondContact N-O 3.42Å; S354-G430 VanDerWaalsContact N-O 3.11Å; S354-G430 WeakPolarHBondContact OG-CA 3.34Å; S354-G430 PolarHBondContact OG-O 3.5Å |
| 431 | I | 63.7 | Low | 73.8 | Confident | 22 Ų | 22 | 13.6 Ų | 13.6 | 11% | 0.113 | 9% | 0.087 | C | C | . | . | S | Bend | trans | -114.3 | 160.8 | -176.3 | 61.1 | 174.7 | 0 | 0 | 0 | 110.6 | L78 M267 V270 A429 Q433 A434 | L78-I431 HydrophobicContact CD2-CD1 3.86Å; M267-I431 HydrophobicContact CE-CG2 3.3Å; M267-I431 HydrophobicContact SD-CG2 3.57Å; M267-I431 VanDerWaalsContact SD-CG2 3.57Å; V270-I431 HydrophobicContact CB-CD1 4.46Å; V270-I431 HydrophobicContact CG1-CB 4.34Å; V270-I431 HydrophobicContact CG1-CD1 3.62Å; V270-I431 HydrophobicContact CG1-CG2 4.33Å; V270-I431 HydrophobicContact CG2-CD1 3.98Å; A429-I431 HydrophobicContact CB-CD1 4.16Å; A429-I431 HydrophobicContact CB-CG1 3.94Å; A429-I431 PolarHBondContact O-N 2.78Å; I431-Q433 PolarHBondContact O-N 3.09Å; I431-A434 HydrophobicContact CG1-CB 3.86Å; I431-A434 PolarHBondContact O-N 3.49Å |
| 432 | P | 62.5 | Low | 73.5 | Confident | 55 Ų | 55 | 13.6 Ų | 13.6 | 36% | 0.357 | 9% | 0.087 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -57.7 | 138.1 | 177.2 | -22.9 | 35.3 | 0 | 0 | 0 | 111 | S351 A434 D464 | S351-P432 VanDerWaalsContact O-CA 3.32Å; S351-P432 WeakPolarHBondContact O-CA 3.25Å; P432-A434 PolarHBondContact O-N 3.4Å; P432-A434 VanDerWaalsContact O-N 3.16Å; P432-D464 WeakPolarHBondContact CA-OD2 3.41Å |
| 433 | Q | 67.4 | Low | 73.1 | Confident | 12 Ų | 12 | 12.7 Ų | 12.7 | 6% | 0.056 | 8% | 0.082 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 61.4 | 12.6 | 176.5 | -54.2 | -166.8 | -51.7 | 0 | 0 | 117.7 | F277 I431 G435 L436 D464 | F277-Q433 HydrophobicContact CE2-CG 4.23Å; F277-Q433 HydrophobicContact CZ-CG 3.94Å; F277-Q433 VanDerWaalsContact CZ-OE1 3.28Å; I431-Q433 PolarHBondContact O-N 3.09Å; Q433-G435 PolarHBondContact O-N 2.84Å; Q433-G435 VanDerWaalsContact O-N 3.08Å; Q433-L436 HydrophobicContact CB-CD1 4.27Å; Q433-L436 HydrophobicContact CG-CD1 4.5Å; Q433-L436 PolarHBondContact O-N 3.37Å; Q433-D464 PolarHBondContact N-OD2 3.49Å |
| 434 | A | 66 | Low | 72.6 | Confident | 11 Ų | 11 | 13.1 Ų | 13.1 | 9% | 0.091 | 8% | 0.082 | C | C | . | . | H | α-helix | trans | -54.8 | -30.4 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | A428 A429 I431 P432 L436 V437 T438 | A428-A434 HydrophobicContact CB-CB 4.17Å; A429-A434 WeakPolarHBondContact O-CB 3.37Å; I431-A434 HydrophobicContact CG1-CB 3.86Å; I431-A434 PolarHBondContact O-N 3.49Å; P432-A434 PolarHBondContact O-N 3.4Å; P432-A434 VanDerWaalsContact O-N 3.16Å; A434-L436 VanDerWaalsContact C-N 3.3Å; A434-L436 PolarHBondContact O-N 3.5Å; A434-V437 WeakPolarHBondContact O-CB 3.4Å; A434-V437 PolarHBondContact O-N 2.78Å; A434-T438 PolarHBondContact O-N 2.92Å; A434-T438 PolarHBondContact O-OG1 3.31Å |
| 435 | G | 72.8 | Confident | 72.1 | Confident | 1 Ų | 1 | 13.9 Ų | 13.9 | 1% | 0.01 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -63.4 | -25.9 | 177.8 | 0 | 0 | 0 | 0 | 0 | 115.5 | Q433 V437 T438 M439 | Q433-G435 PolarHBondContact O-N 2.84Å; Q433-G435 VanDerWaalsContact O-N 3.08Å; G435-V437 VanDerWaalsContact C-N 3.33Å; G435-T438 WeakPolarHBondContact CA-OG1 3.33Å; G435-T438 PolarHBondContact O-OG1 3.33Å; G435-M439 WeakPolarHBondContact O-CB 3.47Å; G435-M439 PolarHBondContact O-N 2.96Å |
| 436 | L | 72.4 | Confident | 71.5 | Confident | 9 Ų | 9 | 14.2 Ų | 14.2 | 5% | 0.047 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -73.1 | -31.9 | 177 | -74.4 | 172.4 | 0 | 0 | 0 | 112.1 | Y393 Q433 A434 I453 I456 I457 D460 | Y393-L436 VanDerWaalsContact OH-CD2 3.22Å; Y393-L436 WeakPolarHBondContact OH-CD2 3.39Å; Q433-L436 HydrophobicContact CB-CD1 4.27Å; Q433-L436 HydrophobicContact CG-CD1 4.5Å; Q433-L436 PolarHBondContact O-N 3.37Å; A434-L436 VanDerWaalsContact C-N 3.3Å; A434-L436 PolarHBondContact O-N 3.5Å; L436-I453 HydrophobicContact CD2-CG2 3.83Å; L436-I456 HydrophobicContact CD2-CD1 4.46Å; L436-I456 HydrophobicContact CD2-CG1 4.38Å; L436-I457 HydrophobicContact CD1-CG1 3.91Å; L436-I457 HydrophobicContact CD1-CG2 4.46Å; L436-I457 HydrophobicContact CD2-CG1 4.02Å; L436-D460 HydrophobicContact CD1-CB 4.15Å; L436-D460 VanDerWaalsContact CD1-OD2 3.26Å; L436-D460 WeakPolarHBondContact CD1-OD2 3.47Å; L436-D460 HydrophobicContact CD2-CB 4.14Å; L436-D460 HydrophobicContact CG-CB 4.35Å; L436-D460 VanDerWaalsContact CG-OD2 3.31Å; L436-D460 WeakPolarHBondContact CG-OD2 3.49Å |
| 437 | V | 65.7 | Low | 70.9 | Confident | 30 Ų | 30 | 13.8 Ų | 13.8 | 18% | 0.182 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -68.1 | -47.2 | 176.9 | 146.1 | 0 | 0 | 0 | 0 | 110.2 | L71 I75 A434 G435 V440 | L71-V437 HydrophobicContact CB-CG2 4.5Å; I75-V437 HydrophobicContact CB-CG1 3.92Å; I75-V437 HydrophobicContact CD1-CB 4.01Å; I75-V437 HydrophobicContact CD1-CG1 3.48Å; I75-V437 VanDerWaalsContact CD1-CG1 3.48Å; I75-V437 HydrophobicContact CD1-CG2 3.79Å; I75-V437 HydrophobicContact CG1-CB 4.01Å; I75-V437 HydrophobicContact CG1-CG1 3.29Å; I75-V437 HydrophobicContact CG1-CG2 3.66Å; I75-V437 HydrophobicContact CG2-CG1 3.5Å; A434-V437 WeakPolarHBondContact O-CB 3.4Å; A434-V437 PolarHBondContact O-N 2.78Å; G435-V437 VanDerWaalsContact C-N 3.33Å; V437-V440 WeakPolarHBondContact O-CB 3.29Å; V437-V440 PolarHBondContact O-N 2.9Å |
| 438 | T | 80.2 | Confident | 71.5 | Confident | 1 Ų | 1 | 14.1 Ų | 14.1 | 1% | 0.006 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -77.3 | -22.7 | -177.1 | 46.7 | 0 | 0 | 0 | 0 | 112.5 | E394 A424 A428 A434 G435 V440 I441 | E394-T438 WeakPolarHBondContact OE1-CB 3.44Å; E394-T438 PolarHBondContact OE1-OG1 3.36Å; A424-T438 WeakPolarHBondContact O-CG2 3.42Å; A428-T438 HydrophobicContact CB-CG2 3.86Å; A434-T438 PolarHBondContact O-N 2.92Å; A434-T438 PolarHBondContact O-OG1 3.31Å; G435-T438 WeakPolarHBondContact CA-OG1 3.33Å; G435-T438 PolarHBondContact O-OG1 3.33Å; T438-V440 PolarHBondContact O-N 3.36Å; T438-I441 HydrophobicContact CG2-CD1 4.17Å; T438-I441 WeakPolarHBondContact O-CB 3.38Å; T438-I441 WeakPolarHBondContact O-CG1 3.29Å; T438-I441 PolarHBondContact O-N 3.38Å |
| 439 | M | 84.5 | Confident | 71.7 | Confident | 0 Ų | 0 | 15.8 Ų | 15.8 | 0% | 0 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -54.4 | -35.4 | 168.7 | 179.8 | 62.2 | 73.6 | 0 | 0 | 113.4 | Y393 E394 A397 G435 I441 V442 L443 I453 I456 | Y393-M439 HydrophobicContact CD1-CE 3.96Å; Y393-M439 HydrophobicContact CE1-CE 3.41Å; Y393-M439 VanDerWaalsContact CE1-CE 3.41Å; E394-M439 VanDerWaalsContact CA-CE 3.48Å; E394-M439 HydrophobicContact CB-CE 4.27Å; E394-M439 HydrophobicContact CG-CE 4.12Å; A397-M439 HydrophobicContact CB-CE 3.16Å; A397-M439 HydrophobicContact CB-SD 4.24Å; G435-M439 WeakPolarHBondContact O-CB 3.47Å; G435-M439 PolarHBondContact O-N 2.96Å; M439-I441 PolarHBondContact O-N 3.47Å; M439-V442 PolarHBondContact O-N 3.18Å; M439-V442 VanDerWaalsContact O-N 3.11Å; M439-L443 HydrophobicContact CG-CD1 4.07Å; M439-L443 HydrophobicContact CG-CG 4.16Å; M439-L443 WeakPolarHBondContact O-CG 3.21Å; M439-L443 PolarHBondContact O-N 2.89Å; M439-L443 HydrophobicContact SD-CD2 4.37Å; M439-L443 HydrophobicContact SD-CG 4.1Å; M439-I453 HydrophobicContact CB-CD1 4.27Å; M439-I453 HydrophobicContact CG-CD1 3.93Å; M439-I453 HydrophobicContact CG-CG1 3.95Å; M439-I456 HydrophobicContact CE-CD1 4.26Å |
| 440 | V | 73.4 | Confident | 72.2 | Confident | 38 Ų | 38 | 17.4 Ų | 17.4 | 23% | 0.23 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -55.9 | -39.2 | 177.8 | 175.3 | 0 | 0 | 0 | 0 | 110.6 | V437 T438 L443 T444 T450 I453 | V437-V440 WeakPolarHBondContact O-CB 3.29Å; V437-V440 PolarHBondContact O-N 2.9Å; T438-V440 PolarHBondContact O-N 3.36Å; V440-L443 PolarHBondContact O-N 2.96Å; V440-T444 HydrophobicContact CG1-CG2 4.26Å; V440-T444 VanDerWaalsContact O-CG2 3.3Å; V440-T444 WeakPolarHBondContact O-CG2 3.49Å; V440-T444 PolarHBondContact O-N 3.01Å; V440-T444 PolarHBondContact O-OG1 3.49Å; V440-T444 VanDerWaalsContact O-OG1 3.07Å; V440-T450 HydrophobicContact CG1-CG2 3.98Å; V440-I453 HydrophobicContact CB-CD1 4.39Å; V440-I453 HydrophobicContact CG2-CD1 3.5Å; V440-I453 VanDerWaalsContact CG2-CD1 3.5Å |
| 441 | I | 71.4 | Confident | 72.6 | Confident | 9 Ų | 9 | 22.8 Ų | 22.8 | 5% | 0.046 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -63.2 | -44.5 | -179.9 | -44.8 | 175.3 | 0 | 0 | 0 | 110.5 | V231 L232 A424 T438 M439 T444 S445 | V231-I441 HydrophobicContact CB-CD1 3.45Å; V231-I441 VanDerWaalsContact CB-CD1 3.45Å; V231-I441 HydrophobicContact CB-CG1 3.53Å; V231-I441 HydrophobicContact CB-CG2 4.33Å; V231-I441 HydrophobicContact CG1-CD1 3.32Å; V231-I441 HydrophobicContact CG1-CG1 3.96Å; V231-I441 HydrophobicContact CG2-CD1 4.01Å; V231-I441 HydrophobicContact CG2-CG1 3.65Å; L232-I441 HydrophobicContact CB-CG2 4.32Å; A424-I441 HydrophobicContact CB-CB 4.25Å; A424-I441 HydrophobicContact CB-CD1 3.96Å; A424-I441 HydrophobicContact CB-CG2 4.45Å; T438-I441 HydrophobicContact CG2-CD1 4.17Å; T438-I441 WeakPolarHBondContact O-CB 3.38Å; T438-I441 WeakPolarHBondContact O-CG1 3.29Å; T438-I441 PolarHBondContact O-N 3.38Å; M439-I441 PolarHBondContact O-N 3.47Å; I441-T444 PolarHBondContact O-OG1 3.32Å; I441-S445 WeakPolarHBondContact O-CB 3.38Å; I441-S445 PolarHBondContact O-N 3.02Å; I441-S445 VanDerWaalsContact O-N 3.1Å |
| 442 | V | 84.9 | Confident | 73.2 | Confident | 0 Ų | 0 | 23.1 Ų | 23.1 | 0% | 0 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -70.5 | -38.5 | -177.9 | -176.4 | 0 | 0 | 0 | 0 | 110.7 | E394 A398 I417 A421 A424 M439 S445 V446 | E394-V442 HydrophobicContact CB-CG2 4.17Å; E394-V442 HydrophobicContact CG-CG2 4.42Å; A398-V442 HydrophobicContact CB-CG1 3.77Å; I417-V442 HydrophobicContact CG1-CG1 4.46Å; I417-V442 HydrophobicContact CG2-CG1 4Å; A421-V442 HydrophobicContact CB-CG1 4.46Å; A421-V442 HydrophobicContact CB-CG2 4.16Å; A424-V442 HydrophobicContact CB-CG2 3.99Å; M439-V442 PolarHBondContact O-N 3.18Å; M439-V442 VanDerWaalsContact O-N 3.11Å; V442-S445 PolarHBondContact O-OG 3.07Å; V442-V446 WeakPolarHBondContact O-CG2 3.45Å |
| 443 | L | 81.9 | Confident | 73.9 | Confident | 0 Ų | 0 | 20.9 Ų | 20.9 | 0% | 0 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -70.1 | -43.2 | 176.7 | -66.3 | -179.4 | 0 | 0 | 0 | 112.2 | A398 I401 M439 V440 S445 V446 G447 L448 T450 I453 | A398-L443 HydrophobicContact CB-CD2 4Å; I401-L443 HydrophobicContact CB-CD2 4.37Å; I401-L443 HydrophobicContact CD1-CD1 3.79Å; I401-L443 HydrophobicContact CD1-CD2 4.01Å; I401-L443 HydrophobicContact CG2-CD2 4.32Å; M439-L443 HydrophobicContact CG-CD1 4.07Å; M439-L443 HydrophobicContact CG-CG 4.16Å; M439-L443 WeakPolarHBondContact O-CG 3.21Å; M439-L443 PolarHBondContact O-N 2.89Å; M439-L443 HydrophobicContact SD-CD2 4.37Å; M439-L443 HydrophobicContact SD-CG 4.1Å; V440-L443 PolarHBondContact O-N 2.96Å; L443-S445 VanDerWaalsContact C-N 3.3Å; L443-S445 PolarHBondContact O-N 2.51Å; L443-V446 PolarHBondContact O-N 2.95Å; L443-G447 PolarHBondContact O-N 3.33Å; L443-G447 VanDerWaalsContact O-N 3.13Å; L443-L448 HydrophobicContact CB-CB 4.18Å; L443-L448 HydrophobicContact CD2-CB 3.96Å; L443-L448 HydrophobicContact CD2-CD1 3.77Å; L443-L448 PolarHBondContact O-N 3.4Å; L443-T450 HydrophobicContact CB-CG2 4.21Å; L443-I453 HydrophobicContact CD1-CD1 3.78Å; L443-I453 HydrophobicContact CD1-CG1 3.43Å; L443-I453 VanDerWaalsContact CD1-CG1 3.43Å |
| 444 | T | 69.1 | Low | 74 | Confident | 33 Ų | 33 | 21.8 Ų | 21.8 | 20% | 0.202 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -68.3 | -30.8 | -179.5 | 57.5 | 0 | 0 | 0 | 0 | 112.5 | Q168 V440 I441 V446 G447 T450 | Q168-T444 PolarHBondContact OE1-OG1 3.23Å; V440-T444 HydrophobicContact CG1-CG2 4.26Å; V440-T444 VanDerWaalsContact O-CG2 3.3Å; V440-T444 WeakPolarHBondContact O-CG2 3.49Å; V440-T444 PolarHBondContact O-N 3.01Å; V440-T444 PolarHBondContact O-OG1 3.49Å; V440-T444 VanDerWaalsContact O-OG1 3.07Å; I441-T444 PolarHBondContact O-OG1 3.32Å; T444-V446 VanDerWaalsContact C-N 3.26Å; T444-V446 PolarHBondContact O-N 3.2Å; T444-G447 PolarHBondContact O-N 3.32Å; T444-G447 VanDerWaalsContact O-N 3.08Å; T444-T450 HydrophobicContact CG2-CG2 3.74Å |
| 445 | S | 68.6 | Low | 74.3 | Confident | 18 Ų | 18 | 23.2 Ų | 23.2 | 13% | 0.126 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -63.4 | -30.1 | 179.2 | 77.1 | 0 | 0 | 0 | 0 | 113.7 | T420 I441 V442 L443 | T420-S445 PolarHBondContact OG1-OG 3.25Å; I441-S445 WeakPolarHBondContact O-CB 3.38Å; I441-S445 PolarHBondContact O-N 3.02Å; I441-S445 VanDerWaalsContact O-N 3.1Å; V442-S445 PolarHBondContact O-OG 3.07Å; L443-S445 VanDerWaalsContact C-N 3.3Å; L443-S445 PolarHBondContact O-N 2.51Å |
| 446 | V | 74.6 | Confident | 74.6 | Confident | 7 Ų | 7 | 23.1 Ų | 23.1 | 4% | 0.042 | 14% | 0.137 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -103.2 | 4.7 | 174.4 | -69.8 | 0 | 0 | 0 | 0 | 113.6 | Q413 T416 I417 V442 L443 T444 L448 | Q413-V446 HydrophobicContact CB-CG1 4.01Å; Q413-V446 HydrophobicContact CG-CG1 4.48Å; T416-V446 HydrophobicContact CG2-CG1 3.78Å; I417-V446 HydrophobicContact CD1-CG1 4.2Å; I417-V446 HydrophobicContact CD1-CG2 4.23Å; I417-V446 HydrophobicContact CG1-CB 4.45Å; I417-V446 HydrophobicContact CG1-CG1 3.64Å; I417-V446 HydrophobicContact CG1-CG2 4.03Å; V442-V446 WeakPolarHBondContact O-CG2 3.45Å; L443-V446 PolarHBondContact O-N 2.95Å; T444-V446 VanDerWaalsContact C-N 3.26Å; T444-V446 PolarHBondContact O-N 3.2Å; V446-L448 VanDerWaalsContact C-N 3.34Å; V446-L448 HydrophobicContact CG2-CB 4.35Å; V446-L448 HydrophobicContact CG2-CD1 3.61Å; V446-L448 HydrophobicContact CG2-CG 3.72Å |
| 447 | G | 67.4 | Low | 74.7 | Confident | 21 Ų | 21 | 22.9 Ų | 22.9 | 22% | 0.216 | 14% | 0.136 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 76 | 17.5 | 175.9 | 0 | 0 | 0 | 0 | 0 | 115 | R170 L443 T444 | R170-G447 PolarHBondContact NH2-O 3.47Å; L443-G447 PolarHBondContact O-N 3.33Å; L443-G447 VanDerWaalsContact O-N 3.13Å; T444-G447 PolarHBondContact O-N 3.32Å; T444-G447 VanDerWaalsContact O-N 3.08Å |
| 448 | L | 77.6 | Confident | 74.9 | Confident | 11 Ų | 11 | 22.6 Ų | 22.6 | 6% | 0.058 | 14% | 0.136 | C | C | . | . | trans | -74.7 | 147.7 | 176.1 | -68.7 | 173.1 | 0 | 0 | 0 | 111.4 | A402 Y407 L443 V446 | A402-L448 HydrophobicContact CB-CD1 4.06Å; A402-L448 HydrophobicContact CB-CD2 4.12Å; Y407-L448 HydrophobicContact CD2-CD2 3.31Å; Y407-L448 HydrophobicContact CE2-CD2 3.91Å; Y407-L448 HydrophobicContact CG-CD2 3.87Å; L443-L448 HydrophobicContact CB-CB 4.18Å; L443-L448 HydrophobicContact CD2-CB 3.96Å; L443-L448 HydrophobicContact CD2-CD1 3.77Å; L443-L448 PolarHBondContact O-N 3.4Å; V446-L448 VanDerWaalsContact C-N 3.34Å; V446-L448 HydrophobicContact CG2-CB 4.35Å; V446-L448 HydrophobicContact CG2-CD1 3.61Å; V446-L448 HydrophobicContact CG2-CG 3.72Å | ||
| 449 | P | 74.7 | Confident | 74.8 | Confident | 37 Ų | 37 | 24.3 Ų | 24.3 | 24% | 0.24 | 15% | 0.147 | C | C | . | . | trans | -65.3 | 135.2 | 175.6 | 27.2 | -35 | 0 | 0 | 0 | 111.7 | Y407 D452 | Y407-P449 HydrophobicContact CE2-CG 4.05Å; P449-D452 VanDerWaalsContact CG-OD2 3.23Å; P449-D452 WeakPolarHBondContact CG-OD2 3.49Å | ||
| 450 | T | 74.5 | Confident | 74.7 | Confident | 44 Ų | 44 | 24.3 Ų | 24.3 | 27% | 0.27 | 15% | 0.147 | S | C | . | . | S | Bend | trans | -87.8 | -14.9 | -177.6 | 53.3 | 0 | 0 | 0 | 0 | 113.2 | V440 L443 T444 D452 I453 | V440-T450 HydrophobicContact CG1-CG2 3.98Å; L443-T450 HydrophobicContact CB-CG2 4.21Å; T444-T450 HydrophobicContact CG2-CG2 3.74Å; T450-D452 PolarHBondContact O-N 3.16Å; T450-I453 WeakPolarHBondContact O-CB 3.42Å; T450-I453 VanDerWaalsContact O-CG1 3.28Å; T450-I453 WeakPolarHBondContact O-CG1 3.26Å; T450-I453 PolarHBondContact O-N 3.47Å |
| 451 | D | 70.4 | Confident | 74.7 | Confident | 119 Ų | 119 | 24.8 Ų | 24.8 | 64% | 0.636 | 15% | 0.145 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -64.6 | -24.5 | 178 | -64.1 | -39.7 | 0 | 0 | 0 | 112.6 | I453 N454 | D451-I453 PolarHBondContact O-N 2.69Å; D451-N454 WeakPolarHBondContact O-CB 3.38Å; D451-N454 PolarHBondContact O-N 3.08Å; D451-N454 PolarHBondContact O-ND2 3.13Å |
| 452 | D | 76.5 | Confident | 75.1 | Confident | 30 Ų | 30 | 25.6 Ų | 25.6 | 16% | 0.16 | 15% | 0.152 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -73.5 | -12.1 | 178.3 | -66.6 | -32.9 | 0 | 0 | 0 | 113.6 | I401 N405 P449 T450 N454 L455 | I401-D452 HydrophobicContact CD1-CB 4.34Å; I401-D452 HydrophobicContact CG1-CB 4.27Å; I401-D452 HydrophobicContact CG2-CB 3.75Å; N405-D452 PolarHBondContact ND2-OD2 2.97Å; N405-D452 PolarHBondContact OD1-OD2 3.48Å; P449-D452 VanDerWaalsContact CG-OD2 3.23Å; P449-D452 WeakPolarHBondContact CG-OD2 3.49Å; T450-D452 PolarHBondContact O-N 3.16Å; D452-N454 PolarHBondContact O-N 3Å; D452-L455 HydrophobicContact CB-CD1 4.23Å; D452-L455 WeakPolarHBondContact O-CB 3.45Å; D452-L455 PolarHBondContact O-N 3.36Å; D452-L455 VanDerWaalsContact O-N 3.07Å |
| 453 | I | 77.1 | Confident | 75.3 | Confident | 7 Ų | 7 | 25.8 Ų | 25.8 | 4% | 0.036 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -55.7 | -33.5 | 168.9 | -65.3 | 174.5 | 0 | 0 | 0 | 109.7 | L436 M439 V440 L443 T450 D451 L455 I456 I457 | L436-I453 HydrophobicContact CD2-CG2 3.83Å; M439-I453 HydrophobicContact CB-CD1 4.27Å; M439-I453 HydrophobicContact CG-CD1 3.93Å; M439-I453 HydrophobicContact CG-CG1 3.95Å; V440-I453 HydrophobicContact CB-CD1 4.39Å; V440-I453 HydrophobicContact CG2-CD1 3.5Å; V440-I453 VanDerWaalsContact CG2-CD1 3.5Å; L443-I453 HydrophobicContact CD1-CD1 3.78Å; L443-I453 HydrophobicContact CD1-CG1 3.43Å; L443-I453 VanDerWaalsContact CD1-CG1 3.43Å; T450-I453 WeakPolarHBondContact O-CB 3.42Å; T450-I453 VanDerWaalsContact O-CG1 3.28Å; T450-I453 WeakPolarHBondContact O-CG1 3.26Å; T450-I453 PolarHBondContact O-N 3.47Å; D451-I453 PolarHBondContact O-N 2.69Å; I453-L455 PolarHBondContact O-N 3.31Å; I453-L455 VanDerWaalsContact O-N 3.1Å; I453-I456 HydrophobicContact CG2-CG1 4.39Å; I453-I456 WeakPolarHBondContact O-CG1 3.23Å; I453-I456 PolarHBondContact O-N 3.42Å; I453-I457 HydrophobicContact CG2-CD1 4.35Å; I453-I457 HydrophobicContact CG2-CG1 4.22Å; I453-I457 WeakPolarHBondContact O-CG1 3.31Å; I453-I457 PolarHBondContact O-N 3.48Å |
| 454 | N | 69.4 | Low | 75.6 | Confident | 32 Ų | 32 | 26.1 Ų | 26.1 | 17% | 0.171 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -60.9 | -25.5 | -178.9 | -62.6 | -45.9 | 0 | 0 | 0 | 113.6 | K288 D451 D452 I456 | K288-N454 HydrophobicContact CD-CB 3.6Å; K288-N454 VanDerWaalsContact CE-CB 3.41Å; K288-N454 HydrophobicContact CG-CB 4.17Å; D451-N454 WeakPolarHBondContact O-CB 3.38Å; D451-N454 PolarHBondContact O-N 3.08Å; D451-N454 PolarHBondContact O-ND2 3.13Å; D452-N454 PolarHBondContact O-N 3Å; N454-I456 VanDerWaalsContact C-N 3.33Å |
| 455 | L | 72.8 | Confident | 76.3 | Confident | 40 Ų | 40 | 26.1 Ų | 26.1 | 21% | 0.209 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -66.3 | -36.4 | 176.7 | -62.6 | 171 | 0 | 0 | 0 | 111.8 | M292 L302 D452 I453 | M292-L455 HydrophobicContact CE-CD2 4.45Å; L302-L455 WeakPolarHBondContact CD1-O 3.47Å; D452-L455 HydrophobicContact CB-CD1 4.23Å; D452-L455 WeakPolarHBondContact O-CB 3.45Å; D452-L455 PolarHBondContact O-N 3.36Å; D452-L455 VanDerWaalsContact O-N 3.07Å; I453-L455 PolarHBondContact O-N 3.31Å; I453-L455 VanDerWaalsContact O-N 3.1Å |
| 456 | I | 80.5 | Confident | 77.5 | Confident | 0 Ų | 0 | 29 Ų | 29 | 0% | 0 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -87.9 | -21.6 | -175.7 | 58.8 | 175.5 | 0 | 0 | 0 | 113 | L302 Y305 Y393 A397 F400 I401 L436 M439 I453 N454 A458 V459 D460 | L302-I456 HydrophobicContact CD1-CG2 4.19Å; Y305-I456 HydrophobicContact CD1-CG2 4.24Å; Y305-I456 HydrophobicContact CE1-CB 4.06Å; Y305-I456 HydrophobicContact CE1-CG2 3.79Å; Y393-I456 WeakPolarHBondContact OH-CD1 3.48Å; A397-I456 HydrophobicContact CB-CD1 3.68Å; F400-I456 HydrophobicContact CD1-CG2 4.01Å; F400-I456 HydrophobicContact CE1-CG2 3.84Å; I401-I456 HydrophobicContact CD1-CD1 4.31Å; L436-I456 HydrophobicContact CD2-CD1 4.46Å; L436-I456 HydrophobicContact CD2-CG1 4.38Å; M439-I456 HydrophobicContact CE-CD1 4.26Å; I453-I456 HydrophobicContact CG2-CG1 4.39Å; I453-I456 WeakPolarHBondContact O-CG1 3.23Å; I453-I456 PolarHBondContact O-N 3.42Å; N454-I456 VanDerWaalsContact C-N 3.33Å; I456-A458 PolarHBondContact O-N 2.93Å; I456-A458 VanDerWaalsContact O-N 3.13Å; I456-V459 PolarHBondContact O-N 3.13Å; I456-D460 WeakPolarHBondContact O-CB 3.37Å; I456-D460 PolarHBondContact O-N 3.38Å |
| 457 | I | 74.4 | Confident | 78.4 | Confident | 4 Ų | 4 | 28.7 Ų | 28.7 | 2% | 0.021 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -53.8 | -37.1 | 179.7 | -65.8 | 176.3 | 0 | 0 | 0 | 112.1 | M68 L284 L436 I453 V459 D460 | M68-I457 HydrophobicContact CE-CD1 3.48Å; M68-I457 VanDerWaalsContact CE-CD1 3.48Å; M68-I457 HydrophobicContact SD-CD1 3.53Å; M68-I457 VanDerWaalsContact SD-CD1 3.53Å; L284-I457 HydrophobicContact CD1-CD1 3.97Å; L284-I457 HydrophobicContact CD1-CG2 4.06Å; L284-I457 HydrophobicContact CD2-CB 3.81Å; L284-I457 HydrophobicContact CD2-CD1 4.11Å; L284-I457 HydrophobicContact CD2-CG2 3.52Å; L284-I457 HydrophobicContact CG-CG2 4.43Å; L436-I457 HydrophobicContact CD1-CG1 3.91Å; L436-I457 HydrophobicContact CD1-CG2 4.46Å; L436-I457 HydrophobicContact CD2-CG1 4.02Å; I453-I457 HydrophobicContact CG2-CD1 4.35Å; I453-I457 HydrophobicContact CG2-CG1 4.22Å; I453-I457 WeakPolarHBondContact O-CG1 3.31Å; I453-I457 PolarHBondContact O-N 3.48Å; I457-V459 PolarHBondContact O-N 3.32Å; I457-D460 PolarHBondContact O-N 2.89Å |
| 458 | A | 69.8 | Low | 79.5 | Confident | 23 Ų | 23 | 27.9 Ų | 27.9 | 19% | 0.19 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -61.2 | -26.2 | -177.7 | 0 | 0 | 0 | 0 | 0 | 113.9 | I285 L302 I456 W461 | I285-A458 HydrophobicContact CD1-CB 4.12Å; I285-A458 HydrophobicContact CG1-CB 3.89Å; I285-A458 HydrophobicContact CG2-CB 4.47Å; L302-A458 HydrophobicContact CD2-CB 4.45Å; I456-A458 PolarHBondContact O-N 2.93Å; I456-A458 VanDerWaalsContact O-N 3.13Å; A458-W461 PolarHBondContact O-NE1 2.95Å; A458-W461 VanDerWaalsContact O-NE1 3.15Å |
| 459 | V | 77.1 | Confident | 80.3 | Confident | 37 Ų | 37 | 29.5 Ų | 29.5 | 22% | 0.224 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -111.4 | -17.8 | 178.8 | 179.3 | 0 | 0 | 0 | 0 | 112 | L302 A306 I456 I457 W461 A462 L463 | L302-V459 HydrophobicContact CD1-CB 4.48Å; L302-V459 HydrophobicContact CD1-CG2 4.34Å; L302-V459 HydrophobicContact CD2-CB 4.37Å; L302-V459 HydrophobicContact CD2-CG2 3.46Å; L302-V459 VanDerWaalsContact CD2-CG2 3.46Å; L302-V459 HydrophobicContact CG-CB 4.29Å; L302-V459 HydrophobicContact CG-CG2 3.66Å; A306-V459 HydrophobicContact CB-CG1 3.67Å; I456-V459 PolarHBondContact O-N 3.13Å; I457-V459 PolarHBondContact O-N 3.32Å; V459-W461 VanDerWaalsContact C-N 3.27Å; V459-W461 PolarHBondContact O-N 2.95Å; V459-A462 PolarHBondContact O-N 3.2Å; V459-L463 HydrophobicContact CG1-CD1 4.05Å; V459-L463 HydrophobicContact CG1-CG 4.03Å; V459-L463 PolarHBondContact O-N 3.44Å |
| 460 | D | 82 | Confident | 81.4 | Confident | 0 Ų | 0 | 28 Ų | 28 | 0% | 0 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -55.8 | -38.2 | 179.6 | -172.2 | 67.6 | 0 | 0 | 0 | 112.9 | Y393 L436 I456 I457 A462 L463 D464 R467 | Y393-D460 WeakPolarHBondContact CE2-OD1 3.39Å; Y393-D460 PolarHBondContact OH-OD1 3.32Å; Y393-D460 VanDerWaalsContact OH-OD1 3.09Å; L436-D460 HydrophobicContact CD1-CB 4.15Å; L436-D460 VanDerWaalsContact CD1-OD2 3.26Å; L436-D460 WeakPolarHBondContact CD1-OD2 3.47Å; L436-D460 HydrophobicContact CD2-CB 4.14Å; L436-D460 HydrophobicContact CG-CB 4.35Å; L436-D460 VanDerWaalsContact CG-OD2 3.31Å; L436-D460 WeakPolarHBondContact CG-OD2 3.49Å; I456-D460 WeakPolarHBondContact O-CB 3.37Å; I456-D460 PolarHBondContact O-N 3.38Å; I457-D460 PolarHBondContact O-N 2.89Å; D460-A462 PolarHBondContact O-N 3.17Å; D460-L463 PolarHBondContact O-N 3.28Å; D460-L463 VanDerWaalsContact O-N 3.1Å; D460-D464 VanDerWaalsContact O-CB 3.25Å; D460-D464 WeakPolarHBondContact O-CB 3.38Å; D460-D464 PolarHBondContact O-N 3.43Å; D460-R467 IonicContact OD1-CZ 3.98Å; D460-R467 IonicContact OD1-NH1 2.8Å; D460-R467 PolarHBondContact OD1-NH1 3.44Å; D460-R467 IonicContact OD1-NH2 2.75Å; D460-R467 PolarHBondContact OD1-NH2 3.5Å; D460-R467 IonicContact OD2-NH2 3.89Å; D460-R467 PolarHBondContact OD2-NH2 3.05Å |
| 461 | W | 74.3 | Confident | 82.4 | Confident | 49 Ų | 49 | 26.1 Ų | 26.1 | 19% | 0.186 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -55.7 | -30.3 | 178.5 | 76.2 | -87.6 | 0 | 0 | 0 | 113.7 | V34 V37 I281 A458 V459 | V34-W461 HydrophobicContact CB-CH2 4.46Å; V34-W461 HydrophobicContact CG1-CH2 4.42Å; V34-W461 HydrophobicContact CG2-CE3 4.49Å; V34-W461 HydrophobicContact CG2-CH2 3.81Å; V34-W461 HydrophobicContact CG2-CZ3 3.54Å; V37-W461 HydrophobicContact CB-CZ2 4.36Å; V37-W461 HydrophobicContact CG1-CZ2 4.17Å; V37-W461 HydrophobicContact CG2-CD2 3.88Å; V37-W461 HydrophobicContact CG2-CG 3.83Å; V37-W461 HydrophobicContact CG2-CZ2 4.25Å; I281-W461 HydrophobicContact CD1-CB 4.42Å; A458-W461 PolarHBondContact O-NE1 2.95Å; A458-W461 VanDerWaalsContact O-NE1 3.15Å; V459-W461 VanDerWaalsContact C-N 3.27Å; V459-W461 PolarHBondContact O-N 2.95Å |
| 462 | A | 79.8 | Confident | 83.5 | Confident | 25 Ų | 25 | 20.6 Ų | 20.6 | 21% | 0.207 | 11% | 0.107 | C | C | . | . | H | α-helix | trans | -86.3 | -42.5 | 177.9 | 0 | 0 | 0 | 0 | 0 | 110.8 | V459 D460 D464 R465 F466 | V459-A462 PolarHBondContact O-N 3.2Å; D460-A462 PolarHBondContact O-N 3.17Å; A462-D464 VanDerWaalsContact C-N 3.29Å; A462-D464 PolarHBondContact O-N 2.86Å; A462-R465 WeakPolarHBondContact O-CB 3.14Å; A462-R465 PolarHBondContact O-N 3.44Å; A462-F466 WeakPolarHBondContact O-CD2 3.1Å |
| 463 | L | 89.4 | Confident | 84.5 | Confident | 4 Ų | 4 | 19.3 Ų | 19.3 | 2% | 0.021 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -63.7 | -36.8 | 178.3 | -63.1 | 177.4 | 0 | 0 | 0 | 111.8 | Y305 A306 V309 V310 Y393 V459 D460 R465 F466 R467 | Y305-L463 HydrophobicContact CD1-CD1 4.4Å; Y305-L463 HydrophobicContact CE1-CD1 3.69Å; A306-L463 HydrophobicContact CB-CD2 4.23Å; V309-L463 HydrophobicContact CB-CD1 4.23Å; V309-L463 HydrophobicContact CB-CD2 4.22Å; V309-L463 HydrophobicContact CG1-CD1 4.27Å; V309-L463 HydrophobicContact CG1-CD2 4.16Å; V309-L463 HydrophobicContact CG2-CD1 4.28Å; V310-L463 HydrophobicContact CG2-CD2 3.64Å; Y393-L463 HydrophobicContact CE2-CD1 4.5Å; V459-L463 HydrophobicContact CG1-CD1 4.05Å; V459-L463 HydrophobicContact CG1-CG 4.03Å; V459-L463 PolarHBondContact O-N 3.44Å; D460-L463 PolarHBondContact O-N 3.28Å; D460-L463 VanDerWaalsContact O-N 3.1Å; L463-R465 PolarHBondContact O-N 3.03Å; L463-F466 PolarHBondContact O-N 3.36Å; L463-R467 WeakPolarHBondContact O-CG 3.49Å; L463-R467 PolarHBondContact O-N 3.07Å |
| 464 | D | 86.7 | Confident | 85.4 | Confident | 7 Ų | 7 | 19 Ų | 19 | 4% | 0.037 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -53.5 | -40.7 | 179.8 | -166.5 | 40.2 | 0 | 0 | 0 | 112.3 | S351 P432 Q433 D460 A462 F466 R467 T468 | S351-D464 WeakPolarHBondContact CB-OD2 3.47Å; P432-D464 WeakPolarHBondContact CA-OD2 3.41Å; Q433-D464 PolarHBondContact N-OD2 3.49Å; D460-D464 VanDerWaalsContact O-CB 3.25Å; D460-D464 WeakPolarHBondContact O-CB 3.38Å; D460-D464 PolarHBondContact O-N 3.43Å; A462-D464 VanDerWaalsContact C-N 3.29Å; A462-D464 PolarHBondContact O-N 2.86Å; D464-F466 VanDerWaalsContact C-N 3.32Å; D464-F466 PolarHBondContact O-N 2.78Å; D464-R467 VanDerWaalsContact CB-NH2 3.31Å; D464-R467 WeakPolarHBondContact O-CB 3.39Å; D464-R467 PolarHBondContact O-N 3.49Å; D464-R467 VanDerWaalsContact O-N 3.13Å; D464-R467 IonicContact OD1-CZ 3.95Å; D464-R467 IonicContact OD1-NE 3.46Å; D464-R467 PolarHBondContact OD1-NE 2.79Å; D464-R467 IonicContact OD1-NH2 3.09Å; D464-R467 PolarHBondContact OD1-NH2 3.15Å; D464-T468 PolarHBondContact O-N 3.34Å; D464-T468 PolarHBondContact O-OG1 2.84Å |
| 465 | R | 85.2 | Confident | 86.7 | Confident | 33 Ų | 33 | 17.7 Ų | 17.7 | 13% | 0.125 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -57.6 | -46.1 | 177.4 | -62.6 | 172.6 | -179.7 | -70.8 | -11.6 | 112 | L30 L348 A349 S351 A462 L463 M469 | L30-R465 VanDerWaalsContact CD1-NH1 3.25Å; L348-R465 HydrophobicContact CD1-CB 3.83Å; L348-R465 HydrophobicContact CG-CB 4.41Å; L348-R465 WeakPolarHBondContact O-CB 3.34Å; L348-R465 VanDerWaalsContact O-CG 3.3Å; L348-R465 WeakPolarHBondContact O-CG 3.46Å; L348-R465 PolarHBondContact O-NH1 3.2Å; A349-R465 PolarHBondContact O-NH1 3.45Å; S351-R465 WeakPolarHBondContact OG-CG 3.34Å; A462-R465 WeakPolarHBondContact O-CB 3.14Å; A462-R465 PolarHBondContact O-N 3.44Å; L463-R465 PolarHBondContact O-N 3.03Å; R465-M469 WeakPolarHBondContact O-CB 3.47Å; R465-M469 PolarHBondContact O-N 3.39Å |
| 466 | F | 93.2 | Very high | 87.8 | Confident | 79 Ų | 79 | 15.8 Ų | 15.8 | 35% | 0.346 | 8% | 0.082 | S | C | . | . | H | α-helix | trans | -69.5 | -39.9 | 178.4 | -63 | -75.1 | 0 | 0 | 0 | 110.6 | V310 L313 L348 A462 L463 D464 M469 I470 | V310-F466 HydrophobicContact CG2-CD2 4.33Å; L313-F466 HydrophobicContact CD1-CB 3.67Å; L348-F466 HydrophobicContact CD1-CD1 3.87Å; L348-F466 HydrophobicContact CD1-CE1 3.98Å; L348-F466 HydrophobicContact CD1-CG 4.38Å; A462-F466 WeakPolarHBondContact O-CD2 3.1Å; L463-F466 PolarHBondContact O-N 3.36Å; D464-F466 VanDerWaalsContact C-N 3.32Å; D464-F466 PolarHBondContact O-N 2.78Å; F466-M469 HydrophobicContact CD1-CE 4.24Å; F466-M469 PolarHBondContact O-N 3.12Å; F466-I470 WeakPolarHBondContact O-CG1 3.49Å; F466-I470 PolarHBondContact O-N 3.39Å |
| 467 | R | 94.3 | Very high | 88.6 | Confident | 0 Ų | 0 | 15.8 Ų | 15.8 | 0% | 0 | 8% | 0.082 | C | C | . | . | H | α-helix | trans | -57.3 | -51.9 | 174.3 | -62.1 | -172.8 | -57.1 | -144.6 | -10.5 | 111.1 | L313 G389 Y393 D460 L463 D464 M469 I470 N471 | L313-R467 HydrophobicContact CD1-CG 4.06Å; G389-R467 WeakPolarHBondContact O-CD 3.3Å; G389-R467 WeakPolarHBondContact O-CG 3.44Å; Y393-R467 VanDerWaalsContact CB-CD 3.47Å; Y393-R467 VanDerWaalsContact CD2-NH1 3.26Å; D460-R467 IonicContact OD1-CZ 3.98Å; D460-R467 IonicContact OD1-NH1 2.8Å; D460-R467 PolarHBondContact OD1-NH1 3.44Å; D460-R467 IonicContact OD1-NH2 2.75Å; D460-R467 PolarHBondContact OD1-NH2 3.5Å; D460-R467 IonicContact OD2-NH2 3.89Å; D460-R467 PolarHBondContact OD2-NH2 3.05Å; L463-R467 WeakPolarHBondContact O-CG 3.49Å; L463-R467 PolarHBondContact O-N 3.07Å; D464-R467 VanDerWaalsContact CB-NH2 3.31Å; D464-R467 WeakPolarHBondContact O-CB 3.39Å; D464-R467 PolarHBondContact O-N 3.49Å; D464-R467 VanDerWaalsContact O-N 3.13Å; D464-R467 IonicContact OD1-CZ 3.95Å; D464-R467 IonicContact OD1-NE 3.46Å; D464-R467 PolarHBondContact OD1-NE 2.79Å; D464-R467 IonicContact OD1-NH2 3.09Å; D464-R467 PolarHBondContact OD1-NH2 3.15Å; R467-M469 VanDerWaalsContact C-N 3.32Å; R467-M469 PolarHBondContact O-N 3.04Å; R467-I470 PolarHBondContact O-N 3.1Å; R467-I470 VanDerWaalsContact O-N 3.15Å; R467-N471 VanDerWaalsContact O-CG 3.25Å; R467-N471 PolarHBondContact O-N 2.62Å; R467-N471 PolarHBondContact O-OD1 2.68Å |
| 468 | T | 90.9 | Very high | 89.6 | Confident | 5 Ų | 5 | 15.6 Ų | 15.6 | 3% | 0.031 | 8% | 0.081 | C | C | . | . | H | α-helix | trans | -57.4 | -46.3 | 178.4 | -50.2 | 0 | 0 | 0 | 0 | 111.3 | A347 S351 S352 S353 D464 I470 N471 V472 | A347-T468 HydrophobicContact CB-CG2 4.07Å; S351-T468 WeakPolarHBondContact CA-OG1 3.25Å; S351-T468 PolarHBondContact O-OG1 3.25Å; S352-T468 VanDerWaalsContact C-CG2 3.42Å; S352-T468 VanDerWaalsContact N-CG2 3.3Å; S353-T468 VanDerWaalsContact N-CG2 3.3Å; D464-T468 PolarHBondContact O-N 3.34Å; D464-T468 PolarHBondContact O-OG1 2.84Å; T468-I470 VanDerWaalsContact C-N 3.29Å; T468-I470 PolarHBondContact O-N 2.69Å; T468-N471 PolarHBondContact O-N 2.82Å; T468-V472 HydrophobicContact CG2-CG2 4.44Å; T468-V472 WeakPolarHBondContact O-CG2 3.21Å; T468-V472 PolarHBondContact O-N 3.03Å |
| 469 | M | 93.8 | Very high | 90.8 | Very high | 44 Ų | 44 | 14.5 Ų | 14.5 | 22% | 0.217 | 7% | 0.072 | C | C | . | . | H | α-helix | trans | -59.1 | -41.2 | 178.7 | -174.4 | -177.8 | 68.1 | 0 | 0 | 111.8 | L344 L348 R465 F466 R467 L473 | L344-M469 HydrophobicContact CB-CG 4.01Å; L344-M469 HydrophobicContact CB-SD 4.5Å; L344-M469 HydrophobicContact CD2-CG 4.24Å; L348-M469 HydrophobicContact CB-SD 4.36Å; L348-M469 HydrophobicContact CD1-CB 4.47Å; L348-M469 HydrophobicContact CD1-SD 4.12Å; R465-M469 WeakPolarHBondContact O-CB 3.47Å; R465-M469 PolarHBondContact O-N 3.39Å; F466-M469 HydrophobicContact CD1-CE 4.24Å; F466-M469 PolarHBondContact O-N 3.12Å; R467-M469 VanDerWaalsContact C-N 3.32Å; R467-M469 PolarHBondContact O-N 3.04Å; M469-L473 WeakPolarHBondContact O-CB 3.4Å; M469-L473 PolarHBondContact O-N 3.23Å |
| 470 | I | 96.7 | Very high | 91.6 | Very high | 5 Ų | 5 | 12.9 Ų | 12.9 | 3% | 0.026 | 6% | 0.063 | C | C | . | . | H | α-helix | trans | -69.2 | -40 | 176.6 | -63.9 | -41.9 | 0 | 0 | 0 | 111.9 | L313 L321 D388 F466 R467 T468 V472 L473 G474 | L313-I470 HydrophobicContact CB-CG1 4.08Å; L313-I470 HydrophobicContact CD2-CB 4.4Å; L313-I470 HydrophobicContact CD2-CG1 4.15Å; L321-I470 HydrophobicContact CD1-CG2 4.41Å; D388-I470 HydrophobicContact CB-CG2 4.45Å; F466-I470 WeakPolarHBondContact O-CG1 3.49Å; F466-I470 PolarHBondContact O-N 3.39Å; R467-I470 PolarHBondContact O-N 3.1Å; R467-I470 VanDerWaalsContact O-N 3.15Å; T468-I470 VanDerWaalsContact C-N 3.29Å; T468-I470 PolarHBondContact O-N 2.69Å; I470-V472 PolarHBondContact O-N 2.86Å; I470-L473 HydrophobicContact CD1-CD2 4.37Å; I470-L473 WeakPolarHBondContact O-CB 3.43Å; I470-L473 PolarHBondContact O-N 3.47Å; I470-G474 PolarHBondContact O-N 2.93Å |
| 471 | N | 95.6 | Very high | 92.3 | Very high | 5 Ų | 5 | 12.9 Ų | 12.9 | 3% | 0.027 | 6% | 0.063 | C | C | . | . | H | α-helix | trans | -59.1 | -49.4 | 175.7 | -64.1 | -7.8 | 0 | 0 | 0 | 110.7 | D388 G389 T390 R467 T468 L473 G474 D475 | D388-N471 PolarHBondContact N-OD1 2.98Å; G389-N471 WeakPolarHBondContact CA-OD1 3.28Å; G389-N471 PolarHBondContact N-OD1 3.2Å; T390-N471 PolarHBondContact OG1-ND2 2.95Å; R467-N471 VanDerWaalsContact O-CG 3.25Å; R467-N471 PolarHBondContact O-N 2.62Å; R467-N471 PolarHBondContact O-OD1 2.68Å; T468-N471 PolarHBondContact O-N 2.82Å; N471-L473 VanDerWaalsContact C-N 3.32Å; N471-L473 PolarHBondContact O-N 2.94Å; N471-G474 PolarHBondContact O-N 2.92Å; N471-G474 VanDerWaalsContact O-N 3.14Å; N471-D475 PolarHBondContact O-N 2.7Å |
| 472 | V | 94.9 | Very high | 93.2 | Very high | 3 Ų | 3 | 10.6 Ų | 10.6 | 2% | 0.018 | 5% | 0.054 | C | C | . | . | H | α-helix | trans | -63.4 | -37.2 | 178.1 | 175.6 | 0 | 0 | 0 | 0 | 112 | L344 A347 T356 T360 T468 I470 D475 A476 | L344-V472 HydrophobicContact CD2-CB 4.37Å; L344-V472 HydrophobicContact CD2-CG1 4.13Å; A347-V472 HydrophobicContact CB-CB 4.22Å; A347-V472 HydrophobicContact CB-CG2 3.83Å; T356-V472 VanDerWaalsContact OG1-CG2 3.32Å; T356-V472 WeakPolarHBondContact OG1-CG2 3.44Å; T360-V472 HydrophobicContact CG2-CG1 4.2Å; T360-V472 WeakPolarHBondContact OG1-CG1 3.45Å; T468-V472 HydrophobicContact CG2-CG2 4.44Å; T468-V472 WeakPolarHBondContact O-CG2 3.21Å; T468-V472 PolarHBondContact O-N 3.03Å; I470-V472 PolarHBondContact O-N 2.86Å; V472-D475 PolarHBondContact O-N 2.83Å; V472-A476 WeakPolarHBondContact O-CB 3.39Å; V472-A476 PolarHBondContact O-N 3.36Å |
| 473 | L | 97.2 | Very high | 93.8 | Very high | 4 Ų | 4 | 10.4 Ų | 10.4 | 2% | 0.021 | 5% | 0.053 | C | C | . | . | H | α-helix | trans | -63.7 | -43.4 | 173.9 | 177.2 | 59.1 | 0 | 0 | 0 | 111.7 | G317 I337 L344 M469 I470 N471 A476 L477 | G317-L473 VanDerWaalsContact O-CD2 3.3Å; G317-L473 WeakPolarHBondContact O-CD2 3.23Å; I337-L473 HydrophobicContact CD1-CD1 4.2Å; I337-L473 HydrophobicContact CG1-CD1 3.86Å; I337-L473 HydrophobicContact CG2-CD1 4.46Å; L344-L473 HydrophobicContact CD1-CD1 4.16Å; L344-L473 HydrophobicContact CD2-CB 3.75Å; L344-L473 HydrophobicContact CD2-CD1 4.47Å; M469-L473 WeakPolarHBondContact O-CB 3.4Å; M469-L473 PolarHBondContact O-N 3.23Å; I470-L473 HydrophobicContact CD1-CD2 4.37Å; I470-L473 WeakPolarHBondContact O-CB 3.43Å; I470-L473 PolarHBondContact O-N 3.47Å; N471-L473 VanDerWaalsContact C-N 3.32Å; N471-L473 PolarHBondContact O-N 2.94Å; L473-A476 PolarHBondContact O-N 3.17Å; L473-L477 HydrophobicContact CD1-CD1 3.85Å; L473-L477 HydrophobicContact CD1-CG 4.02Å; L473-L477 HydrophobicContact CG-CD1 3.96Å; L473-L477 WeakPolarHBondContact O-CB 3.27Å; L473-L477 WeakPolarHBondContact O-CG 3.04Å; L473-L477 PolarHBondContact O-N 3.38Å |
| 474 | G | 96.5 | Very high | 93.9 | Very high | 0 Ų | 0 | 13.8 Ų | 13.8 | 0% | 0 | 7% | 0.068 | C | C | . | . | H | α-helix | trans | -57.1 | -48.1 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | I470 N471 A476 L477 A478 | I470-G474 PolarHBondContact O-N 2.93Å; N471-G474 PolarHBondContact O-N 2.92Å; N471-G474 VanDerWaalsContact O-N 3.14Å; G474-A476 PolarHBondContact O-N 2.92Å; G474-L477 PolarHBondContact O-N 2.91Å; G474-A478 VanDerWaalsContact O-CB 3.3Å; G474-A478 WeakPolarHBondContact O-CB 3.38Å; G474-A478 PolarHBondContact O-N 3.32Å |
| 475 | D | 95.2 | Very high | 94.1 | Very high | 5 Ų | 5 | 16.1 Ų | 16.1 | 3% | 0.027 | 8% | 0.08 | C | C | . | . | H | α-helix | trans | -62.3 | -44.1 | 178.6 | -65.3 | -15.5 | 0 | 0 | 0 | 112.3 | L379 G382 A383 N386 N471 V472 A478 A479 | L379-D475 HydrophobicContact CD2-CB 3.83Å; G382-D475 VanDerWaalsContact C-OD2 3.27Å; G382-D475 VanDerWaalsContact CA-OD1 3.27Å; G382-D475 WeakPolarHBondContact CA-OD1 3.36Å; A383-D475 PolarHBondContact N-OD2 3.36Å; N386-D475 VanDerWaalsContact CB-OD1 3.26Å; N386-D475 WeakPolarHBondContact CB-OD1 3.3Å; N386-D475 PolarHBondContact ND2-N 3.42Å; N386-D475 PolarHBondContact ND2-OD1 2.82Å; N471-D475 PolarHBondContact O-N 2.7Å; V472-D475 PolarHBondContact O-N 2.83Å; D475-A478 PolarHBondContact O-N 3.37Å; D475-A479 PolarHBondContact O-N 2.79Å |
| 476 | A | 96.4 | Very high | 94.1 | Very high | 0 Ų | 0 | 14.6 Ų | 14.6 | 0% | 0 | 7% | 0.074 | C | C | . | . | H | α-helix | trans | -63.4 | -45.3 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | F336 V340 T360 L364 V472 L473 G474 A479 G480 | F336-A476 HydrophobicContact CE1-CB 4.35Å; F336-A476 VanDerWaalsContact CE1-O 3.26Å; F336-A476 WeakPolarHBondContact CE1-O 3.2Å; F336-A476 VanDerWaalsContact CZ-O 3.22Å; F336-A476 WeakPolarHBondContact CZ-O 2.97Å; V340-A476 HydrophobicContact CB-CB 4.45Å; V340-A476 HydrophobicContact CG1-CB 4.11Å; V340-A476 HydrophobicContact CG2-CB 4.28Å; T360-A476 HydrophobicContact CG2-CB 4.39Å; L364-A476 HydrophobicContact CD2-CB 4.26Å; V472-A476 WeakPolarHBondContact O-CB 3.39Å; V472-A476 PolarHBondContact O-N 3.36Å; L473-A476 PolarHBondContact O-N 3.17Å; G474-A476 PolarHBondContact O-N 2.92Å; A476-A479 PolarHBondContact O-N 3Å; A476-G480 PolarHBondContact O-N 2.9Å; A476-G480 VanDerWaalsContact O-N 3.16Å |
| 477 | L | 97.1 | Very high | 93.6 | Very high | 0 Ų | 0 | 19.6 Ų | 19.6 | 0% | 0 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -66.9 | -39.3 | 177.7 | -71.2 | 172.8 | 0 | 0 | 0 | 111.5 | L321 Y325 F336 I337 L473 G474 A479 G480 I481 | L321-L477 HydrophobicContact CB-CD1 3.66Å; Y325-L477 HydrophobicContact CD2-CB 4.39Å; Y325-L477 HydrophobicContact CD2-CD2 3.67Å; Y325-L477 HydrophobicContact CE2-CD2 4.3Å; Y325-L477 HydrophobicContact CG-CD2 3.95Å; F336-L477 HydrophobicContact CD1-CD2 3.68Å; F336-L477 HydrophobicContact CE1-CD2 4.08Å; I337-L477 HydrophobicContact CG1-CD2 4.32Å; L473-L477 HydrophobicContact CD1-CD1 3.85Å; L473-L477 HydrophobicContact CD1-CG 4.02Å; L473-L477 HydrophobicContact CG-CD1 3.96Å; L473-L477 WeakPolarHBondContact O-CB 3.27Å; L473-L477 WeakPolarHBondContact O-CG 3.04Å; L473-L477 PolarHBondContact O-N 3.38Å; G474-L477 PolarHBondContact O-N 2.91Å; L477-A479 PolarHBondContact O-N 2.94Å; L477-G480 PolarHBondContact O-N 2.71Å; L477-I481 WeakPolarHBondContact O-CG1 3.47Å; L477-I481 PolarHBondContact O-N 2.87Å |
| 478 | A | 95.6 | Very high | 92.5 | Very high | 0 Ų | 0 | 27.6 Ų | 27.6 | 0% | 0 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -57.8 | -47.7 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111 | Y105 Y106 V378 G474 D475 G480 I481 M482 | Y105-A478 HydrophobicContact CD1-CB 3.75Å; Y105-A478 HydrophobicContact CE1-CB 3.51Å; Y106-A478 HydrophobicContact CD1-CB 4.27Å; Y106-A478 HydrophobicContact CE1-CB 3.39Å; V378-A478 HydrophobicContact CG1-CB 4.12Å; G474-A478 VanDerWaalsContact O-CB 3.3Å; G474-A478 WeakPolarHBondContact O-CB 3.38Å; G474-A478 PolarHBondContact O-N 3.32Å; D475-A478 PolarHBondContact O-N 3.37Å; A478-G480 VanDerWaalsContact C-N 3.27Å; A478-G480 PolarHBondContact O-N 3.01Å; A478-I481 PolarHBondContact O-N 3.27Å; A478-I481 VanDerWaalsContact O-N 3.09Å; A478-M482 WeakPolarHBondContact O-CB 3.36Å; A478-M482 VanDerWaalsContact O-CG 3.27Å; A478-M482 WeakPolarHBondContact O-CG 3.26Å; A478-M482 PolarHBondContact O-N 2.92Å |
| 479 | A | 94.3 | Very high | 91.5 | Very high | 0 Ų | 0 | 29.6 Ų | 29.6 | 0% | 0 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -58.7 | -39.9 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | L364 V378 L379 D475 A476 L477 A483 | L364-A479 HydrophobicContact CD1-CB 3.56Å; V378-A479 HydrophobicContact CB-CB 4.22Å; V378-A479 HydrophobicContact CG1-CB 3.94Å; L379-A479 HydrophobicContact CD2-CB 4.49Å; D475-A479 PolarHBondContact O-N 2.79Å; A476-A479 PolarHBondContact O-N 3Å; L477-A479 PolarHBondContact O-N 2.94Å; A479-A483 VanDerWaalsContact O-CB 3.28Å; A479-A483 WeakPolarHBondContact O-CB 3.42Å; A479-A483 PolarHBondContact O-N 3.5Å |
| 480 | G | 95.3 | Very high | 90.2 | Very high | 3 Ų | 3 | 29.2 Ų | 29.2 | 3% | 0.031 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -66.5 | -37.8 | 174.5 | 0 | 0 | 0 | 0 | 0 | 114 | A476 L477 A478 H484 | A476-G480 PolarHBondContact O-N 2.9Å; A476-G480 VanDerWaalsContact O-N 3.16Å; L477-G480 PolarHBondContact O-N 2.71Å; A478-G480 VanDerWaalsContact C-N 3.27Å; A478-G480 PolarHBondContact O-N 3.01Å; G480-H484 PolarHBondContact O-N 2.86Å |
| 481 | I | 95.9 | Very high | 88.5 | Confident | 0 Ų | 0 | 32.2 Ų | 32.2 | 0% | 0 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -68.5 | -47.1 | 176 | -71.6 | 164.3 | 0 | 0 | 0 | 110.7 | Y105 Y325 I328 T329 L477 A478 A483 H484 I485 | Y105-I481 HydrophobicContact CD2-CD1 4.47Å; Y105-I481 HydrophobicContact CE2-CD1 3.45Å; Y105-I481 VanDerWaalsContact CE2-CD1 3.45Å; Y105-I481 WeakPolarHBondContact OH-CD1 3.35Å; Y325-I481 HydrophobicContact CD2-CD1 4.22Å; Y325-I481 HydrophobicContact CD2-CG1 3.72Å; Y325-I481 HydrophobicContact CE2-CG1 4.37Å; Y325-I481 HydrophobicContact CG-CG1 4.42Å; I328-I481 HydrophobicContact CD1-CD1 4.38Å; I328-I481 HydrophobicContact CD1-CG2 4.06Å; I328-I481 HydrophobicContact CG2-CG2 3.94Å; T329-I481 HydrophobicContact CG2-CG1 4.03Å; L477-I481 WeakPolarHBondContact O-CG1 3.47Å; L477-I481 PolarHBondContact O-N 2.87Å; A478-I481 PolarHBondContact O-N 3.27Å; A478-I481 VanDerWaalsContact O-N 3.09Å; I481-A483 VanDerWaalsContact C-N 3.29Å; I481-A483 PolarHBondContact O-N 3.26Å; I481-H484 WeakPolarHBondContact O-CA 3.39Å; I481-H484 WeakPolarHBondContact O-CB 3.5Å; I481-H484 PolarHBondContact O-N 2.84Å; I481-I485 HydrophobicContact CG2-CD1 3.61Å; I481-I485 HydrophobicContact CG2-CG1 4.31Å; I481-I485 WeakPolarHBondContact O-CG1 3.5Å; I481-I485 PolarHBondContact O-N 2.97Å |
| 482 | M | 93.4 | Very high | 86.4 | Confident | 1 Ų | 1 | 38.6 Ų | 38.6 | 1% | 0.005 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -61.6 | -39.4 | 177.5 | -64.9 | -55.5 | 143.4 | 0 | 0 | 111.2 | L98 L101 Y105 I374 V378 A478 H484 I485 C486 | L98-M482 HydrophobicContact CD1-CB 3.77Å; L98-M482 HydrophobicContact CD1-CG 4.2Å; L98-M482 HydrophobicContact CD1-SD 4.48Å; L101-M482 HydrophobicContact CB-SD 4.02Å; L101-M482 HydrophobicContact CD2-CE 4.32Å; L101-M482 HydrophobicContact CD2-SD 3.51Å; L101-M482 VanDerWaalsContact CD2-SD 3.51Å; L101-M482 HydrophobicContact CG-CE 3.97Å; L101-M482 HydrophobicContact CG-SD 3.65Å; L101-M482 WeakPolarHBondContact O-CE 3.04Å; Y105-M482 HydrophobicContact CD1-CE 4.45Å; Y105-M482 HydrophobicContact CD2-CE 4.32Å; Y105-M482 HydrophobicContact CG-CE 3.85Å; I374-M482 HydrophobicContact CG2-CB 3.99Å; V378-M482 HydrophobicContact CG2-CB 4.23Å; V378-M482 HydrophobicContact CG2-CG 4.12Å; A478-M482 WeakPolarHBondContact O-CB 3.36Å; A478-M482 VanDerWaalsContact O-CG 3.27Å; A478-M482 WeakPolarHBondContact O-CG 3.26Å; A478-M482 PolarHBondContact O-N 2.92Å; M482-H484 VanDerWaalsContact C-N 3.25Å; M482-H484 PolarHBondContact O-N 3Å; M482-I485 PolarHBondContact O-N 3.39Å; M482-C486 VanDerWaalsContact O-CB 3.31Å; M482-C486 WeakPolarHBondContact O-CB 3.33Å; M482-C486 PolarHBondContact O-N 3.43Å |
| 483 | A | 91.8 | Very high | 84.4 | Confident | 21 Ų | 21 | 42.6 Ų | 42.6 | 17% | 0.174 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -60.7 | -33.2 | 172.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | I370 I374 A479 I481 | I370-A483 HydrophobicContact CD1-CB 3.76Å; I370-A483 HydrophobicContact CG2-CB 4.21Å; I374-A483 VanDerWaalsContact CD1-CA 3.41Å; I374-A483 HydrophobicContact CD1-CB 3.78Å; A479-A483 VanDerWaalsContact O-CB 3.28Å; A479-A483 WeakPolarHBondContact O-CB 3.42Å; A479-A483 PolarHBondContact O-N 3.5Å; I481-A483 VanDerWaalsContact C-N 3.29Å; I481-A483 PolarHBondContact O-N 3.26Å |
| 484 | H | 92.4 | Very high | 82 | Confident | 75 Ų | 75 | 48.6 Ų | 48.6 | 35% | 0.347 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -74.2 | -47.6 | 174.6 | -173.5 | 78.9 | 0 | 0 | 0 | 112.2 | T329 G480 I481 M482 R487 | T329-H484 HydrophobicContact CG2-CB 3.82Å; G480-H484 PolarHBondContact O-N 2.86Å; I481-H484 WeakPolarHBondContact O-CA 3.39Å; I481-H484 WeakPolarHBondContact O-CB 3.5Å; I481-H484 PolarHBondContact O-N 2.84Å; M482-H484 VanDerWaalsContact C-N 3.25Å; M482-H484 PolarHBondContact O-N 3Å; H484-R487 WeakPolarHBondContact O-CB 3.44Å |
| 485 | I | 91.1 | Very high | 79.3 | Confident | 55 Ų | 55 | 52 Ų | 52 | 28% | 0.282 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -69.6 | -45.3 | -174.6 | -62.6 | 169.7 | 0 | 0 | 0 | 111.2 | L101 I328 I481 M482 R487 | L101-I485 HydrophobicContact CD2-CB 3.91Å; L101-I485 HydrophobicContact CD2-CD1 3.8Å; L101-I485 HydrophobicContact CD2-CG1 4.47Å; L101-I485 HydrophobicContact CD2-CG2 3.46Å; L101-I485 VanDerWaalsContact CD2-CG2 3.46Å; I328-I485 HydrophobicContact CG2-CD1 3.97Å; I328-I485 HydrophobicContact CG2-CG1 4.04Å; I481-I485 HydrophobicContact CG2-CD1 3.61Å; I481-I485 HydrophobicContact CG2-CG1 4.31Å; I481-I485 WeakPolarHBondContact O-CG1 3.5Å; I481-I485 PolarHBondContact O-N 2.97Å; M482-I485 PolarHBondContact O-N 3.39Å; I485-R487 VanDerWaalsContact C-N 3.26Å; I485-R487 PolarHBondContact O-N 2.74Å |
| 486 | C | 85.6 | Confident | 76.7 | Confident | 1 Ų | 1 | 57.1 Ų | 57.1 | 1% | 0.007 | 31% | 0.306 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -84.8 | 5.5 | -176.9 | -64.7 | 0 | 0 | 0 | 0 | 113.4 | L98 M482 K488 D489 F490 | L98-C486 HydrophobicContact CD1-CB 4.49Å; M482-C486 VanDerWaalsContact O-CB 3.31Å; M482-C486 WeakPolarHBondContact O-CB 3.33Å; M482-C486 PolarHBondContact O-N 3.43Å; C486-K488 PolarHBondContact O-N 3.15Å; C486-K488 VanDerWaalsContact O-N 3.08Å; C486-D489 PolarHBondContact O-N 2.96Å; C486-F490 HydrophobicContact CB-CD2 3.87Å; C486-F490 HydrophobicContact CB-CE2 3.44Å; C486-F490 VanDerWaalsContact CB-CE2 3.44Å; C486-F490 HydrophobicContact CB-CZ 4.48Å; C486-F490 WeakPolarHBondContact O-CD2 3.49Å; C486-F490 PolarHBondContact O-N 2.86Å |
| 487 | R | 81.9 | Confident | 73.7 | Confident | 185 Ų | 185 | 62.6 Ų | 62.6 | 70% | 0.698 | 33% | 0.331 | S | S | * | . | H | α-helix | trans | -52.5 | -35.8 | -178.5 | -171.9 | 179.5 | 179.5 | -168.4 | 0.4 | 113.5 | H484 I485 A491 | H484-R487 WeakPolarHBondContact O-CB 3.44Å; I485-R487 VanDerWaalsContact C-N 3.26Å; I485-R487 PolarHBondContact O-N 2.74Å; R487-A491 WeakPolarHBondContact O-CB 3.46Å; R487-A491 PolarHBondContact O-N 3.15Å |
| 488 | K | 70.9 | Confident | 70.7 | Confident | 168 Ų | 168 | 71.8 Ų | 71.8 | 73% | 0.73 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -71.7 | -35.5 | -179.9 | -67.8 | -174.6 | 179.5 | 180 | 0 | 112.7 | C486 A491 Q492 | C486-K488 PolarHBondContact O-N 3.15Å; C486-K488 VanDerWaalsContact O-N 3.08Å; K488-A491 PolarHBondContact O-N 3.33Å; K488-Q492 PolarHBondContact O-N 3.38Å |
| 489 | D | 70.7 | Confident | 67.4 | Low | 46 Ų | 46 | 79.8 Ų | 79.8 | 25% | 0.246 | 41% | 0.413 | C | S | . | . | H | α-helix | trans | -69.7 | -42.7 | -177.8 | -55.6 | -11.2 | 0 | 0 | 0 | 109.2 | R97 C486 A491 Q492 D493 | R97-D489 IonicContact CZ-OD1 3.27Å; R97-D489 IonicContact CZ-OD2 3.57Å; R97-D489 IonicContact NE-OD2 2.83Å; R97-D489 IonicContact NH1-OD1 2.72Å; R97-D489 PolarHBondContact NH1-OD1 2.9Å; R97-D489 IonicContact NH1-OD2 3.43Å; R97-D489 PolarHBondContact NH1-OD2 3.22Å; C486-D489 PolarHBondContact O-N 2.96Å; D489-A491 PolarHBondContact O-N 2.93Å; D489-Q492 PolarHBondContact O-N 3.48Å; D489-D493 PolarHBondContact O-N 2.82Å |
| 490 | F | 65.7 | Low | 64.3 | Low | 37 Ų | 37 | 86.5 Ų | 86.5 | 16% | 0.162 | 45% | 0.448 | C | S | . | . | H | α-helix | trans | -74.7 | -21.1 | 176.7 | -62.8 | -65.2 | 0 | 0 | 0 | 114.6 | L98 I374 C486 Q492 M494 | L98-F490 HydrophobicContact CD2-CZ 4.22Å; I374-F490 HydrophobicContact CD1-CD2 3.83Å; I374-F490 HydrophobicContact CD1-CE2 3.41Å; I374-F490 VanDerWaalsContact CD1-CE2 3.41Å; I374-F490 HydrophobicContact CD1-CZ 4.17Å; I374-F490 HydrophobicContact CG1-CD2 4.29Å; I374-F490 HydrophobicContact CG1-CE2 3.55Å; I374-F490 HydrophobicContact CG1-CZ 3.78Å; C486-F490 HydrophobicContact CB-CD2 3.87Å; C486-F490 HydrophobicContact CB-CE2 3.44Å; C486-F490 VanDerWaalsContact CB-CE2 3.44Å; C486-F490 HydrophobicContact CB-CZ 4.48Å; C486-F490 WeakPolarHBondContact O-CD2 3.49Å; C486-F490 PolarHBondContact O-N 2.86Å; F490-Q492 VanDerWaalsContact C-N 3.32Å; F490-M494 WeakPolarHBondContact O-CG 3.44Å; F490-M494 PolarHBondContact O-N 2.97Å |
| 491 | A | 61.1 | Low | 61.5 | Low | 67 Ų | 67 | 92.2 Ų | 92.2 | 55% | 0.554 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -74 | -25.2 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | R487 K488 D489 | R487-A491 WeakPolarHBondContact O-CB 3.46Å; R487-A491 PolarHBondContact O-N 3.15Å; K488-A491 PolarHBondContact O-N 3.33Å; D489-A491 PolarHBondContact O-N 2.93Å |
| 492 | Q | 52.5 | Low | 58.5 | Low | 139 Ų | 139 | 98.1 Ų | 98.1 | 65% | 0.65 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -79 | -37.2 | 176.4 | -72.5 | 179.8 | -20.5 | 0 | 0 | 112.2 | K488 D489 F490 M494 G495 T496 | K488-Q492 PolarHBondContact O-N 3.38Å; D489-Q492 PolarHBondContact O-N 3.48Å; F490-Q492 VanDerWaalsContact C-N 3.32Å; Q492-M494 VanDerWaalsContact C-N 3.35Å; Q492-M494 PolarHBondContact O-N 3.49Å; Q492-G495 PolarHBondContact O-N 2.91Å; Q492-G495 VanDerWaalsContact O-N 3.15Å; Q492-T496 PolarHBondContact O-N 3.12Å; Q492-T496 PolarHBondContact O-OG1 3.05Å |
| 493 | D | 51.4 | Low | 55.4 | Low | 88 Ų | 88 | 107 Ų | 107 | 47% | 0.471 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -62.8 | -39.3 | 174 | -84.6 | -14.9 | 0 | 0 | 0 | 112.3 | D489 G495 T496 E497 | D489-D493 PolarHBondContact O-N 2.82Å; D493-G495 PolarHBondContact O-N 3.26Å; D493-T496 PolarHBondContact O-N 2.83Å; D493-E497 PolarHBondContact O-N 3.49Å |
| 494 | M | 46.3 | Very low | 52.6 | Low | 129 Ų | 129 | 112.8 Ų | 112.8 | 64% | 0.635 | 60% | 0.6 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67 | -18.8 | 175.9 | -68.8 | -77.7 | -90.6 | 0 | 0 | 113.5 | F490 Q492 T496 | F490-M494 WeakPolarHBondContact O-CG 3.44Å; F490-M494 PolarHBondContact O-N 2.97Å; Q492-M494 VanDerWaalsContact C-N 3.35Å; Q492-M494 PolarHBondContact O-N 3.49Å; M494-T496 VanDerWaalsContact C-N 3.34Å |
| 495 | G | 41.3 | Very low | 49.5 | Very low | 71 Ų | 71 | 117.9 Ų | 117.9 | 73% | 0.732 | 62% | 0.621 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.8 | -11.1 | 172.5 | 0 | 0 | 0 | 0 | 0 | 113.7 | Q492 D493 | Q492-G495 PolarHBondContact O-N 2.91Å; Q492-G495 VanDerWaalsContact O-N 3.15Å; D493-G495 PolarHBondContact O-N 3.26Å |
| 496 | T | 39.9 | Very low | 46.6 | Very low | 114 Ų | 114 | 121.1 Ų | 121.1 | 70% | 0.699 | 65% | 0.646 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -119.3 | -13.5 | -172.7 | -34.1 | 0 | 0 | 0 | 0 | 112.5 | Q492 D493 M494 K498 | Q492-T496 PolarHBondContact O-N 3.12Å; Q492-T496 PolarHBondContact O-OG1 3.05Å; D493-T496 PolarHBondContact O-N 2.83Å; M494-T496 VanDerWaalsContact C-N 3.34Å; T496-K498 PolarHBondContact O-N 2.85Å; T496-K498 VanDerWaalsContact O-N 3.07Å |
| 497 | E | 34.3 | Very low | 44.2 | Very low | 114 Ų | 114 | 125.6 Ų | 125.6 | 53% | 0.533 | 67% | 0.672 | S | S | . | * | trans | -68.9 | 101.5 | 168.9 | -86.4 | -174.6 | 151.2 | 0 | 0 | 110.8 | D493 L499 | D493-E497 PolarHBondContact O-N 3.49Å; E497-L499 PolarHBondContact O-N 3.2Å | ||
| 498 | K | 33.3 | Very low | 42 | Very low | 193 Ų | 193 | 121 Ų | 121 | 84% | 0.839 | 67% | 0.666 | S | S | * | * | trans | -52.5 | 125.5 | 147.4 | -80 | 179.7 | 175.9 | 177.7 | 0 | 107.1 | T496 L500 | T496-K498 PolarHBondContact O-N 2.85Å; T496-K498 VanDerWaalsContact O-N 3.07Å; K498-L500 PolarHBondContact O-N 3.23Å | ||
| 499 | L | 26.2 | Very low | 40.4 | Very low | 168 Ų | 168 | 119.8 Ų | 119.8 | 88% | 0.88 | 67% | 0.666 | S | S | * | * | trans | -42.7 | 111.2 | 171.1 | -100.7 | 90.2 | 0 | 0 | 0 | 110.1 | E497 | E497-L499 PolarHBondContact O-N 3.2Š| ||
| 500 | L | 29 | Very low | 38.9 | Very low | 142 Ų | 142 | 125.4 Ų | 125.4 | 74% | 0.743 | 69% | 0.691 | S | S | * | * | trans | -70.3 | 125.9 | 157.9 | -80.2 | 155.8 | 0 | 0 | 0 | 107 | K498 C502 | K498-L500 PolarHBondContact O-N 3.23Å; L500-C502 VanDerWaalsContact C-N 3.25Å; L500-C502 PolarHBondContact O-N 3.02Å | ||
| 501 | P | 36 | Very low | 37.6 | Very low | 122 Ų | 122 | 129.3 Ų | 129.3 | 79% | 0.792 | 71% | 0.709 | S | S | * | * | S | Bend | trans | -80 | 76.5 | -179.2 | 32.5 | -32 | 0 | 0 | 0 | 109.6 | ||
| 502 | C | 34 | Very low | 36.7 | Very low | 125 Ų | 125 | 130.6 Ų | 130.6 | 85% | 0.845 | 71% | 0.706 | S | S | * | * | trans | -151.6 | 59.3 | 164.7 | -91.9 | 0 | 0 | 0 | 0 | 110.5 | L500 | L500-C502 VanDerWaalsContact C-N 3.25Å; L500-C502 PolarHBondContact O-N 3.02Å | ||
| 503 | E | 28.4 | Very low | 36 | Very low | 186 Ų | 186 | 128 Ų | 128 | 87% | 0.869 | 70% | 0.7 | S | S | * | * | trans | -107.2 | 105.9 | 148.7 | -93.2 | -165.6 | 138.3 | 0 | 0 | 107.5 | K505 | E503-K505 PolarHBondContact O-N 3.36Š| ||
| 504 | T | 32.1 | Very low | 35.3 | Very low | 143 Ų | 143 | 127.4 Ų | 127.4 | 88% | 0.877 | 71% | 0.707 | S | S | * | * | trans | -67.8 | 100.7 | 164.5 | 36.5 | 0 | 0 | 0 | 0 | 108 | ||||
| 505 | K | 28.1 | Very low | 35 | Very low | 182 Ų | 182 | 125.3 Ų | 125.3 | 79% | 0.791 | 71% | 0.71 | S | S | * | * | trans | -56.5 | 137.1 | 164.4 | -79.7 | -179.9 | 175.6 | 177.2 | 0 | 109 | E503 V507 | E503-K505 PolarHBondContact O-N 3.36Å; K505-V507 PolarHBondContact O-N 3.31Å; K505-V507 VanDerWaalsContact O-N 3.12Å | ||
| 506 | P | 30.4 | Very low | 34.9 | Very low | 124 Ų | 124 | 129.3 Ų | 129.3 | 81% | 0.805 | 71% | 0.71 | S | S | * | * | trans | -68.7 | 111.9 | 169.9 | 26.9 | -29.4 | 0 | 0 | 0 | 108.5 | T508 | P506-T508 PolarHBondContact O-N 2.72Š| ||
| 507 | V | 35.8 | Very low | 34.8 | Very low | 94 Ų | 94 | 132.1 Ų | 132.1 | 57% | 0.57 | 72% | 0.715 | S | S | * | * | trans | -61.4 | 127.5 | 172.6 | 176.3 | 0 | 0 | 0 | 0 | 108 | K505 E511 I512 | K505-V507 PolarHBondContact O-N 3.31Å; K505-V507 VanDerWaalsContact O-N 3.12Å; V507-E511 HydrophobicContact CG1-CB 3.93Å; V507-E511 WeakPolarHBondContact CG1-OE2 3.38Å; V507-I512 HydrophobicContact CG1-CD1 4.45Å; V507-I512 HydrophobicContact CG1-CG1 4.02Å | ||
| 508 | T | 35.5 | Very low | 34.9 | Very low | 90 Ų | 90 | 134.1 Ų | 134.1 | 55% | 0.552 | 73% | 0.729 | S | S | * | * | trans | -82 | 145 | -178.1 | -7.5 | 0 | 0 | 0 | 0 | 109.3 | P506 Q510 E511 | P506-T508 PolarHBondContact O-N 2.72Å; T508-Q510 PolarHBondContact O-N 3.02Å; T508-E511 PolarHBondContact N-OE2 2.78Å; T508-E511 PolarHBondContact O-N 3.01Å | ||
| 509 | L | 36.8 | Very low | 35.4 | Very low | 141 Ų | 141 | 128.8 Ų | 128.8 | 74% | 0.738 | 73% | 0.729 | S | S | * | * | H | α-helix | trans | -54.2 | -23.4 | -175.5 | -139.3 | 106 | 0 | 0 | 0 | 113.8 | V513 | L509-V513 WeakPolarHBondContact O-CG2 3.48Å; L509-V513 PolarHBondContact O-N 2.95Å |
| 510 | Q | 38 | Very low | 35.7 | Very low | 164 Ų | 164 | 126.2 Ų | 126.2 | 77% | 0.766 | 72% | 0.724 | S | S | * | * | H | α-helix | trans | -68.7 | -31.4 | 174.8 | -82.7 | 174.9 | -39 | 0 | 0 | 113.9 | T508 V513 A514 | T508-Q510 PolarHBondContact O-N 3.02Å; Q510-V513 PolarHBondContact O-N 2.96Å; Q510-A514 PolarHBondContact O-N 2.98Å; Q510-A514 VanDerWaalsContact O-N 3.12Å |
| 511 | E | 39.6 | Very low | 36 | Very low | 119 Ų | 119 | 126.5 Ų | 126.5 | 56% | 0.556 | 73% | 0.731 | S | S | * | * | H | α-helix | trans | -73.3 | -31.3 | 177.7 | -68 | 176.3 | 144 | 0 | 0 | 111.4 | V507 T508 A515 | V507-E511 HydrophobicContact CG1-CB 3.93Å; V507-E511 WeakPolarHBondContact CG1-OE2 3.38Å; T508-E511 PolarHBondContact N-OE2 2.78Å; T508-E511 PolarHBondContact O-N 3.01Å; E511-A515 PolarHBondContact O-N 3.15Å |
| 512 | I | 41.5 | Very low | 35.7 | Very low | 95 Ų | 95 | 129.3 Ų | 129.3 | 49% | 0.487 | 73% | 0.731 | S | S | . | * | H | α-helix | trans | -70.2 | -37.6 | 174.6 | -60 | 174.4 | 0 | 0 | 0 | 110.8 | V507 A515 | V507-I512 HydrophobicContact CG1-CD1 4.45Å; V507-I512 HydrophobicContact CG1-CG1 4.02Å; I512-A515 PolarHBondContact O-N 3.1Å |
| 513 | V | 39 | Very low | 35.4 | Very low | 85 Ų | 85 | 128.4 Ų | 128.4 | 52% | 0.515 | 73% | 0.726 | S | S | . | * | H | α-helix | trans | -74.6 | -32.4 | -179.9 | 175.7 | 0 | 0 | 0 | 0 | 111.9 | L509 Q510 A515 Q516 | L509-V513 WeakPolarHBondContact O-CG2 3.48Å; L509-V513 PolarHBondContact O-N 2.95Å; Q510-V513 PolarHBondContact O-N 2.96Å; V513-A515 VanDerWaalsContact C-N 3.28Å; V513-A515 PolarHBondContact O-N 3.09Å; V513-Q516 PolarHBondContact O-N 2.9Å |
| 514 | A | 35.6 | Very low | 35.6 | Very low | 75 Ų | 75 | 127 Ų | 127 | 62% | 0.62 | 73% | 0.73 | S | S | * | * | H | α-helix | trans | -66.7 | -29.2 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | Q510 Q516 | Q510-A514 PolarHBondContact O-N 2.98Å; Q510-A514 VanDerWaalsContact O-N 3.12Å; A514-Q516 VanDerWaalsContact C-N 3.31Å; A514-Q516 PolarHBondContact O-N 3.38Å |
| 515 | A | 41 | Very low | 35.7 | Very low | 85 Ų | 85 | 124.3 Ų | 124.3 | 70% | 0.702 | 72% | 0.722 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.5 | -14.4 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.8 | E511 I512 V513 | E511-A515 PolarHBondContact O-N 3.15Å; I512-A515 PolarHBondContact O-N 3.1Å; V513-A515 VanDerWaalsContact C-N 3.28Å; V513-A515 PolarHBondContact O-N 3.09Å |
| 516 | Q | 39.1 | Very low | 36 | Very low | 155 Ų | 155 | 124.1 Ų | 124.1 | 72% | 0.724 | 72% | 0.724 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.5 | -2.4 | -177.2 | -76.5 | -161.8 | -42.4 | 0 | 0 | 115 | V513 A514 N518 | V513-Q516 PolarHBondContact O-N 2.9Å; A514-Q516 VanDerWaalsContact C-N 3.31Å; A514-Q516 PolarHBondContact O-N 3.38Å; Q516-N518 PolarHBondContact O-N 2.99Å |
| 517 | Q | 36.4 | Very low | 36 | Very low | 172 Ų | 172 | 123.4 Ų | 123.4 | 80% | 0.804 | 73% | 0.728 | S | S | * | * | S | Bend | trans | -83.5 | -0.8 | -171.4 | -103.1 | -172.2 | -11.5 | 0 | 0 | 116.8 | ||
| 518 | N | 36.5 | Very low | 35.7 | Very low | 156 Ų | 156 | 124.5 Ų | 124.5 | 83% | 0.834 | 74% | 0.74 | S | S | * | * | S | Bend | trans | -112.1 | 96.4 | 171.2 | -74.5 | -17.4 | 0 | 0 | 0 | 109.7 | Q516 C520 | Q516-N518 PolarHBondContact O-N 2.99Å; N518-C520 PolarHBondContact O-N 3.17Å; N518-C520 VanDerWaalsContact O-N 3.11Å |
| 519 | G | 45.3 | Very low | 35.7 | Very low | 81 Ų | 81 | 128.9 Ų | 128.9 | 84% | 0.835 | 75% | 0.754 | S | S | * | * | trans | -55.4 | 111.9 | -178.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 520 | C | 31.2 | Very low | 35.3 | Very low | 114 Ų | 114 | 130 Ų | 130 | 77% | 0.77 | 76% | 0.76 | S | S | * | * | trans | -158.5 | 110.7 | 155.1 | -140.2 | 0 | 0 | 0 | 0 | 108.1 | N518 | N518-C520 PolarHBondContact O-N 3.17Å; N518-C520 VanDerWaalsContact O-N 3.11Å | ||
| 521 | V | 36.8 | Very low | 34.8 | Very low | 149 Ų | 149 | 128.4 Ų | 128.4 | 90% | 0.903 | 76% | 0.762 | S | S | * | * | trans | -83.5 | 117.3 | 174.7 | 176.1 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 522 | K | 28 | Very low | 34.3 | Very low | 180 Ų | 180 | 131.8 Ų | 131.8 | 78% | 0.783 | 78% | 0.783 | S | S | * | * | trans | -136.1 | 139.8 | 163 | -78.2 | -167.1 | 175.4 | -171.7 | 0 | 111.4 | ||||
| 523 | S | 29.4 | Very low | 33.5 | Very low | 106 Ų | 106 | 130.5 Ų | 130.5 | 74% | 0.741 | 79% | 0.793 | S | S | * | * | trans | -69.6 | 153.5 | -177.8 | 173.5 | 0 | 0 | 0 | 0 | 112.4 | A525 | S523-A525 PolarHBondContact O-N 3.13Š| ||
| 524 | V | 31.8 | Very low | 33.4 | Very low | 157 Ų | 157 | 131.9 Ų | 131.9 | 95% | 0.952 | 80% | 0.804 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.3 | 33.3 | -170.6 | -180 | 0 | 0 | 0 | 0 | 114 | ||
| 525 | A | 33.5 | Very low | 32.9 | Very low | 86 Ų | 86 | 134.3 Ų | 134.3 | 71% | 0.711 | 81% | 0.811 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -123.1 | -3.9 | -175.3 | 0 | 0 | 0 | 0 | 0 | 116 | S523 | S523-A525 PolarHBondContact O-N 3.13Š|
| 526 | E | 34 | Very low | 32.2 | Very low | 179 Ų | 179 | 136.1 Ų | 136.1 | 84% | 0.836 | 82% | 0.817 | S | S | * | * | trans | -141 | 85.6 | -178.2 | -72 | 179.1 | 155.1 | 0 | 0 | 111 | ||||
| 527 | A | 30.5 | Very low | 31.8 | Very low | 108 Ų | 108 | 133.7 Ų | 133.7 | 89% | 0.893 | 82% | 0.815 | S | S | * | * | trans | -155.8 | 58.6 | 164.1 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 528 | S | 30.9 | Very low | 31.4 | Very low | 117 Ų | 117 | 134.5 Ų | 134.5 | 82% | 0.818 | 82% | 0.818 | S | S | * | * | trans | -111.2 | 138.7 | 154.6 | -147.6 | 0 | 0 | 0 | 0 | 106.2 | ||||
| 529 | E | 35.2 | Very low | 30.9 | Very low | 183 Ų | 183 | 135.7 Ų | 135.7 | 86% | 0.855 | 82% | 0.818 | S | S | * | * | trans | 88.2 | 95.4 | -172.2 | -55.1 | -171.5 | 153.2 | 0 | 0 | 116.7 | ||||
| 530 | L | 27.3 | Very low | 30.1 | Very low | 165 Ų | 165 | 139.8 Ų | 139.8 | 86% | 0.864 | 82% | 0.819 | S | S | * | * | trans | -161.9 | 95.2 | 137.5 | -103.8 | 140.3 | 0 | 0 | 0 | 111.4 | ||||
| 531 | T | 27.8 | Very low | 30 | Very low | 130 Ų | 130 | 138.9 Ų | 138.9 | 80% | 0.798 | 81% | 0.812 | S | S | * | * | trans | 48.8 | 117.5 | 137.2 | 52 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 532 | L | 29.4 | Very low | 29.3 | Very low | 189 Ų | 189 | 138.7 Ų | 138.7 | 99% | 0.99 | 81% | 0.811 | S | S | * | * | trans | -98.8 | 137.3 | 159.3 | -106.4 | 147.6 | 0 | 0 | 0 | 111 | ||||
| 533 | G | 25.8 | Very low | 29.2 | Very low | 68 Ų | 68 | 139 Ų | 139 | 70% | 0.701 | 82% | 0.815 | S | S | * | * | trans | -178.7 | 157.6 | 154.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 534 | P | 36.1 | Very low | 28.9 | Very low | 114 Ų | 114 | 140.4 Ų | 140.4 | 74% | 0.74 | 82% | 0.819 | S | S | * | * | cis | -127 | 149 | -9.8 | 37.8 | -20.7 | 0 | 0 | 0 | 115.8 | ||||
| 535 | T | 25.4 | Very low | 28.6 | Very low | 127 Ų | 127 | 142.4 Ų | 142.4 | 78% | 0.779 | 82% | 0.818 | S | S | * | * | trans | 57.4 | 116.1 | 139 | 58.7 | 0 | 0 | 0 | 0 | 122.4 | ||||
| 536 | C | 24.8 | Very low | 28.2 | Very low | 122 Ų | 122 | 147.2 Ų | 147.2 | 82% | 0.824 | 83% | 0.826 | S | S | * | * | 170.9 | 160.2 | 109.8 | -101.5 | 0 | 0 | 0 | 0 | 112.1 | |||||
| 537 | P | 32.4 | Very low | 27.8 | Very low | 105 Ų | 105 | 146.7 Ų | 146.7 | 68% | 0.682 | 83% | 0.829 | S | S | * | * | -117.3 | 173.8 | -101 | 28.8 | -8.8 | 0 | 0 | 0 | 115 | |||||
| 538 | H | 28.2 | Very low | 27.7 | Very low | 188 Ų | 188 | 150.9 Ų | 150.9 | 87% | 0.87 | 83% | 0.83 | S | S | * | * | trans | 107.3 | 83.9 | 171.4 | -61.4 | -65.7 | 0 | 0 | 0 | 116.2 | ||||
| 539 | H | 25.6 | Very low | 27.4 | Very low | 181 Ų | 181 | 152.7 Ų | 152.7 | 84% | 0.838 | 83% | 0.83 | S | S | * | * | trans | -121.5 | 138.1 | 157.7 | -107.5 | -53.9 | 0 | 0 | 0 | 109.2 | ||||
| 540 | I | 27.8 | Very low | 27.8 | Very low | 167 Ų | 167 | 149.3 Ų | 149.3 | 86% | 0.856 | 82% | 0.824 | S | S | * | * | trans | -141.6 | 144 | 136.9 | -70.5 | -166.7 | 0 | 0 | 0 | 106.8 | ||||
| 541 | P | 29.3 | Very low | 27.8 | Very low | 95 Ų | 95 | 146.1 Ų | 146.1 | 62% | 0.617 | 82% | 0.822 | S | S | * | * | trans | -119.4 | 173.5 | -135.8 | 41.8 | -31.3 | 0 | 0 | 0 | 115.1 | ||||
| 542 | V | 22.9 | Very low | 27.7 | Very low | 146 Ų | 146 | 144.5 Ų | 144.5 | 89% | 0.885 | 82% | 0.822 | S | S | * | * | trans | -136 | 123.4 | 154.2 | 178.8 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 543 | Q | 24.9 | Very low | 27.5 | Very low | 186 Ų | 186 | 140.5 Ų | 140.5 | 87% | 0.869 | 82% | 0.816 | S | S | * | * | trans | -84.9 | 146.5 | 177.6 | -75.8 | 179.9 | -36.7 | 0 | 0 | 111.3 | ||||
| 544 | V | 23.2 | Very low | 27.5 | Very low | 136 Ų | 136 | 142 Ų | 142 | 82% | 0.824 | 82% | 0.815 | S | S | * | * | trans | -118.7 | 127.1 | 166.3 | 175.1 | 0 | 0 | 0 | 0 | 106.4 | ||||
| 545 | E | 24.8 | Very low | 27.1 | Very low | 198 Ų | 198 | 143.9 Ų | 143.9 | 93% | 0.925 | 82% | 0.819 | S | S | * | * | trans | -99.5 | 135.6 | 175.1 | -143.6 | 165.3 | -178.3 | 0 | 0 | 108 | ||||
| 546 | Q | 25.2 | Very low | 27.1 | Very low | 187 Ų | 187 | 145 Ų | 145 | 87% | 0.874 | 82% | 0.82 | S | S | * | * | trans | -121 | 132.9 | -176.3 | -133.5 | 177.3 | -1.9 | 0 | 0 | 108.8 | ||||
| 547 | D | 26.1 | Very low | 27.1 | Very low | 168 Ų | 168 | 147.3 Ų | 147.3 | 90% | 0.898 | 82% | 0.818 | S | S | * | * | trans | -59.9 | 146.4 | 179.6 | -75.6 | -51.1 | 0 | 0 | 0 | 114.5 | ||||
| 548 | E | 27.9 | Very low | 26.7 | Very low | 196 Ų | 196 | 148.7 Ų | 148.7 | 92% | 0.916 | 83% | 0.829 | S | S | * | * | trans | -118.2 | 139.5 | 158.6 | -80.1 | -163 | 147.9 | 0 | 0 | 111.3 | ||||
| 549 | D | 25.8 | Very low | 26.5 | Very low | 156 Ų | 156 | 145 Ų | 145 | 83% | 0.834 | 82% | 0.82 | S | S | * | * | trans | -96.5 | 177.6 | 174.7 | -108.4 | -23.1 | 0 | 0 | 0 | 110.1 | ||||
| 550 | P | 44.1 | Very low | 26.5 | Very low | 111 Ų | 111 | 143.4 Ų | 143.4 | 72% | 0.721 | 82% | 0.816 | S | S | * | * | -133.8 | 178.5 | -62.5 | 34.5 | -12.9 | 0 | 0 | 0 | 114.5 | |||||
| 551 | A | 25.9 | Very low | 26.4 | Very low | 98 Ų | 98 | 143.8 Ų | 143.8 | 81% | 0.81 | 81% | 0.814 | S | S | * | * | trans | 86.5 | 112.8 | 150.6 | 0 | 0 | 0 | 0 | 0 | 122.9 | ||||
| 552 | A | 25.6 | Very low | 26.4 | Very low | 97 Ų | 97 | 147 Ų | 147 | 80% | 0.802 | 82% | 0.824 | S | S | * | * | 138.5 | 124.8 | 107.2 | 0 | 0 | 0 | 0 | 0 | 117.2 | |||||
| 553 | A | 26.1 | Very low | 26.5 | Very low | 105 Ų | 105 | 144.8 Ų | 144.8 | 87% | 0.868 | 82% | 0.815 | S | S | * | * | trans | 67.3 | 140.4 | 161.5 | 0 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 554 | S | 25 | Very low | 26.5 | Very low | 99 Ų | 99 | 144.3 Ų | 144.3 | 69% | 0.692 | 81% | 0.813 | S | S | * | * | cis | -163.8 | 149.1 | 15.8 | 51.5 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 555 | L | 27.6 | Very low | 26.8 | Very low | 154 Ų | 154 | 145.5 Ų | 145.5 | 81% | 0.806 | 81% | 0.814 | S | S | * | * | trans | 44.5 | 113.4 | 148.3 | -73.6 | 148.1 | 0 | 0 | 0 | 119.7 | ||||
| 556 | D | 25.8 | Very low | 27 | Very low | 151 Ų | 151 | 144.3 Ų | 144.3 | 81% | 0.807 | 81% | 0.808 | S | S | * | * | -172.7 | 152.8 | 105 | -100.9 | -21.8 | 0 | 0 | 0 | 113.5 | |||||
| 557 | H | 25.3 | Very low | 27.2 | Very low | 170 Ų | 170 | 140.7 Ų | 140.7 | 79% | 0.787 | 80% | 0.799 | S | S | * | * | trans | -49.1 | 142.9 | -173.6 | -81.9 | -70.8 | 0 | 0 | 0 | 117.6 | ||||
| 558 | C | 24.5 | Very low | 27.3 | Very low | 133 Ų | 133 | 139.8 Ų | 139.8 | 90% | 0.899 | 79% | 0.794 | S | S | * | * | -160 | 127.1 | 126.7 | -111.6 | 0 | 0 | 0 | 0 | 111.7 | |||||
| 559 | T | 23.8 | Very low | 27.5 | Very low | 111 Ų | 111 | 141 Ų | 141 | 68% | 0.681 | 81% | 0.814 | S | S | * | * | trans | -85.8 | 172.9 | 179.1 | 34.3 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 560 | I | 24.4 | Very low | 27.6 | Very low | 148 Ų | 148 | 140.2 Ų | 140.2 | 76% | 0.759 | 81% | 0.813 | S | S | * | * | trans | 99.6 | 132.3 | 159.2 | -55.1 | 168.6 | 0 | 0 | 0 | 113.2 | ||||
| 561 | E | 25.3 | Very low | 26.7 | Very low | 174 Ų | 174 | 141.7 Ų | 141.7 | 81% | 0.813 | 82% | 0.818 | S | S | * | * | cis | -162.1 | 149.7 | -15.1 | -111.4 | 172.6 | 168.6 | 0 | 0 | 105.8 | ||||
| 562 | I | 29.5 | Very low | 26.8 | Very low | 164 Ų | 164 | 144.2 Ų | 144.2 | 84% | 0.841 | 82% | 0.819 | S | S | * | * | trans | -99 | 121.2 | 167.5 | -68 | 165.7 | 0 | 0 | 0 | 106.7 | ||||
| 563 | S | 25.1 | Very low | 26.9 | Very low | 99 Ų | 99 | 146.9 Ų | 146.9 | 69% | 0.692 | 82% | 0.82 | S | S | * | * | trans | -173.1 | 132.6 | 156.3 | -75.1 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 564 | E | 25.8 | Very low | 26.9 | Very low | 175 Ų | 175 | 149.6 Ų | 149.6 | 82% | 0.818 | 82% | 0.817 | S | S | * | * | trans | 71.7 | 111.6 | 153.3 | -60.6 | 177.7 | 177.7 | 0 | 0 | 119.5 | ||||
| 565 | L | 28.2 | Very low | 27 | Very low | 162 Ų | 162 | 152.9 Ų | 152.9 | 85% | 0.848 | 83% | 0.825 | S | S | * | * | -170.1 | 117.8 | 100.2 | -117.9 | 93 | 0 | 0 | 0 | 111.4 | |||||
| 566 | E | 29.6 | Very low | 27 | Very low | 173 Ų | 173 | 152.9 Ų | 152.9 | 81% | 0.808 | 83% | 0.826 | S | S | * | * | trans | -65.2 | 144.8 | 153.7 | -65.8 | 174 | 132.8 | 0 | 0 | 110 | ||||
| 567 | T | 30.5 | Very low | 27.1 | Very low | 111 Ų | 111 | 153 Ų | 153 | 68% | 0.681 | 83% | 0.828 | S | S | * | * | 155.1 | 126.4 | 113.3 | 43.8 | 0 | 0 | 0 | 0 | 114 | |||||
| 568 | N | 27.4 | Very low | 27.2 | Very low | 148 Ų | 148 | 151.6 Ų | 151.6 | 79% | 0.791 | 83% | 0.831 | S | S | * | * | trans | 56.2 | 112.1 | 135.3 | -55.5 | -23.7 | 0 | 0 | 0 | 120.8 | ||||
| 569 | V | 32.8 | Very low | 27.5 | Very low | 221 Ų | 221 | 153.3 Ų | 153.3 | 100% | 1.339 | 83% | 0.825 | S | S | * | * | -153.5 | 0 | 87.6 | 167.7 | 0 | 0 | 0 | 0 | 108.8 |
Retrieved 569 of 569 residues in 298.7 ms
(Link to these results)