| 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 | 37.7 | Very low | 55.6 | Low | 231 Ų | 231 | 102.6 Ų | 102.6 | 100% | 1.138 | 61% | 0.612 | S | S | * | * | 0 | 73 | 0 | -75 | 133.6 | 77.7 | 0 | 0 | 110.4 | |||||
| 2 | S | 49.8 | Very low | 56.8 | Low | 90 Ų | 90 | 102.1 Ų | 102.1 | 63% | 0.629 | 60% | 0.603 | S | S | * | * | trans | -153.5 | -12.9 | 173.2 | -120.9 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 3 | S | 54.3 | Low | 58.2 | Low | 101 Ų | 101 | 99.5 Ų | 99.5 | 71% | 0.706 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -76.9 | -22.2 | 178.2 | -56.6 | 0 | 0 | 0 | 0 | 114.1 | ||
| 4 | D | 55.5 | Low | 59.8 | Low | 116 Ų | 116 | 99.9 Ų | 99.9 | 62% | 0.62 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -78.7 | -27.5 | -178 | -53.4 | -47.8 | 0 | 0 | 0 | 112.6 | V6 T8 | D4-V6 PolarHBondContact O-N 3Å; D4-T8 WeakPolarHBondContact O-CB 3.13Å; D4-T8 PolarHBondContact O-N 3.44Å; D4-T8 PolarHBondContact O-OG1 2.64Å |
| 5 | N | 57.5 | Low | 60.8 | Low | 112 Ų | 112 | 94.5 Ų | 94.5 | 60% | 0.599 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -72.4 | -32.1 | -176.9 | -77.6 | -9.7 | 0 | 0 | 0 | 113.2 | S9 | N5-S9 WeakPolarHBondContact O-CB 3.26Å; N5-S9 PolarHBondContact O-N 3.29Å; N5-S9 PolarHBondContact O-OG 3.5Å |
| 6 | V | 54.5 | Low | 62.1 | Low | 110 Ų | 110 | 97.9 Ų | 97.9 | 67% | 0.667 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -71.6 | -41.4 | 179 | 175 | 0 | 0 | 0 | 0 | 110.5 | D4 S9 S10 | D4-V6 PolarHBondContact O-N 3Å; V6-S9 PolarHBondContact O-N 3.18Å; V6-S10 PolarHBondContact O-N 2.92Å; V6-S10 PolarHBondContact O-OG 3.49Å |
| 7 | V | 56 | Low | 63.4 | Low | 92 Ų | 92 | 94.5 Ų | 94.5 | 56% | 0.558 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -68.3 | -46 | 177 | 179.8 | 0 | 0 | 0 | 0 | 110.8 | S9 S10 V11 | V7-S9 VanDerWaalsContact C-N 3.32Å; V7-S9 PolarHBondContact O-N 3.41Å; V7-S10 PolarHBondContact O-N 2.97Å; V7-S10 PolarHBondContact O-OG 2.89Å; V7-V11 HydrophobicContact CG1-CG2 4.35Å; V7-V11 VanDerWaalsContact O-CG2 3.24Å; V7-V11 WeakPolarHBondContact O-CG2 3.24Å; V7-V11 PolarHBondContact O-N 3.28Å |
| 8 | T | 59.2 | Low | 64.5 | Low | 55 Ų | 55 | 94 Ų | 94 | 34% | 0.337 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -63.1 | -38.2 | 176.8 | -56.9 | 0 | 0 | 0 | 0 | 111.9 | D4 S10 V11 L12 | D4-T8 WeakPolarHBondContact O-CB 3.13Å; D4-T8 PolarHBondContact O-N 3.44Å; D4-T8 PolarHBondContact O-OG1 2.64Å; T8-S10 VanDerWaalsContact C-N 3.35Å; T8-S10 PolarHBondContact O-N 3.06Å; T8-V11 PolarHBondContact O-N 3.44Å; T8-L12 HydrophobicContact CG2-CD1 4.22Å; T8-L12 WeakPolarHBondContact O-CG 3.33Å; T8-L12 PolarHBondContact O-N 3.18Å |
| 9 | S | 60.6 | Low | 65.3 | Low | 78 Ų | 78 | 89.7 Ų | 89.7 | 55% | 0.545 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -70.3 | -25.5 | 178.9 | -61 | 0 | 0 | 0 | 0 | 113.7 | N5 V6 V7 P13 | N5-S9 WeakPolarHBondContact O-CB 3.26Å; N5-S9 PolarHBondContact O-N 3.29Å; N5-S9 PolarHBondContact O-OG 3.5Å; V6-S9 PolarHBondContact O-N 3.18Å; V7-S9 VanDerWaalsContact C-N 3.32Å; V7-S9 PolarHBondContact O-N 3.41Å; S9-P13 WeakPolarHBondContact O-CD 3.15Å; S9-P13 WeakPolarHBondContact O-CG 2.81Å |
| 10 | S | 62.1 | Low | 66.1 | Low | 61 Ų | 61 | 92.6 Ų | 92.6 | 43% | 0.427 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -85.4 | -32.1 | 173.4 | 56 | 0 | 0 | 0 | 0 | 112.9 | V6 V7 T8 P13 | V6-S10 PolarHBondContact O-N 2.92Å; V6-S10 PolarHBondContact O-OG 3.49Å; V7-S10 PolarHBondContact O-N 2.97Å; V7-S10 PolarHBondContact O-OG 2.89Å; T8-S10 VanDerWaalsContact C-N 3.35Å; T8-S10 PolarHBondContact O-N 3.06Å; S10-P13 VanDerWaalsContact O-CD 3.26Å; S10-P13 WeakPolarHBondContact O-CD 3.4Å; S10-P13 VanDerWaalsContact O-CG 3.26Å; S10-P13 WeakPolarHBondContact O-CG 3.26Å |
| 11 | V | 64.7 | Low | 67.1 | Low | 83 Ų | 83 | 96 Ų | 96 | 50% | 0.503 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -70.9 | -36.2 | 179.6 | 172.1 | 0 | 0 | 0 | 0 | 112.4 | V7 T8 S15 | V7-V11 HydrophobicContact CG1-CG2 4.35Å; V7-V11 VanDerWaalsContact O-CG2 3.24Å; V7-V11 WeakPolarHBondContact O-CG2 3.24Å; V7-V11 PolarHBondContact O-N 3.28Å; T8-V11 PolarHBondContact O-N 3.44Å; V11-S15 PolarHBondContact O-N 3.15Å; V11-S15 PolarHBondContact O-OG 3.42Å; V11-S15 VanDerWaalsContact O-OG 3.05Å |
| 12 | L | 69.6 | Low | 69.1 | Low | 96 Ų | 96 | 88.3 Ų | 88.3 | 50% | 0.503 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -60.5 | -51.5 | 176.5 | -76.2 | 171.9 | 0 | 0 | 0 | 114.6 | T8 D14 S15 Y16 | T8-L12 HydrophobicContact CG2-CD1 4.22Å; T8-L12 WeakPolarHBondContact O-CG 3.33Å; T8-L12 PolarHBondContact O-N 3.18Å; L12-D14 VanDerWaalsContact C-N 3.34Å; L12-D14 PolarHBondContact O-N 3.43Å; L12-S15 PolarHBondContact O-N 2.96Å; L12-S15 PolarHBondContact O-OG 3.08Å; L12-Y16 WeakPolarHBondContact O-CB 3.37Å; L12-Y16 PolarHBondContact O-N 3.46Å; L12-Y16 VanDerWaalsContact O-N 3.1Å |
| 13 | P | 75.3 | Confident | 70.7 | Confident | 68 Ų | 68 | 86.6 Ų | 86.6 | 44% | 0.442 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -65.7 | -35.9 | -179 | 22.4 | -32.1 | 0 | 0 | 0 | 112.6 | S9 S10 S17 | S9-P13 WeakPolarHBondContact O-CD 3.15Å; S9-P13 WeakPolarHBondContact O-CG 2.81Å; S10-P13 VanDerWaalsContact O-CD 3.26Å; S10-P13 WeakPolarHBondContact O-CD 3.4Å; S10-P13 VanDerWaalsContact O-CG 3.26Å; S10-P13 WeakPolarHBondContact O-CG 3.26Å; P13-S17 WeakPolarHBondContact O-CB 3.45Å; P13-S17 PolarHBondContact O-N 3.1Å |
| 14 | D | 79.9 | Confident | 72.4 | Confident | 105 Ų | 105 | 86.5 Ų | 86.5 | 56% | 0.561 | 46% | 0.455 | S | S | * | . | H | α-helix | trans | -65.3 | -49.1 | 178.4 | -75.6 | -17.6 | 0 | 0 | 0 | 111.2 | L12 Y16 S17 L18 | L12-D14 VanDerWaalsContact C-N 3.34Å; L12-D14 PolarHBondContact O-N 3.43Å; D14-Y16 PolarHBondContact O-N 3.05Å; D14-S17 WeakPolarHBondContact O-CB 3.46Å; D14-S17 PolarHBondContact O-N 2.96Å; D14-S17 VanDerWaalsContact O-N 3.15Å; D14-S17 PolarHBondContact O-OG 3.5Å; D14-L18 WeakPolarHBondContact O-CG 3.49Å; D14-L18 PolarHBondContact O-N 2.71Å; D14-L18 VanDerWaalsContact O-N 3.08Å |
| 15 | S | 76.2 | Confident | 73.8 | Confident | 20 Ų | 20 | 85.2 Ų | 85.2 | 14% | 0.14 | 45% | 0.448 | C | S | . | . | H | α-helix | trans | -62.7 | -42 | 179 | 60.2 | 0 | 0 | 0 | 0 | 112.5 | V11 L12 S17 L18 A19 | V11-S15 PolarHBondContact O-N 3.15Å; V11-S15 PolarHBondContact O-OG 3.42Å; V11-S15 VanDerWaalsContact O-OG 3.05Å; L12-S15 PolarHBondContact O-N 2.96Å; L12-S15 PolarHBondContact O-OG 3.08Å; S15-S17 VanDerWaalsContact C-N 3.33Å; S15-S17 PolarHBondContact O-N 3.05Å; S15-L18 PolarHBondContact O-N 3.17Å; S15-A19 PolarHBondContact O-N 3.5Å |
| 16 | Y | 81.1 | Confident | 75.1 | Confident | 149 Ų | 149 | 80.6 Ų | 80.6 | 58% | 0.584 | 42% | 0.424 | S | S | * | . | H | α-helix | trans | -59.5 | -42.2 | 172.6 | 177.6 | -97.9 | 0 | 0 | 0 | 112.4 | L12 D14 L18 A19 R20 | L12-Y16 WeakPolarHBondContact O-CB 3.37Å; L12-Y16 PolarHBondContact O-N 3.46Å; L12-Y16 VanDerWaalsContact O-N 3.1Å; D14-Y16 PolarHBondContact O-N 3.05Å; Y16-L18 VanDerWaalsContact C-N 3.34Å; Y16-L18 PolarHBondContact O-N 3.45Å; Y16-A19 PolarHBondContact O-N 3.03Å; Y16-R20 WeakPolarHBondContact O-CB 2.77Å; Y16-R20 PolarHBondContact O-N 3.49Å |
| 17 | S | 84.3 | Confident | 76.6 | Confident | 40 Ų | 40 | 82 Ų | 82 | 28% | 0.28 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -63.2 | -40.4 | 179.7 | 83.3 | 0 | 0 | 0 | 0 | 112.1 | P13 D14 S15 R20 R21 | P13-S17 WeakPolarHBondContact O-CB 3.45Å; P13-S17 PolarHBondContact O-N 3.1Å; D14-S17 WeakPolarHBondContact O-CB 3.46Å; D14-S17 PolarHBondContact O-N 2.96Å; D14-S17 VanDerWaalsContact O-N 3.15Å; D14-S17 PolarHBondContact O-OG 3.5Å; S15-S17 VanDerWaalsContact C-N 3.33Å; S15-S17 PolarHBondContact O-N 3.05Å; S17-R20 PolarHBondContact O-N 2.92Å; S17-R21 WeakPolarHBondContact O-CG 3.44Å; S17-R21 PolarHBondContact O-N 2.99Å |
| 18 | L | 82.2 | Confident | 78.1 | Confident | 85 Ų | 85 | 80.2 Ų | 80.2 | 45% | 0.445 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -67 | -49.8 | 176.8 | -66.3 | 178.7 | 0 | 0 | 0 | 110.9 | D14 S15 Y16 R20 R21 H22 | D14-L18 WeakPolarHBondContact O-CG 3.49Å; D14-L18 PolarHBondContact O-N 2.71Å; D14-L18 VanDerWaalsContact O-N 3.08Å; S15-L18 PolarHBondContact O-N 3.17Å; Y16-L18 VanDerWaalsContact C-N 3.34Å; Y16-L18 PolarHBondContact O-N 3.45Å; L18-R20 VanDerWaalsContact C-N 3.26Å; L18-R20 PolarHBondContact O-N 3.3Å; L18-R21 WeakPolarHBondContact O-CB 3.08Å; L18-R21 PolarHBondContact O-N 3.45Å; L18-H22 PolarHBondContact O-CD2 3.1Å; L18-H22 PolarHBondContact O-N 2.88Å |
| 19 | A | 79.7 | Confident | 79.3 | Confident | 12 Ų | 12 | 79.1 Ų | 79.1 | 10% | 0.099 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -55.5 | -43.3 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | S15 Y16 R21 H22 L23 | S15-A19 PolarHBondContact O-N 3.5Å; Y16-A19 PolarHBondContact O-N 3.03Å; A19-R21 PolarHBondContact O-N 3.32Å; A19-H22 PolarHBondContact O-N 3Å; A19-L23 WeakPolarHBondContact O-CB 3.34Å; A19-L23 PolarHBondContact O-N 3.06Å |
| 20 | R | 82.4 | Confident | 80.5 | Confident | 147 Ų | 147 | 79.1 Ų | 79.1 | 56% | 0.555 | 40% | 0.396 | S | S | * | . | H | α-helix | trans | -60.9 | -44.6 | 174.5 | -174.2 | 174.1 | 178.8 | 164.4 | -0.3 | 111.9 | Y16 S17 L18 L23 Q24 | Y16-R20 WeakPolarHBondContact O-CB 2.77Å; Y16-R20 PolarHBondContact O-N 3.49Å; S17-R20 PolarHBondContact O-N 2.92Å; L18-R20 VanDerWaalsContact C-N 3.26Å; L18-R20 PolarHBondContact O-N 3.3Å; R20-L23 PolarHBondContact O-N 3.44Å; R20-Q24 VanDerWaalsContact O-CG 3.25Å; R20-Q24 WeakPolarHBondContact O-CG 2.93Å; R20-Q24 PolarHBondContact O-N 3.18Å |
| 21 | R | 86.3 | Confident | 81.7 | Confident | 166 Ų | 166 | 83 Ų | 83 | 63% | 0.626 | 41% | 0.405 | S | S | * | . | H | α-helix | trans | -61.3 | -46.3 | 176.1 | -74.1 | 174.3 | -177.2 | 175 | 3.5 | 111.6 | S17 L18 A19 L23 Q24 L25 | S17-R21 WeakPolarHBondContact O-CG 3.44Å; S17-R21 PolarHBondContact O-N 2.99Å; L18-R21 WeakPolarHBondContact O-CB 3.08Å; L18-R21 PolarHBondContact O-N 3.45Å; A19-R21 PolarHBondContact O-N 3.32Å; R21-L23 VanDerWaalsContact C-N 3.34Å; R21-L23 PolarHBondContact O-N 3.49Å; R21-Q24 WeakPolarHBondContact O-CB 3.06Å; R21-Q24 PolarHBondContact O-N 2.98Å; R21-L25 WeakPolarHBondContact O-CG 3.35Å; R21-L25 PolarHBondContact O-N 2.72Å |
| 22 | H | 81.2 | Confident | 82.7 | Confident | 69 Ų | 69 | 81 Ų | 81 | 32% | 0.319 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -60 | -44 | 177.5 | -74 | -66 | 0 | 0 | 0 | 112.2 | L18 A19 Q24 L25 S26 | L18-H22 PolarHBondContact O-CD2 3.1Å; L18-H22 PolarHBondContact O-N 2.88Å; A19-H22 PolarHBondContact O-N 3Å; H22-Q24 VanDerWaalsContact C-N 3.32Å; H22-Q24 PolarHBondContact O-N 2.68Å; H22-L25 PolarHBondContact O-N 2.91Å; H22-S26 PolarHBondContact O-N 3.23Å; H22-S26 PolarHBondContact O-OG 3.39Å; H22-S26 VanDerWaalsContact O-OG 3.05Å |
| 23 | L | 83.2 | Confident | 83.4 | Confident | 53 Ų | 53 | 76.9 Ų | 76.9 | 28% | 0.277 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -60.3 | -44.2 | 176.4 | -161.8 | 167.7 | 0 | 0 | 0 | 110.9 | A19 R20 R21 L25 S26 R27 | A19-L23 WeakPolarHBondContact O-CB 3.34Å; A19-L23 PolarHBondContact O-N 3.06Å; R20-L23 PolarHBondContact O-N 3.44Å; R21-L23 VanDerWaalsContact C-N 3.34Å; R21-L23 PolarHBondContact O-N 3.49Å; L23-L25 PolarHBondContact O-N 3.5Å; L23-S26 PolarHBondContact O-N 2.88Å; L23-R27 HydrophobicContact CD2-CG 3.97Å; L23-R27 WeakPolarHBondContact O-CB 3.5Å; L23-R27 WeakPolarHBondContact O-CG 3.39Å; L23-R27 PolarHBondContact O-N 3.02Å |
| 24 | Q | 88.7 | Confident | 84 | Confident | 99 Ų | 99 | 76.5 Ų | 76.5 | 46% | 0.463 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -62.8 | -41.4 | 176.1 | -67.7 | -67 | -1 | 0 | 0 | 112.6 | R20 R21 H22 R27 A28 | R20-Q24 VanDerWaalsContact O-CG 3.25Å; R20-Q24 WeakPolarHBondContact O-CG 2.93Å; R20-Q24 PolarHBondContact O-N 3.18Å; R21-Q24 WeakPolarHBondContact O-CB 3.06Å; R21-Q24 PolarHBondContact O-N 2.98Å; H22-Q24 VanDerWaalsContact C-N 3.32Å; H22-Q24 PolarHBondContact O-N 2.68Å; Q24-R27 PolarHBondContact O-N 3.43Å; Q24-A28 WeakPolarHBondContact O-CB 3.05Å; Q24-A28 PolarHBondContact O-N 3.36Å |
| 25 | L | 85.5 | Confident | 84.3 | Confident | 90 Ų | 90 | 79.5 Ų | 79.5 | 47% | 0.471 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -62.1 | -46.9 | 176.3 | -70.8 | 173.2 | 0 | 0 | 0 | 111.2 | R21 H22 L23 R27 A28 K29 | R21-L25 WeakPolarHBondContact O-CG 3.35Å; R21-L25 PolarHBondContact O-N 2.72Å; H22-L25 PolarHBondContact O-N 2.91Å; L23-L25 PolarHBondContact O-N 3.5Å; L25-R27 VanDerWaalsContact C-N 3.31Å; L25-R27 PolarHBondContact O-N 3.43Å; L25-A28 WeakPolarHBondContact O-CB 3.04Å; L25-A28 PolarHBondContact O-N 3.23Å; L25-A28 VanDerWaalsContact O-N 3.08Å; L25-K29 VanDerWaalsContact O-CG 3.27Å; L25-K29 WeakPolarHBondContact O-CG 3.37Å; L25-K29 PolarHBondContact O-N 3.05Å |
| 26 | S | 85.4 | Confident | 84.8 | Confident | 14 Ų | 14 | 82 Ų | 82 | 10% | 0.098 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -62.2 | -40.1 | 177.6 | -57.3 | 0 | 0 | 0 | 0 | 112.1 | H22 L23 K29 L30 I85 I89 | H22-S26 PolarHBondContact O-N 3.23Å; H22-S26 PolarHBondContact O-OG 3.39Å; H22-S26 VanDerWaalsContact O-OG 3.05Å; L23-S26 PolarHBondContact O-N 2.88Å; S26-K29 PolarHBondContact O-N 3.24Å; S26-L30 WeakPolarHBondContact O-CB 3.24Å; S26-L30 PolarHBondContact O-N 3.18Å; S26-I85 WeakPolarHBondContact OG-CG2 3.24Å; S26-I89 WeakPolarHBondContact OG-CD1 3.25Å |
| 27 | R | 85.5 | Confident | 85.2 | Confident | 141 Ų | 141 | 75.7 Ų | 75.7 | 53% | 0.532 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -62.5 | -41.1 | 171.1 | -78.9 | -178.9 | 169.9 | 150.4 | 1.3 | 112.4 | L23 Q24 L25 L30 K31 | L23-R27 HydrophobicContact CD2-CG 3.97Å; L23-R27 WeakPolarHBondContact O-CB 3.5Å; L23-R27 WeakPolarHBondContact O-CG 3.39Å; L23-R27 PolarHBondContact O-N 3.02Å; Q24-R27 PolarHBondContact O-N 3.43Å; L25-R27 VanDerWaalsContact C-N 3.31Å; L25-R27 PolarHBondContact O-N 3.43Å; R27-L30 PolarHBondContact O-N 3.42Å; R27-K31 WeakPolarHBondContact O-CB 3.38Å; R27-K31 WeakPolarHBondContact O-CG 3.38Å; R27-K31 PolarHBondContact O-N 2.96Å |
| 28 | A | 87.9 | Confident | 85.4 | Confident | 54 Ų | 54 | 77 Ų | 77 | 45% | 0.446 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -65 | -42.3 | 178.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | Q24 L25 K31 A32 | Q24-A28 WeakPolarHBondContact O-CB 3.05Å; Q24-A28 PolarHBondContact O-N 3.36Å; L25-A28 WeakPolarHBondContact O-CB 3.04Å; L25-A28 PolarHBondContact O-N 3.23Å; L25-A28 VanDerWaalsContact O-N 3.08Å; A28-K31 PolarHBondContact O-N 3.36Å; A28-A32 WeakPolarHBondContact O-CB 3.46Å; A28-A32 PolarHBondContact O-N 2.98Å |
| 29 | K | 83.4 | Confident | 85.6 | Confident | 32 Ų | 32 | 78.2 Ų | 78.2 | 14% | 0.139 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -62.3 | -45.5 | 173.8 | -64.9 | 170.7 | -174.2 | -168.6 | 0 | 111 | L25 S26 K31 A32 T33 I85 E118 W121 | L25-K29 VanDerWaalsContact O-CG 3.27Å; L25-K29 WeakPolarHBondContact O-CG 3.37Å; L25-K29 PolarHBondContact O-N 3.05Å; S26-K29 PolarHBondContact O-N 3.24Å; K29-K31 VanDerWaalsContact C-N 3.34Å; K29-K31 PolarHBondContact O-N 2.71Å; K29-A32 WeakPolarHBondContact O-CB 3.47Å; K29-A32 PolarHBondContact O-N 3.48Å; K29-A32 VanDerWaalsContact O-N 3.08Å; K29-T33 PolarHBondContact O-N 3.41Å; K29-I85 HydrophobicContact CD-CD1 4.1Å; K29-E118 IonicContact NZ-OE1 2.71Å; K29-E118 PolarHBondContact NZ-OE1 2.81Å; K29-W121 HydrophobicContact CB-CH2 4.42Å; K29-W121 HydrophobicContact CB-CZ2 3.91Å; K29-W121 HydrophobicContact CD-CD2 4.16Å; K29-W121 HydrophobicContact CD-CE3 3.97Å; K29-W121 HydrophobicContact CD-CH2 3.25Å; K29-W121 HydrophobicContact CD-CZ2 3.39Å; K29-W121 HydrophobicContact CD-CZ3 3.56Å; K29-W121 HydrophobicContact CG-CH2 3.44Å; K29-W121 VanDerWaalsContact CG-CH2 3.44Å; K29-W121 HydrophobicContact CG-CZ2 3.43Å; K29-W121 VanDerWaalsContact CG-CZ2 3.43Å; K29-W121 HydrophobicContact CG-CZ3 4.25Å |
| 30 | L | 85.6 | Confident | 85.7 | Confident | 77 Ų | 77 | 78.2 Ų | 78.2 | 40% | 0.403 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -60.8 | -41.2 | 176.7 | -164.9 | 68.9 | 0 | 0 | 0 | 111.8 | S26 R27 A32 T33 S34 A82 | S26-L30 WeakPolarHBondContact O-CB 3.24Å; S26-L30 PolarHBondContact O-N 3.18Å; R27-L30 PolarHBondContact O-N 3.42Å; L30-A32 VanDerWaalsContact C-N 3.34Å; L30-T33 HydrophobicContact CD1-CG2 4.2Å; L30-T33 WeakPolarHBondContact O-CG2 3.2Å; L30-S34 WeakPolarHBondContact O-CB 3.44Å; L30-S34 PolarHBondContact O-N 2.95Å; L30-S34 PolarHBondContact O-OG 3.47Å; L30-A82 HydrophobicContact CD1-CB 3.34Å |
| 31 | K | 86.8 | Confident | 86 | Confident | 144 Ų | 144 | 74 Ų | 74 | 63% | 0.626 | 39% | 0.385 | S | S | * | . | H | α-helix | trans | -68.2 | -30.1 | 173.1 | -76.3 | -178.5 | 178.5 | 177.8 | 0 | 113.3 | R27 A28 K29 S34 R35 | R27-K31 WeakPolarHBondContact O-CB 3.38Å; R27-K31 WeakPolarHBondContact O-CG 3.38Å; R27-K31 PolarHBondContact O-N 2.96Å; A28-K31 PolarHBondContact O-N 3.36Å; K29-K31 VanDerWaalsContact C-N 3.34Å; K29-K31 PolarHBondContact O-N 2.71Å; K31-S34 WeakPolarHBondContact CA-OG 3.47Å; K31-S34 PolarHBondContact O-OG 2.87Å; K31-R35 VanDerWaalsContact O-CG 3.27Å; K31-R35 WeakPolarHBondContact O-CG 3.43Å; K31-R35 PolarHBondContact O-N 2.75Å; K31-R35 PolarHBondContact O-NE 3.36Å; K31-R35 VanDerWaalsContact O-NE 3.13Å |
| 32 | A | 86.2 | Confident | 86.1 | Confident | 41 Ų | 41 | 67.8 Ų | 67.8 | 34% | 0.339 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -71.4 | -47.5 | 174.8 | 0 | 0 | 0 | 0 | 0 | 110.7 | A28 K29 L30 S34 R35 V36 | A28-A32 WeakPolarHBondContact O-CB 3.46Å; A28-A32 PolarHBondContact O-N 2.98Å; K29-A32 WeakPolarHBondContact O-CB 3.47Å; K29-A32 PolarHBondContact O-N 3.48Å; K29-A32 VanDerWaalsContact O-N 3.08Å; L30-A32 VanDerWaalsContact C-N 3.34Å; A32-S34 PolarHBondContact O-N 3.46Å; A32-R35 PolarHBondContact O-N 3.35Å; A32-V36 WeakPolarHBondContact O-CG2 3.47Å; A32-V36 PolarHBondContact O-N 3.08Å; A32-V36 VanDerWaalsContact O-N 3.12Å |
| 33 | T | 84.7 | Confident | 86.1 | Confident | 8 Ų | 8 | 70 Ų | 70 | 5% | 0.049 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -63.9 | -40.8 | 176.8 | -179.7 | 0 | 0 | 0 | 0 | 112.3 | K29 L30 R35 V36 S37 V78 H79 A82 | K29-T33 PolarHBondContact O-N 3.41Å; L30-T33 HydrophobicContact CD1-CG2 4.2Å; L30-T33 WeakPolarHBondContact O-CG2 3.2Å; T33-R35 VanDerWaalsContact C-N 3.32Å; T33-R35 PolarHBondContact O-N 2.78Å; T33-V36 PolarHBondContact O-N 2.83Å; T33-S37 PolarHBondContact O-N 2.94Å; T33-S37 PolarHBondContact O-OG 3.35Å; T33-S37 VanDerWaalsContact O-OG 3.13Å; T33-V78 VanDerWaalsContact CB-CG1 3.47Å; T33-V78 HydrophobicContact CG2-CG1 4.42Å; T33-V78 WeakPolarHBondContact OG1-CG1 3.49Å; T33-H79 PolarHBondContact OG1-CE1 3.41Å; T33-H79 PolarHBondContact OG1-ND1 2.95Å; T33-H79 VanDerWaalsContact OG1-ND1 3.08Å; T33-A82 HydrophobicContact CG2-CB 4.05Å |
| 34 | S | 87.8 | Confident | 86.2 | Confident | 61 Ų | 61 | 68 Ų | 68 | 43% | 0.427 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -63.5 | -38 | 178.7 | 66.7 | 0 | 0 | 0 | 0 | 112.5 | L30 K31 A32 S37 A38 | L30-S34 WeakPolarHBondContact O-CB 3.44Å; L30-S34 PolarHBondContact O-N 2.95Å; L30-S34 PolarHBondContact O-OG 3.47Å; K31-S34 WeakPolarHBondContact CA-OG 3.47Å; K31-S34 PolarHBondContact O-OG 2.87Å; A32-S34 PolarHBondContact O-N 3.46Å; S34-S37 PolarHBondContact O-N 3.22Å; S34-A38 PolarHBondContact O-N 2.86Å |
| 35 | R | 87.2 | Confident | 86.2 | Confident | 168 Ų | 168 | 69.6 Ų | 69.6 | 63% | 0.634 | 38% | 0.381 | S | S | * | . | H | α-helix | trans | -63 | -43.3 | 173.5 | -76.7 | -176.7 | -65.6 | 164.5 | 2.1 | 111.9 | K31 A32 T33 A38 L39 | K31-R35 VanDerWaalsContact O-CG 3.27Å; K31-R35 WeakPolarHBondContact O-CG 3.43Å; K31-R35 PolarHBondContact O-N 2.75Å; K31-R35 PolarHBondContact O-NE 3.36Å; K31-R35 VanDerWaalsContact O-NE 3.13Å; A32-R35 PolarHBondContact O-N 3.35Å; T33-R35 VanDerWaalsContact C-N 3.32Å; T33-R35 PolarHBondContact O-N 2.78Å; R35-A38 PolarHBondContact O-N 3Å; R35-L39 WeakPolarHBondContact O-CG 3.01Å; R35-L39 PolarHBondContact O-N 2.89Å; R35-L39 VanDerWaalsContact O-N 3.09Å |
| 36 | V | 86.8 | Confident | 86.3 | Confident | 72 Ų | 72 | 69 Ų | 69 | 44% | 0.436 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -61.6 | -45.3 | 174.5 | 175.2 | 0 | 0 | 0 | 0 | 110.2 | A32 T33 A38 L39 L40 L75 | A32-V36 WeakPolarHBondContact O-CG2 3.47Å; A32-V36 PolarHBondContact O-N 3.08Å; A32-V36 VanDerWaalsContact O-N 3.12Å; T33-V36 PolarHBondContact O-N 2.83Å; V36-A38 VanDerWaalsContact C-N 3.32Å; V36-A38 PolarHBondContact O-N 3.39Å; V36-L39 PolarHBondContact O-N 3.41Å; V36-L40 HydrophobicContact CG1-CD1 3.87Å; V36-L40 HydrophobicContact CG1-CG 4.1Å; V36-L40 WeakPolarHBondContact O-CB 3.44Å; V36-L40 VanDerWaalsContact O-CG 3.26Å; V36-L40 WeakPolarHBondContact O-CG 3.41Å; V36-L40 PolarHBondContact O-N 3.38Å; V36-L75 HydrophobicContact CG1-CD1 4.36Å |
| 37 | S | 87.6 | Confident | 86 | Confident | 17 Ų | 17 | 69.6 Ų | 69.6 | 12% | 0.119 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -57.5 | -42.1 | 175.7 | -56.7 | 0 | 0 | 0 | 0 | 113.3 | T33 S34 L40 A41 L75 H79 | T33-S37 PolarHBondContact O-N 2.94Å; T33-S37 PolarHBondContact O-OG 3.35Å; T33-S37 VanDerWaalsContact O-OG 3.13Å; S34-S37 PolarHBondContact O-N 3.22Å; S37-L40 PolarHBondContact O-N 3.14Å; S37-A41 VanDerWaalsContact O-CB 3.26Å; S37-A41 WeakPolarHBondContact O-CB 3.37Å; S37-A41 PolarHBondContact O-N 2.9Å; S37-L75 WeakPolarHBondContact OG-CD1 3.37Å; S37-H79 PolarHBondContact OG-CE1 2.94Å; S37-H79 PolarHBondContact OG-NE2 3.35Å |
| 38 | A | 89.6 | Confident | 85.9 | Confident | 66 Ų | 66 | 66.9 Ų | 66.9 | 55% | 0.545 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -64.4 | -43.1 | 178.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | S34 R35 V36 A41 G42 | S34-A38 PolarHBondContact O-N 2.86Å; R35-A38 PolarHBondContact O-N 3Å; V36-A38 VanDerWaalsContact C-N 3.32Å; V36-A38 PolarHBondContact O-N 3.39Å; A38-A41 PolarHBondContact O-N 3.36Å; A38-G42 PolarHBondContact O-N 2.94Å |
| 39 | L | 85.3 | Confident | 86 | Confident | 112 Ų | 112 | 68.5 Ų | 68.5 | 59% | 0.586 | 38% | 0.382 | S | S | * | . | H | α-helix | trans | -64.6 | -43.5 | 176 | -68.1 | 177.8 | 0 | 0 | 0 | 111.6 | R35 V36 G42 F43 | R35-L39 WeakPolarHBondContact O-CG 3.01Å; R35-L39 PolarHBondContact O-N 2.89Å; R35-L39 VanDerWaalsContact O-N 3.09Å; V36-L39 PolarHBondContact O-N 3.41Å; L39-G42 WeakPolarHBondContact O-CA 3.27Å; L39-G42 PolarHBondContact O-N 2.89Å; L39-F43 HydrophobicContact CB-CE2 4.41Å; L39-F43 WeakPolarHBondContact O-CD2 2.98Å; L39-F43 PolarHBondContact O-N 3.42Å |
| 40 | L | 83.8 | Confident | 85.9 | Confident | 11 Ų | 11 | 72.9 Ų | 72.9 | 6% | 0.058 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -65 | -41.6 | 177.7 | -67.8 | -174.9 | 0 | 0 | 0 | 112.5 | V36 S37 G42 F43 A44 L71 L75 F132 | V36-L40 HydrophobicContact CG1-CD1 3.87Å; V36-L40 HydrophobicContact CG1-CG 4.1Å; V36-L40 WeakPolarHBondContact O-CB 3.44Å; V36-L40 VanDerWaalsContact O-CG 3.26Å; V36-L40 WeakPolarHBondContact O-CG 3.41Å; V36-L40 PolarHBondContact O-N 3.38Å; S37-L40 PolarHBondContact O-N 3.14Å; L40-G42 VanDerWaalsContact C-N 3.27Å; L40-G42 PolarHBondContact O-N 2.87Å; L40-F43 HydrophobicContact CD2-CD2 4.36Å; L40-F43 PolarHBondContact O-N 2.68Å; L40-A44 VanDerWaalsContact O-CB 3.31Å; L40-A44 WeakPolarHBondContact O-CB 3.17Å; L40-A44 PolarHBondContact O-N 3.4Å; L40-L71 HydrophobicContact CD1-CD1 3.61Å; L40-L71 HydrophobicContact CD1-CD2 4.42Å; L40-L71 HydrophobicContact CD1-CG 3.75Å; L40-L71 HydrophobicContact CD2-CD1 3.78Å; L40-L71 HydrophobicContact CD2-CD2 3.34Å; L40-L71 HydrophobicContact CD2-CG 3.65Å; L40-L71 HydrophobicContact CG-CD1 4.32Å; L40-L71 HydrophobicContact CG-CD2 4.4Å; L40-L71 HydrophobicContact CG-CG 4.26Å; L40-L75 HydrophobicContact CB-CD2 4.48Å; L40-L75 HydrophobicContact CD1-CB 4.2Å; L40-L75 HydrophobicContact CD1-CD1 3.83Å; L40-L75 HydrophobicContact CD1-CD2 4.13Å; L40-L75 HydrophobicContact CD1-CG 4.28Å; L40-F132 HydrophobicContact CD2-CD2 4.24Å; L40-F132 HydrophobicContact CD2-CE2 3.57Å; L40-F132 HydrophobicContact CD2-CZ 4.26Å |
| 41 | A | 88.1 | Confident | 85.5 | Confident | 60 Ų | 60 | 71.7 Ų | 71.7 | 50% | 0.496 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -61.6 | -38.4 | 172.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | S37 A38 A44 M45 | S37-A41 VanDerWaalsContact O-CB 3.26Å; S37-A41 WeakPolarHBondContact O-CB 3.37Å; S37-A41 PolarHBondContact O-N 2.9Å; A38-A41 PolarHBondContact O-N 3.36Å; A41-A44 WeakPolarHBondContact O-CB 3.37Å; A41-A44 PolarHBondContact O-N 3.39Å; A41-M45 WeakPolarHBondContact O-CB 3.49Å; A41-M45 PolarHBondContact O-N 3.1Å |
| 42 | G | 88.5 | Confident | 85.2 | Confident | 34 Ų | 34 | 71.6 Ų | 71.6 | 35% | 0.351 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -60.7 | -49.9 | 171.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | A38 L39 L40 A44 M45 V46 | A38-G42 PolarHBondContact O-N 2.94Å; L39-G42 WeakPolarHBondContact O-CA 3.27Å; L39-G42 PolarHBondContact O-N 2.89Å; L40-G42 VanDerWaalsContact C-N 3.27Å; L40-G42 PolarHBondContact O-N 2.87Å; G42-A44 VanDerWaalsContact C-N 3.32Å; G42-A44 PolarHBondContact O-N 3.01Å; G42-M45 PolarHBondContact O-N 3.5Å; G42-V46 WeakPolarHBondContact O-CG2 3.48Å; G42-V46 PolarHBondContact O-N 3.4Å |
| 43 | F | 81.6 | Confident | 84.8 | Confident | 115 Ų | 115 | 74.8 Ų | 74.8 | 50% | 0.504 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -62.6 | -38.6 | 175.8 | -70.5 | -56.6 | 0 | 0 | 0 | 112.5 | L39 L40 V46 A47 | L39-F43 HydrophobicContact CB-CE2 4.41Å; L39-F43 WeakPolarHBondContact O-CD2 2.98Å; L39-F43 PolarHBondContact O-N 3.42Å; L40-F43 HydrophobicContact CD2-CD2 4.36Å; L40-F43 PolarHBondContact O-N 2.68Å; F43-V46 PolarHBondContact O-N 3.35Å; F43-A47 VanDerWaalsContact O-CB 3.31Å; F43-A47 WeakPolarHBondContact O-CB 3.34Å; F43-A47 PolarHBondContact O-N 3.46Å |
| 44 | A | 84.5 | Confident | 84.1 | Confident | 11 Ų | 11 | 76.2 Ų | 76.2 | 9% | 0.091 | 43% | 0.427 | C | S | . | . | H | α-helix | trans | -60.8 | -47.8 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.2 | L40 A41 G42 A47 I48 F68 | L40-A44 VanDerWaalsContact O-CB 3.31Å; L40-A44 WeakPolarHBondContact O-CB 3.17Å; L40-A44 PolarHBondContact O-N 3.4Å; A41-A44 WeakPolarHBondContact O-CB 3.37Å; A41-A44 PolarHBondContact O-N 3.39Å; G42-A44 VanDerWaalsContact C-N 3.32Å; G42-A44 PolarHBondContact O-N 3.01Å; A44-A47 PolarHBondContact O-N 3.27Å; A44-I48 WeakPolarHBondContact O-CB 3.36Å; A44-I48 WeakPolarHBondContact O-CD1 3.29Å; A44-I48 WeakPolarHBondContact O-CG1 3.4Å; A44-I48 PolarHBondContact O-N 2.9Å; A44-F68 HydrophobicContact CB-CD2 4.12Å; A44-F68 HydrophobicContact CB-CE2 3.23Å; A44-F68 HydrophobicContact CB-CZ 3.57Å |
| 45 | M | 89.1 | Confident | 83.1 | Confident | 134 Ų | 134 | 77.7 Ų | 77.7 | 66% | 0.66 | 43% | 0.433 | S | S | * | . | H | α-helix | trans | -60.8 | -46.5 | 178 | -180 | 172.5 | -81.7 | 0 | 0 | 110.8 | A41 G42 I48 I49 | A41-M45 WeakPolarHBondContact O-CB 3.49Å; A41-M45 PolarHBondContact O-N 3.1Å; G42-M45 PolarHBondContact O-N 3.5Å; M45-I48 PolarHBondContact O-N 3.25Å; M45-I49 WeakPolarHBondContact O-CG2 3.27Å; M45-I49 PolarHBondContact O-N 3.26Å |
| 46 | V | 86 | Confident | 82.2 | Confident | 76 Ų | 76 | 73 Ų | 73 | 46% | 0.461 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -61.4 | -44.4 | 175.6 | 176 | 0 | 0 | 0 | 0 | 111.4 | G42 F43 I48 I49 E50 | G42-V46 WeakPolarHBondContact O-CG2 3.48Å; G42-V46 PolarHBondContact O-N 3.4Å; F43-V46 PolarHBondContact O-N 3.35Å; V46-I48 VanDerWaalsContact C-N 3.34Å; V46-I48 PolarHBondContact O-N 2.91Å; V46-I49 WeakPolarHBondContact O-CG1 3.41Å; V46-I49 PolarHBondContact O-N 3.28Å; V46-E50 HydrophobicContact CG1-CG 4.25Å; V46-E50 WeakPolarHBondContact O-CB 3.31Å; V46-E50 VanDerWaalsContact O-CG 3.26Å; V46-E50 WeakPolarHBondContact O-CG 3.41Å; V46-E50 PolarHBondContact O-N 2.98Å |
| 47 | A | 80.4 | Confident | 81.2 | Confident | 27 Ų | 27 | 78 Ų | 78 | 22% | 0.223 | 46% | 0.456 | C | S | . | . | H | α-helix | trans | -63.4 | -39.1 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | F43 A44 E50 L51 L64 | F43-A47 VanDerWaalsContact O-CB 3.31Å; F43-A47 WeakPolarHBondContact O-CB 3.34Å; F43-A47 PolarHBondContact O-N 3.46Å; A44-A47 PolarHBondContact O-N 3.27Å; A47-E50 PolarHBondContact O-N 2.96Å; A47-L51 WeakPolarHBondContact O-CB 3.1Å; A47-L51 PolarHBondContact O-N 3.17Å; A47-L64 HydrophobicContact CB-CD2 3.76Å |
| 48 | I | 83.1 | Confident | 79.6 | Confident | 85 Ų | 85 | 81.1 Ų | 81.1 | 44% | 0.436 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -66.3 | -41.5 | 177.8 | -69.9 | 163.6 | 0 | 0 | 0 | 110.8 | A44 M45 V46 Q52 | A44-I48 WeakPolarHBondContact O-CB 3.36Å; A44-I48 WeakPolarHBondContact O-CD1 3.29Å; A44-I48 WeakPolarHBondContact O-CG1 3.4Å; A44-I48 PolarHBondContact O-N 2.9Å; M45-I48 PolarHBondContact O-N 3.25Å; V46-I48 VanDerWaalsContact C-N 3.34Å; V46-I48 PolarHBondContact O-N 2.91Å; I48-Q52 VanDerWaalsContact CG2-NE2 3.31Å; I48-Q52 VanDerWaalsContact O-CG 3.31Å; I48-Q52 WeakPolarHBondContact O-CG 3.47Å; I48-Q52 PolarHBondContact O-N 2.92Å |
| 49 | I | 89.4 | Confident | 78.3 | Confident | 87 Ų | 87 | 87.1 Ų | 87.1 | 45% | 0.446 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -66.3 | -43.3 | 176.6 | 62.6 | 173.4 | 0 | 0 | 0 | 111.4 | M45 V46 L51 Q52 V53 | M45-I49 WeakPolarHBondContact O-CG2 3.27Å; M45-I49 PolarHBondContact O-N 3.26Å; V46-I49 WeakPolarHBondContact O-CG1 3.41Å; V46-I49 PolarHBondContact O-N 3.28Å; I49-L51 VanDerWaalsContact C-N 3.35Å; I49-L51 PolarHBondContact O-N 2.86Å; I49-Q52 PolarHBondContact O-N 3.44Å; I49-V53 WeakPolarHBondContact O-CG2 3.44Å; I49-V53 PolarHBondContact O-N 3.26Å |
| 50 | E | 81.6 | Confident | 77.1 | Confident | 124 Ų | 124 | 84.5 Ų | 84.5 | 58% | 0.579 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -64.7 | -40.3 | 178 | -69.1 | -66 | 143.6 | 0 | 0 | 111.1 | V46 A47 V53 A54 | V46-E50 HydrophobicContact CG1-CG 4.25Å; V46-E50 WeakPolarHBondContact O-CB 3.31Å; V46-E50 VanDerWaalsContact O-CG 3.26Å; V46-E50 WeakPolarHBondContact O-CG 3.41Å; V46-E50 PolarHBondContact O-N 2.98Å; A47-E50 PolarHBondContact O-N 2.96Å; E50-V53 PolarHBondContact O-N 3.13Å; E50-A54 WeakPolarHBondContact O-CB 3.43Å; E50-A54 PolarHBondContact O-N 3.32Å |
| 51 | L | 77 | Confident | 76.2 | Confident | 53 Ų | 53 | 88 Ų | 88 | 28% | 0.277 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -63.9 | -42.8 | 177.4 | -177.9 | 66.3 | 0 | 0 | 0 | 112 | A47 I49 V53 A54 V55 P60 L65 | A47-L51 WeakPolarHBondContact O-CB 3.1Å; A47-L51 PolarHBondContact O-N 3.17Å; I49-L51 VanDerWaalsContact C-N 3.35Å; I49-L51 PolarHBondContact O-N 2.86Å; L51-V53 VanDerWaalsContact C-N 3.27Å; L51-V53 PolarHBondContact O-N 3.08Å; L51-A54 PolarHBondContact O-N 2.95Å; L51-V55 HydrophobicContact CD1-CG2 4.21Å; L51-V55 HydrophobicContact CG-CG2 4.35Å; L51-V55 VanDerWaalsContact O-CG2 3.23Å; L51-V55 WeakPolarHBondContact O-CG2 3.44Å; L51-V55 PolarHBondContact O-N 2.9Å; L51-P60 HydrophobicContact CD1-CB 3.48Å; L51-P60 VanDerWaalsContact CD1-CB 3.48Å; L51-L65 HydrophobicContact CD2-CD2 4.24Å |
| 52 | Q | 80.2 | Confident | 75.2 | Confident | 141 Ų | 141 | 92.7 Ų | 92.7 | 66% | 0.659 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -62.3 | -36.6 | 177.6 | -75.5 | 177.3 | 36.8 | 0 | 0 | 112 | I48 I49 | I48-Q52 VanDerWaalsContact CG2-NE2 3.31Å; I48-Q52 VanDerWaalsContact O-CG 3.31Å; I48-Q52 WeakPolarHBondContact O-CG 3.47Å; I48-Q52 PolarHBondContact O-N 2.92Å; I49-Q52 PolarHBondContact O-N 3.44Å |
| 53 | V | 77.7 | Confident | 74.3 | Confident | 109 Ų | 109 | 93.6 Ų | 93.6 | 66% | 0.661 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -70.2 | -45.7 | 175.1 | 176.3 | 0 | 0 | 0 | 0 | 110.8 | I49 E50 L51 V55 G56 | I49-V53 WeakPolarHBondContact O-CG2 3.44Å; I49-V53 PolarHBondContact O-N 3.26Å; E50-V53 PolarHBondContact O-N 3.13Å; L51-V53 VanDerWaalsContact C-N 3.27Å; L51-V53 PolarHBondContact O-N 3.08Å; V53-V55 PolarHBondContact O-N 3.43Å; V53-G56 PolarHBondContact O-N 3.27Å |
| 54 | A | 70.3 | Confident | 73.7 | Confident | 38 Ų | 38 | 90.9 Ų | 90.9 | 31% | 0.314 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -66.8 | -35.3 | -177.6 | 0 | 0 | 0 | 0 | 0 | 113.9 | E50 L51 G56 E57 S58 | E50-A54 WeakPolarHBondContact O-CB 3.43Å; E50-A54 PolarHBondContact O-N 3.32Å; L51-A54 PolarHBondContact O-N 2.95Å; A54-G56 PolarHBondContact O-N 2.83Å; A54-G56 VanDerWaalsContact O-N 3.16Å; A54-E57 PolarHBondContact O-N 3.45Å; A54-S58 PolarHBondContact O-N 3.3Å; A54-S58 VanDerWaalsContact O-O 3.12Å |
| 55 | V | 67.7 | Low | 73.1 | Confident | 92 Ų | 92 | 94.5 Ų | 94.5 | 56% | 0.558 | 53% | 0.533 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.7 | -23.3 | 176.6 | 169.1 | 0 | 0 | 0 | 0 | 112.1 | L51 V53 E57 | L51-V55 HydrophobicContact CD1-CG2 4.21Å; L51-V55 HydrophobicContact CG-CG2 4.35Å; L51-V55 VanDerWaalsContact O-CG2 3.23Å; L51-V55 WeakPolarHBondContact O-CG2 3.44Å; L51-V55 PolarHBondContact O-N 2.9Å; V53-V55 PolarHBondContact O-N 3.43Å; V55-E57 VanDerWaalsContact C-N 3.27Å; V55-E57 PolarHBondContact O-N 3.28Å |
| 56 | G | 67.9 | Low | 72.5 | Confident | 70 Ų | 70 | 95 Ų | 95 | 72% | 0.722 | 53% | 0.531 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.2 | -24.4 | 170.9 | 0 | 0 | 0 | 0 | 0 | 114.1 | V53 A54 | V53-G56 PolarHBondContact O-N 3.27Å; A54-G56 PolarHBondContact O-N 2.83Å; A54-G56 VanDerWaalsContact O-N 3.16Å |
| 57 | E | 66.1 | Low | 71.9 | Confident | 177 Ų | 177 | 92.2 Ų | 92.2 | 83% | 0.827 | 52% | 0.516 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -115.6 | -37.9 | -169.4 | -157.2 | 106.6 | 165.7 | 0 | 0 | 113.1 | A54 V55 | A54-E57 PolarHBondContact O-N 3.45Å; V55-E57 VanDerWaalsContact C-N 3.27Å; V55-E57 PolarHBondContact O-N 3.28Å |
| 58 | S | 53.9 | Low | 71.6 | Confident | 81 Ų | 81 | 94.5 Ų | 94.5 | 57% | 0.566 | 52% | 0.521 | S | S | * | . | S | Bend | trans | -165.3 | 167.7 | -177.5 | 54.6 | 0 | 0 | 0 | 0 | 114.8 | A54 | A54-S58 PolarHBondContact O-N 3.3Å; A54-S58 VanDerWaalsContact O-O 3.12Å |
| 59 | K | 61.4 | Low | 71.6 | Confident | 193 Ų | 193 | 94.3 Ų | 94.3 | 84% | 0.839 | 52% | 0.524 | S | S | * | . | trans | -54.9 | 135.6 | -177.3 | -98.3 | 177.6 | 128.2 | 87.3 | 0 | 111.9 | ||||
| 60 | P | 61.3 | Low | 71.2 | Confident | 56 Ų | 56 | 92.7 Ų | 92.7 | 36% | 0.364 | 52% | 0.516 | S | S | . | . | trans | -72 | 143.8 | -177.4 | 30 | -36 | 0 | 0 | 0 | 112.7 | L51 E62 | L51-P60 HydrophobicContact CD1-CB 3.48Å; L51-P60 VanDerWaalsContact CD1-CB 3.48Å; P60-E62 PolarHBondContact O-N 3.03Å; P60-E62 VanDerWaalsContact O-N 3.16Å | ||
| 61 | P | 63.8 | Low | 71.2 | Confident | 84 Ų | 84 | 88 Ų | 88 | 55% | 0.545 | 50% | 0.495 | S | S | . | . | trans | -74.3 | 104.9 | 175.4 | 28.2 | -32.2 | 0 | 0 | 0 | 111 | G63 L64 | P61-G63 PolarHBondContact O-N 3.32Å; P61-G63 VanDerWaalsContact O-N 3.08Å; P61-L64 PolarHBondContact O-N 3.1Å; P61-L64 VanDerWaalsContact O-N 3.15Å | ||
| 62 | E | 67.9 | Low | 71.5 | Confident | 160 Ų | 160 | 87.4 Ų | 87.4 | 75% | 0.748 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -53.7 | -29.9 | -178.3 | -63 | 177.2 | 178.9 | 0 | 0 | 113.6 | P60 L64 L65 F66 | P60-E62 PolarHBondContact O-N 3.03Å; P60-E62 VanDerWaalsContact O-N 3.16Å; E62-L64 VanDerWaalsContact C-N 3.27Å; E62-L64 PolarHBondContact O-N 3.21Å; E62-L65 PolarHBondContact O-N 3.1Å; E62-F66 PolarHBondContact O-N 2.97Å |
| 63 | G | 68.8 | Low | 71.9 | Confident | 52 Ų | 52 | 84.5 Ų | 84.5 | 54% | 0.536 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -62.5 | -29.4 | -179.5 | 0 | 0 | 0 | 0 | 0 | 114.5 | P61 A67 | P61-G63 PolarHBondContact O-N 3.32Å; P61-G63 VanDerWaalsContact O-N 3.08Å; G63-A67 WeakPolarHBondContact O-CB 3.39Å; G63-A67 PolarHBondContact O-N 3.34Å; G63-A67 VanDerWaalsContact O-N 3.07Å |
| 64 | L | 68.7 | Low | 72.2 | Confident | 58 Ų | 58 | 80.8 Ų | 80.8 | 30% | 0.304 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -73.7 | -39.8 | -177.5 | -158 | 150.3 | 0 | 0 | 0 | 111.4 | A47 P61 E62 A67 F68 H139 | A47-L64 HydrophobicContact CB-CD2 3.76Å; P61-L64 PolarHBondContact O-N 3.1Å; P61-L64 VanDerWaalsContact O-N 3.15Å; E62-L64 VanDerWaalsContact C-N 3.27Å; E62-L64 PolarHBondContact O-N 3.21Å; L64-A67 PolarHBondContact O-N 3.41Å; L64-F68 WeakPolarHBondContact O-CB 3.44Å; L64-F68 PolarHBondContact O-N 3.41Å; L64-H139 WeakPolarHBondContact CD1-NE2 3.44Å |
| 65 | L | 72.1 | Confident | 72.7 | Confident | 88 Ų | 88 | 80.7 Ų | 80.7 | 46% | 0.461 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -64.1 | -41.5 | 174.9 | -66.2 | 174.2 | 0 | 0 | 0 | 111.5 | L51 E62 F68 T69 | L51-L65 HydrophobicContact CD2-CD2 4.24Å; E62-L65 PolarHBondContact O-N 3.1Å; L65-F68 PolarHBondContact O-N 2.76Å; L65-T69 WeakPolarHBondContact O-CB 3.24Å; L65-T69 PolarHBondContact O-N 2.99Å; L65-T69 PolarHBondContact O-OG1 3.17Å |
| 66 | F | 75.9 | Confident | 73.8 | Confident | 143 Ų | 143 | 80.6 Ų | 80.6 | 63% | 0.627 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -63.9 | -46 | 178 | -173.3 | -104.2 | 0 | 0 | 0 | 111.6 | E62 F68 T69 I70 | E62-F66 PolarHBondContact O-N 2.97Å; F66-F68 PolarHBondContact O-N 3.26Å; F66-T69 WeakPolarHBondContact O-CB 3.4Å; F66-T69 PolarHBondContact O-N 3.31Å; F66-I70 HydrophobicContact CD1-CD1 3.83Å; F66-I70 HydrophobicContact CE1-CD1 3.33Å; F66-I70 HydrophobicContact CE1-CG1 4.33Å; F66-I70 HydrophobicContact CZ-CD1 3.74Å; F66-I70 HydrophobicContact CZ-CG1 4.44Å; F66-I70 PolarHBondContact O-N 2.94Å; F66-I70 VanDerWaalsContact O-N 3.09Å |
| 67 | A | 73.6 | Confident | 74.7 | Confident | 18 Ų | 18 | 80 Ų | 80 | 15% | 0.149 | 44% | 0.442 | C | S | . | . | H | α-helix | trans | -56.8 | -47.8 | 174 | 0 | 0 | 0 | 0 | 0 | 112.4 | G63 L64 T69 I70 L71 V135 | G63-A67 WeakPolarHBondContact O-CB 3.39Å; G63-A67 PolarHBondContact O-N 3.34Å; G63-A67 VanDerWaalsContact O-N 3.07Å; L64-A67 PolarHBondContact O-N 3.41Å; A67-T69 VanDerWaalsContact C-N 3.3Å; A67-T69 PolarHBondContact O-N 3.21Å; A67-I70 PolarHBondContact O-N 2.95Å; A67-L71 WeakPolarHBondContact O-CB 3.35Å; A67-L71 PolarHBondContact O-N 3.22Å; A67-L71 VanDerWaalsContact O-N 3.07Å; A67-V135 HydrophobicContact CB-CG1 3.43Å; A67-V135 VanDerWaalsContact CB-CG1 3.43Å |
| 68 | F | 75.7 | Confident | 75.6 | Confident | 75 Ų | 75 | 72.9 Ų | 72.9 | 33% | 0.329 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -61.5 | -37.8 | 177.5 | 177.7 | -110 | 0 | 0 | 0 | 112.7 | A44 L64 L65 F66 L71 S72 | A44-F68 HydrophobicContact CB-CD2 4.12Å; A44-F68 HydrophobicContact CB-CE2 3.23Å; A44-F68 HydrophobicContact CB-CZ 3.57Å; L64-F68 WeakPolarHBondContact O-CB 3.44Å; L64-F68 PolarHBondContact O-N 3.41Å; L65-F68 PolarHBondContact O-N 2.76Å; F66-F68 PolarHBondContact O-N 3.26Å; F68-L71 PolarHBondContact O-N 2.92Å; F68-S72 WeakPolarHBondContact CZ-OG 3.37Å; F68-S72 WeakPolarHBondContact O-CB 3.48Å; F68-S72 PolarHBondContact O-N 2.93Å; F68-S72 PolarHBondContact O-OG 3.12Å |
| 69 | T | 81.8 | Confident | 77.1 | Confident | 81 Ų | 81 | 72.7 Ų | 72.7 | 50% | 0.497 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -65 | -49 | 178.7 | -58 | 0 | 0 | 0 | 0 | 111.4 | L65 F66 A67 L71 S72 C73 | L65-T69 WeakPolarHBondContact O-CB 3.24Å; L65-T69 PolarHBondContact O-N 2.99Å; L65-T69 PolarHBondContact O-OG1 3.17Å; F66-T69 WeakPolarHBondContact O-CB 3.4Å; F66-T69 PolarHBondContact O-N 3.31Å; A67-T69 VanDerWaalsContact C-N 3.3Å; A67-T69 PolarHBondContact O-N 3.21Å; T69-L71 VanDerWaalsContact C-N 3.28Å; T69-L71 PolarHBondContact O-N 2.97Å; T69-S72 PolarHBondContact O-N 3.09Å; T69-C73 PolarHBondContact O-N 3.17Å |
| 70 | I | 82.3 | Confident | 78.4 | Confident | 54 Ų | 54 | 68.7 Ų | 68.7 | 28% | 0.277 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -58.9 | -45.4 | 177.2 | -67.6 | 174 | 0 | 0 | 0 | 110.2 | F66 A67 S72 C73 L74 | F66-I70 HydrophobicContact CD1-CD1 3.83Å; F66-I70 HydrophobicContact CE1-CD1 3.33Å; F66-I70 HydrophobicContact CE1-CG1 4.33Å; F66-I70 HydrophobicContact CZ-CD1 3.74Å; F66-I70 HydrophobicContact CZ-CG1 4.44Å; F66-I70 PolarHBondContact O-N 2.94Å; F66-I70 VanDerWaalsContact O-N 3.09Å; A67-I70 PolarHBondContact O-N 2.95Å; I70-S72 VanDerWaalsContact C-N 3.33Å; I70-S72 PolarHBondContact O-N 3.49Å; I70-C73 WeakPolarHBondContact O-CB 3.44Å; I70-C73 PolarHBondContact O-N 3.46Å; I70-L74 HydrophobicContact CG2-CD1 4.08Å; I70-L74 WeakPolarHBondContact O-CG 3.28Å; I70-L74 PolarHBondContact O-N 3.34Å |
| 71 | L | 81.3 | Confident | 79.5 | Confident | 26 Ų | 26 | 67.8 Ų | 67.8 | 14% | 0.136 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -61.5 | -41.4 | -179.8 | -174.7 | 49.3 | 0 | 0 | 0 | 112.6 | L40 A67 F68 T69 L74 L75 F132 | L40-L71 HydrophobicContact CD1-CD1 3.61Å; L40-L71 HydrophobicContact CD1-CD2 4.42Å; L40-L71 HydrophobicContact CD1-CG 3.75Å; L40-L71 HydrophobicContact CD2-CD1 3.78Å; L40-L71 HydrophobicContact CD2-CD2 3.34Å; L40-L71 HydrophobicContact CD2-CG 3.65Å; L40-L71 HydrophobicContact CG-CD1 4.32Å; L40-L71 HydrophobicContact CG-CD2 4.4Å; L40-L71 HydrophobicContact CG-CG 4.26Å; A67-L71 WeakPolarHBondContact O-CB 3.35Å; A67-L71 PolarHBondContact O-N 3.22Å; A67-L71 VanDerWaalsContact O-N 3.07Å; F68-L71 PolarHBondContact O-N 2.92Å; T69-L71 VanDerWaalsContact C-N 3.28Å; T69-L71 PolarHBondContact O-N 2.97Å; L71-L74 PolarHBondContact O-N 3.4Å; L71-L75 PolarHBondContact O-N 3.34Å; L71-F132 HydrophobicContact CD1-CB 4.4Å; L71-F132 HydrophobicContact CD1-CD2 3.44Å; L71-F132 VanDerWaalsContact CD1-CD2 3.44Å; L71-F132 HydrophobicContact CD1-CE2 4.1Å; L71-F132 HydrophobicContact CD1-CG 4.31Å; L71-F132 HydrophobicContact CD2-CD2 4.01Å; L71-F132 HydrophobicContact CD2-CE2 4Å; L71-F132 HydrophobicContact CG-CD2 4.35Å |
| 72 | S | 83.8 | Confident | 80.5 | Confident | 39 Ų | 39 | 64 Ų | 64 | 27% | 0.273 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -65 | -41.7 | 175.2 | -60.8 | 0 | 0 | 0 | 0 | 111.9 | F68 T69 I70 L74 L75 V76 | F68-S72 WeakPolarHBondContact CZ-OG 3.37Å; F68-S72 WeakPolarHBondContact O-CB 3.48Å; F68-S72 PolarHBondContact O-N 2.93Å; F68-S72 PolarHBondContact O-OG 3.12Å; T69-S72 PolarHBondContact O-N 3.09Å; I70-S72 VanDerWaalsContact C-N 3.33Å; I70-S72 PolarHBondContact O-N 3.49Å; S72-L74 PolarHBondContact O-N 3.36Å; S72-L75 WeakPolarHBondContact O-CB 3.19Å; S72-L75 PolarHBondContact O-N 2.95Å; S72-V76 WeakPolarHBondContact O-CG2 3.49Å; S72-V76 PolarHBondContact O-N 2.88Å |
| 73 | C | 87.7 | Confident | 81.3 | Confident | 81 Ų | 81 | 60.6 Ų | 60.6 | 55% | 0.547 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -58.9 | -45.5 | 173.8 | -92.6 | 0 | 0 | 0 | 0 | 112.1 | T69 I70 L75 V76 V77 | T69-C73 PolarHBondContact O-N 3.17Å; I70-C73 WeakPolarHBondContact O-CB 3.44Å; I70-C73 PolarHBondContact O-N 3.46Å; C73-L75 VanDerWaalsContact C-N 3.33Å; C73-L75 PolarHBondContact O-N 3.32Å; C73-V76 WeakPolarHBondContact O-CB 3.43Å; C73-V76 PolarHBondContact O-N 3.08Å; C73-V77 WeakPolarHBondContact O-CG2 3.44Å; C73-V77 PolarHBondContact O-N 3.09Å |
| 74 | L | 83.6 | Confident | 82.2 | Confident | 31 Ų | 31 | 61 Ų | 61 | 16% | 0.162 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -65.5 | -37.4 | 177.7 | -66.4 | 168.2 | 0 | 0 | 0 | 112 | I70 L71 S72 V76 V77 V78 L131 | I70-L74 HydrophobicContact CG2-CD1 4.08Å; I70-L74 WeakPolarHBondContact O-CG 3.28Å; I70-L74 PolarHBondContact O-N 3.34Å; L71-L74 PolarHBondContact O-N 3.4Å; S72-L74 PolarHBondContact O-N 3.36Å; L74-V76 VanDerWaalsContact C-N 3.32Å; L74-V76 PolarHBondContact O-N 3.12Å; L74-V77 WeakPolarHBondContact O-CB 3.49Å; L74-V77 PolarHBondContact O-N 3.39Å; L74-V77 VanDerWaalsContact O-N 3.16Å; L74-V78 WeakPolarHBondContact O-CG2 3.45Å; L74-V78 PolarHBondContact O-N 3Å; L74-L131 HydrophobicContact CD1-CB 3.53Å; L74-L131 HydrophobicContact CD1-CD1 3.7Å; L74-L131 HydrophobicContact CD1-CG 4.27Å; L74-L131 HydrophobicContact CD2-CD1 3.82Å; L74-L131 HydrophobicContact CG-CD1 4.32Å |
| 75 | L | 82.3 | Confident | 82.9 | Confident | 35 Ų | 35 | 58.9 Ų | 58.9 | 18% | 0.183 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -59.6 | -45.4 | 174.8 | -170 | 62.1 | 0 | 0 | 0 | 111.7 | V36 S37 L40 L71 S72 C73 V77 V78 H79 | V36-L75 HydrophobicContact CG1-CD1 4.36Å; S37-L75 WeakPolarHBondContact OG-CD1 3.37Å; L40-L75 HydrophobicContact CB-CD2 4.48Å; L40-L75 HydrophobicContact CD1-CB 4.2Å; L40-L75 HydrophobicContact CD1-CD1 3.83Å; L40-L75 HydrophobicContact CD1-CD2 4.13Å; L40-L75 HydrophobicContact CD1-CG 4.28Å; L71-L75 PolarHBondContact O-N 3.34Å; S72-L75 WeakPolarHBondContact O-CB 3.19Å; S72-L75 PolarHBondContact O-N 2.95Å; C73-L75 VanDerWaalsContact C-N 3.33Å; C73-L75 PolarHBondContact O-N 3.32Å; L75-V77 VanDerWaalsContact C-N 3.3Å; L75-V77 PolarHBondContact O-N 3.49Å; L75-V78 PolarHBondContact O-N 3.13Å; L75-H79 PolarHBondContact O-N 3.33Å |
| 76 | V | 89.4 | Confident | 83.4 | Confident | 90 Ų | 90 | 57.4 Ų | 57.4 | 55% | 0.545 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -58.1 | -45 | 174.2 | 172.8 | 0 | 0 | 0 | 0 | 110.1 | S72 C73 L74 V78 H79 I80 | S72-V76 WeakPolarHBondContact O-CG2 3.49Å; S72-V76 PolarHBondContact O-N 2.88Å; C73-V76 WeakPolarHBondContact O-CB 3.43Å; C73-V76 PolarHBondContact O-N 3.08Å; L74-V76 VanDerWaalsContact C-N 3.32Å; L74-V76 PolarHBondContact O-N 3.12Å; V76-V78 PolarHBondContact O-N 3.44Å; V76-H79 PolarHBondContact O-N 3.36Å; V76-I80 HydrophobicContact CG1-CG1 4.27Å; V76-I80 WeakPolarHBondContact O-CG1 3.5Å; V76-I80 PolarHBondContact O-N 2.97Å |
| 77 | V | 86.9 | Confident | 83.7 | Confident | 59 Ų | 59 | 55.1 Ų | 55.1 | 36% | 0.358 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -56.8 | -50.5 | 176.2 | 174.3 | 0 | 0 | 0 | 0 | 111.1 | C73 L74 L75 H79 I80 M81 | C73-V77 WeakPolarHBondContact O-CG2 3.44Å; C73-V77 PolarHBondContact O-N 3.09Å; L74-V77 WeakPolarHBondContact O-CB 3.49Å; L74-V77 PolarHBondContact O-N 3.39Å; L74-V77 VanDerWaalsContact O-N 3.16Å; L75-V77 VanDerWaalsContact C-N 3.3Å; L75-V77 PolarHBondContact O-N 3.49Å; V77-H79 VanDerWaalsContact C-N 3.28Å; V77-H79 PolarHBondContact O-N 3.08Å; V77-I80 PolarHBondContact O-N 3.44Å; V77-M81 HydrophobicContact CG1-CE 4.13Å; V77-M81 HydrophobicContact CG1-CG 4.38Å; V77-M81 WeakPolarHBondContact O-CG 3.31Å; V77-M81 PolarHBondContact O-N 3Å |
| 78 | V | 85.3 | Confident | 83.8 | Confident | 26 Ų | 26 | 56.3 Ų | 56.3 | 16% | 0.158 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -63.1 | -35.6 | 179.8 | -175.1 | 0 | 0 | 0 | 0 | 111.6 | T33 L74 L75 V76 M81 A82 | T33-V78 VanDerWaalsContact CB-CG1 3.47Å; T33-V78 HydrophobicContact CG2-CG1 4.42Å; T33-V78 WeakPolarHBondContact OG1-CG1 3.49Å; L74-V78 WeakPolarHBondContact O-CG2 3.45Å; L74-V78 PolarHBondContact O-N 3Å; L75-V78 PolarHBondContact O-N 3.13Å; V76-V78 PolarHBondContact O-N 3.44Å; V78-M81 PolarHBondContact O-N 2.93Å; V78-A82 PolarHBondContact O-N 2.85Å |
| 79 | H | 85 | Confident | 83.6 | Confident | 78 Ų | 78 | 53.6 Ų | 53.6 | 36% | 0.361 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -65 | -47.9 | 175.6 | -86.7 | 14.5 | 0 | 0 | 0 | 113.1 | T33 S37 L75 V76 V77 M81 A82 V83 | T33-H79 PolarHBondContact OG1-CE1 3.41Å; T33-H79 PolarHBondContact OG1-ND1 2.95Å; T33-H79 VanDerWaalsContact OG1-ND1 3.08Å; S37-H79 PolarHBondContact OG-CE1 2.94Å; S37-H79 PolarHBondContact OG-NE2 3.35Å; L75-H79 PolarHBondContact O-N 3.33Å; V76-H79 PolarHBondContact O-N 3.36Å; V77-H79 VanDerWaalsContact C-N 3.28Å; V77-H79 PolarHBondContact O-N 3.08Å; H79-M81 PolarHBondContact O-N 3.18Å; H79-A82 PolarHBondContact O-N 3.44Å; H79-A82 VanDerWaalsContact O-N 3.12Å; H79-V83 WeakPolarHBondContact O-CG2 3.13Å; H79-V83 PolarHBondContact O-N 3.33Å; H79-V83 VanDerWaalsContact O-N 3.08Å |
| 80 | I | 88.7 | Confident | 83.2 | Confident | 109 Ų | 109 | 54.9 Ų | 54.9 | 56% | 0.559 | 32% | 0.315 | S | S | * | . | H | α-helix | trans | -60.7 | -38.9 | 176 | -61.6 | -56.4 | 0 | 0 | 0 | 110.5 | V76 V77 A82 V83 M84 | V76-I80 HydrophobicContact CG1-CG1 4.27Å; V76-I80 WeakPolarHBondContact O-CG1 3.5Å; V76-I80 PolarHBondContact O-N 2.97Å; V77-I80 PolarHBondContact O-N 3.44Å; I80-A82 VanDerWaalsContact C-N 3.34Å; I80-A82 PolarHBondContact O-N 3.38Å; I80-V83 PolarHBondContact O-N 2.9Å; I80-M84 WeakPolarHBondContact O-CB 3.37Å; I80-M84 PolarHBondContact O-N 3.47Å |
| 81 | M | 85.8 | Confident | 82.4 | Confident | 36 Ų | 36 | 56.2 Ų | 56.2 | 18% | 0.177 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -63.4 | -38.6 | 175.6 | -63.7 | -73.9 | 162.5 | 0 | 0 | 112.7 | V77 V78 H79 M84 I85 W121 | V77-M81 HydrophobicContact CG1-CE 4.13Å; V77-M81 HydrophobicContact CG1-CG 4.38Å; V77-M81 WeakPolarHBondContact O-CG 3.31Å; V77-M81 PolarHBondContact O-N 3Å; V78-M81 PolarHBondContact O-N 2.93Å; H79-M81 PolarHBondContact O-N 3.18Å; M81-M84 HydrophobicContact CE-CE 4.48Å; M81-M84 WeakPolarHBondContact O-CB 3.44Å; M81-M84 PolarHBondContact O-N 3.48Å; M81-M84 HydrophobicContact SD-CE 3.28Å; M81-M84 WeakPolarHBondContact SD-CE 3.38Å; M81-I85 WeakPolarHBondContact O-CG1 3.25Å; M81-I85 PolarHBondContact O-N 2.93Å; M81-W121 HydrophobicContact CB-CG 4.49Å; M81-W121 HydrophobicContact SD-CB 4.47Å |
| 82 | A | 83.8 | Confident | 81.7 | Confident | 6 Ų | 6 | 57 Ų | 57 | 5% | 0.05 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -68.9 | -36 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | L30 T33 V78 H79 I80 S86 | L30-A82 HydrophobicContact CD1-CB 3.34Å; T33-A82 HydrophobicContact CG2-CB 4.05Å; V78-A82 PolarHBondContact O-N 2.85Å; H79-A82 PolarHBondContact O-N 3.44Å; H79-A82 VanDerWaalsContact O-N 3.12Å; I80-A82 VanDerWaalsContact C-N 3.34Å; I80-A82 PolarHBondContact O-N 3.38Å; A82-S86 PolarHBondContact O-N 2.87Å; A82-S86 PolarHBondContact O-OG 3.49Å |
| 83 | V | 85.1 | Confident | 80.8 | Confident | 88 Ų | 88 | 58.8 Ų | 58.8 | 53% | 0.533 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -63.2 | -46.5 | 170.2 | 174.5 | 0 | 0 | 0 | 0 | 110.3 | H79 I80 I85 S86 T87 | H79-V83 WeakPolarHBondContact O-CG2 3.13Å; H79-V83 PolarHBondContact O-N 3.33Å; H79-V83 VanDerWaalsContact O-N 3.08Å; I80-V83 PolarHBondContact O-N 2.9Å; V83-I85 PolarHBondContact O-N 3.44Å; V83-S86 WeakPolarHBondContact O-CB 3.31Å; V83-S86 PolarHBondContact O-N 3.18Å; V83-S86 VanDerWaalsContact O-N 3.1Å; V83-T87 PolarHBondContact O-N 2.89Å; V83-T87 PolarHBondContact O-OG1 3.31Å |
| 84 | M | 87.1 | Confident | 79.7 | Confident | 61 Ų | 61 | 59.2 Ų | 59.2 | 30% | 0.3 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -57.2 | -48.7 | 179.5 | -177.9 | 176.1 | 50.8 | 0 | 0 | 111.9 | I80 M81 S86 T87 C88 V117 | I80-M84 WeakPolarHBondContact O-CB 3.37Å; I80-M84 PolarHBondContact O-N 3.47Å; M81-M84 HydrophobicContact CE-CE 4.48Å; M81-M84 WeakPolarHBondContact O-CB 3.44Å; M81-M84 PolarHBondContact O-N 3.48Å; M81-M84 HydrophobicContact SD-CE 3.28Å; M81-M84 WeakPolarHBondContact SD-CE 3.38Å; M84-S86 VanDerWaalsContact C-N 3.27Å; M84-S86 PolarHBondContact O-N 3.41Å; M84-T87 PolarHBondContact O-N 3.26Å; M84-C88 WeakPolarHBondContact O-CB 3.48Å; M84-C88 PolarHBondContact O-N 2.9Å; M84-C88 PolarHBondContact O-SG 2.91Å; M84-V117 HydrophobicContact CE-CG1 3.47Å; M84-V117 VanDerWaalsContact CE-CG1 3.47Å; M84-V117 HydrophobicContact CG-CG1 3.93Å; M84-V117 HydrophobicContact SD-CB 4.5Å; M84-V117 HydrophobicContact SD-CG1 3.64Å; M84-V117 HydrophobicContact SD-CG2 4.09Å |
| 85 | I | 83.8 | Confident | 78.7 | Confident | 13 Ų | 13 | 61 Ų | 61 | 7% | 0.067 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -61.8 | -37 | 178.3 | -63 | 168.4 | 0 | 0 | 0 | 111.5 | S26 K29 M81 V83 C88 I89 W121 | S26-I85 WeakPolarHBondContact OG-CG2 3.24Å; K29-I85 HydrophobicContact CD-CD1 4.1Å; M81-I85 WeakPolarHBondContact O-CG1 3.25Å; M81-I85 PolarHBondContact O-N 2.93Å; V83-I85 PolarHBondContact O-N 3.44Å; I85-C88 PolarHBondContact O-N 3.36Å; I85-I89 HydrophobicContact CG2-CD1 4.19Å; I85-I89 WeakPolarHBondContact O-CG1 3.26Å; I85-I89 PolarHBondContact O-N 2.96Å; I85-W121 HydrophobicContact CD1-CB 4.3Å; I85-W121 HydrophobicContact CD1-CD2 3.87Å; I85-W121 HydrophobicContact CD1-CE3 4.45Å; I85-W121 HydrophobicContact CD1-CG 3.74Å |
| 86 | S | 82.9 | Confident | 77.4 | Confident | 56 Ų | 56 | 64.2 Ų | 64.2 | 39% | 0.392 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -66.5 | -47 | 179.3 | -58.3 | 0 | 0 | 0 | 0 | 111.5 | A82 V83 M84 C88 I89 | A82-S86 PolarHBondContact O-N 2.87Å; A82-S86 PolarHBondContact O-OG 3.49Å; V83-S86 WeakPolarHBondContact O-CB 3.31Å; V83-S86 PolarHBondContact O-N 3.18Å; V83-S86 VanDerWaalsContact O-N 3.1Å; M84-S86 VanDerWaalsContact C-N 3.27Å; M84-S86 PolarHBondContact O-N 3.41Å; S86-C88 VanDerWaalsContact C-N 3.32Å; S86-C88 PolarHBondContact O-N 2.89Å; S86-I89 PolarHBondContact O-N 3.21Å |
| 87 | T | 81.3 | Confident | 75.9 | Confident | 95 Ų | 95 | 65.3 Ų | 65.3 | 58% | 0.583 | 37% | 0.365 | S | S | * | . | H | α-helix | trans | -66.7 | -32.9 | 177.7 | -53.1 | 0 | 0 | 0 | 0 | 111.9 | V83 M84 I89 P91 | V83-T87 PolarHBondContact O-N 2.89Å; V83-T87 PolarHBondContact O-OG1 3.31Å; M84-T87 PolarHBondContact O-N 3.26Å; T87-I89 VanDerWaalsContact C-N 3.32Å; T87-I89 PolarHBondContact O-N 2.94Å; T87-P91 WeakPolarHBondContact O-CD 3.47Å |
| 88 | C | 75.6 | Confident | 74.5 | Confident | 43 Ų | 43 | 67.3 Ų | 67.3 | 29% | 0.291 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -67.7 | -27 | 177.2 | -67.2 | 0 | 0 | 0 | 0 | 113.6 | M84 I85 S86 P91 R114 | M84-C88 WeakPolarHBondContact O-CB 3.48Å; M84-C88 PolarHBondContact O-N 2.9Å; M84-C88 PolarHBondContact O-SG 2.91Å; I85-C88 PolarHBondContact O-N 3.36Å; S86-C88 VanDerWaalsContact C-N 3.32Å; S86-C88 PolarHBondContact O-N 2.89Å; C88-P91 WeakPolarHBondContact O-CD 3.26Å; C88-P91 WeakPolarHBondContact O-CG 3.13Å; C88-R114 PolarHBondContact O-NH2 2.84Å |
| 89 | I | 72.3 | Confident | 72.7 | Confident | 18 Ų | 18 | 71.1 Ų | 71.1 | 9% | 0.092 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -79.8 | -31.3 | -177.5 | -70.9 | 168.2 | 0 | 0 | 0 | 113.3 | S26 I85 S86 T87 H92 | S26-I89 WeakPolarHBondContact OG-CD1 3.25Å; I85-I89 HydrophobicContact CG2-CD1 4.19Å; I85-I89 WeakPolarHBondContact O-CG1 3.26Å; I85-I89 PolarHBondContact O-N 2.96Å; S86-I89 PolarHBondContact O-N 3.21Å; T87-I89 VanDerWaalsContact C-N 3.32Å; T87-I89 PolarHBondContact O-N 2.94Å; I89-H92 WeakPolarHBondContact O-CB 3.12Å; I89-H92 PolarHBondContact O-N 3.34Å; I89-H92 VanDerWaalsContact O-N 3.14Å |
| 90 | L | 73.2 | Confident | 71.3 | Confident | 108 Ų | 108 | 72.2 Ų | 72.2 | 57% | 0.565 | 41% | 0.408 | S | S | * | . | H | α-helix | trans | -55.9 | -48.2 | -179.1 | -146.5 | 69.7 | 0 | 0 | 0 | 114.4 | H92 I93 | L90-H92 PolarHBondContact O-N 2.83Å; L90-H92 VanDerWaalsContact O-N 3.1Å; L90-I93 HydrophobicContact CD1-CD1 4.12Å; L90-I93 WeakPolarHBondContact O-CG1 3.4Å; L90-I93 PolarHBondContact O-N 2.83Å |
| 91 | P | 65.1 | Low | 69.5 | Low | 82 Ų | 82 | 74.3 Ų | 74.3 | 53% | 0.532 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -63.8 | -22.1 | 179.4 | 24.2 | -34.9 | 0 | 0 | 0 | 113.6 | T87 C88 S95 | T87-P91 WeakPolarHBondContact O-CD 3.47Å; C88-P91 WeakPolarHBondContact O-CD 3.26Å; C88-P91 WeakPolarHBondContact O-CG 3.13Å; P91-S95 PolarHBondContact O-N 3.42Å; P91-S95 PolarHBondContact O-OG 3.26Å |
| 92 | H | 67.5 | Low | 67.9 | Low | 44 Ų | 44 | 78.5 Ų | 78.5 | 20% | 0.204 | 45% | 0.451 | C | S | . | . | H | α-helix | trans | -76.3 | -32.4 | -179.2 | -174.1 | 61.6 | 0 | 0 | 0 | 112.5 | I89 L90 S95 Y96 | I89-H92 WeakPolarHBondContact O-CB 3.12Å; I89-H92 PolarHBondContact O-N 3.34Å; I89-H92 VanDerWaalsContact O-N 3.14Å; L90-H92 PolarHBondContact O-N 2.83Å; L90-H92 VanDerWaalsContact O-N 3.1Å; H92-S95 PolarHBondContact O-OG 3.17Å; H92-Y96 AromaticContact CD2-CE2 3.9Å; H92-Y96 AromaticContact CE1-CE2 3.63Å; H92-Y96 AromaticContact CE1-CZ 3.67Å; H92-Y96 PolarHBondContact CE1-OH 3.04Å; H92-Y96 AromaticContact ND1-CE2 3.94Å; H92-Y96 AromaticContact NE2-CE2 3.62Å; H92-Y96 AromaticContact NE2-CZ 3.85Å; H92-Y96 PolarHBondContact NE2-OH 2.97Å; H92-Y96 WeakPolarHBondContact O-CD2 3.42Å; H92-Y96 WeakPolarHBondContact O-CE2 3.28Å |
| 93 | I | 64.5 | Low | 66.4 | Low | 75 Ų | 75 | 83.8 Ų | 83.8 | 39% | 0.385 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -75.1 | -36.4 | 177.1 | 56.5 | 162.7 | 0 | 0 | 0 | 111.9 | L90 Y96 | L90-I93 HydrophobicContact CD1-CD1 4.12Å; L90-I93 WeakPolarHBondContact O-CG1 3.4Å; L90-I93 PolarHBondContact O-N 2.83Å; I93-Y96 PolarHBondContact O-N 3.45Å |
| 94 | D | 65.3 | Low | 64.8 | Low | 91 Ų | 91 | 85.8 Ų | 85.8 | 49% | 0.487 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -71.8 | -32.5 | -177.5 | -66.5 | -24.3 | 0 | 0 | 0 | 111.5 | Y96 T97 | D94-Y96 PolarHBondContact O-N 3.41Å; D94-T97 PolarHBondContact O-N 3.38Å; D94-T97 VanDerWaalsContact O-N 3.1Å; D94-T97 PolarHBondContact O-OG1 3.29Å |
| 95 | S | 61.7 | Low | 63.1 | Low | 67 Ų | 67 | 91 Ų | 91 | 47% | 0.469 | 51% | 0.505 | S | S | . | . | G | 310 helix | trans | -64.7 | -23 | 179.3 | 61.5 | 0 | 0 | 0 | 0 | 114.4 | P91 H92 T97 | P91-S95 PolarHBondContact O-N 3.42Å; P91-S95 PolarHBondContact O-OG 3.26Å; H92-S95 PolarHBondContact O-OG 3.17Å; S95-T97 PolarHBondContact O-N 3.48Å |
| 96 | Y | 56.1 | Low | 61.6 | Low | 104 Ų | 104 | 96.1 Ų | 96.1 | 41% | 0.408 | 53% | 0.529 | S | S | . | . | G | 310 helix | trans | -74.3 | -13.7 | 176.2 | -70 | -75.3 | 0 | 0 | 0 | 113.3 | H92 I93 D94 | H92-Y96 AromaticContact CD2-CE2 3.9Å; H92-Y96 AromaticContact CE1-CE2 3.63Å; H92-Y96 AromaticContact CE1-CZ 3.67Å; H92-Y96 PolarHBondContact CE1-OH 3.04Å; H92-Y96 AromaticContact ND1-CE2 3.94Å; H92-Y96 AromaticContact NE2-CE2 3.62Å; H92-Y96 AromaticContact NE2-CZ 3.85Å; H92-Y96 PolarHBondContact NE2-OH 2.97Å; H92-Y96 WeakPolarHBondContact O-CD2 3.42Å; H92-Y96 WeakPolarHBondContact O-CE2 3.28Å; I93-Y96 PolarHBondContact O-N 3.45Å; D94-Y96 PolarHBondContact O-N 3.41Å |
| 97 | T | 56.9 | Low | 60.2 | Low | 113 Ų | 113 | 102.5 Ų | 102.5 | 69% | 0.693 | 55% | 0.553 | S | S | * | * | G | 310 helix | trans | -91.7 | -14.5 | 178.2 | 66.7 | 0 | 0 | 0 | 0 | 113.3 | D94 S95 | D94-T97 PolarHBondContact O-N 3.38Å; D94-T97 VanDerWaalsContact O-N 3.1Å; D94-T97 PolarHBondContact O-OG1 3.29Å; S95-T97 PolarHBondContact O-N 3.48Å |
| 98 | V | 57.8 | Low | 59.2 | Low | 100 Ų | 100 | 99.1 Ų | 99.1 | 61% | 0.606 | 53% | 0.534 | S | S | * | . | S | Bend | trans | -86 | 126.7 | 178 | -175.7 | 0 | 0 | 0 | 0 | 108.6 | Q100 | V98-Q100 PolarHBondContact O-N 3.01Š|
| 99 | P | 47.6 | Very low | 58.3 | Low | 107 Ų | 107 | 101.1 Ų | 101.1 | 70% | 0.695 | 55% | 0.546 | S | S | * | . | trans | -53 | 138.4 | 179.5 | -25.2 | 33.4 | 0 | 0 | 0 | 112.3 | D101 | P99-D101 VanDerWaalsContact C-N 3.31Å; P99-D101 PolarHBondContact O-N 3.46Å | ||
| 100 | Q | 56.2 | Low | 58 | Low | 101 Ų | 101 | 105.1 Ų | 105.1 | 47% | 0.472 | 56% | 0.564 | S | S | . | * | S | Bend | trans | -74.2 | 61.2 | -158.8 | -164.9 | -172.5 | -33 | 0 | 0 | 112.9 | V98 Y103 | V98-Q100 PolarHBondContact O-N 3.01Å; Q100-Y103 VanDerWaalsContact C-CD1 3.41Å; Q100-Y103 HydrophobicContact CB-CD1 4.34Å; Q100-Y103 HydrophobicContact CB-CE1 4.26Å; Q100-Y103 HydrophobicContact CG-CD1 3.64Å; Q100-Y103 HydrophobicContact CG-CD2 4.09Å; Q100-Y103 HydrophobicContact CG-CE1 3.51Å; Q100-Y103 HydrophobicContact CG-CE2 3.85Å; Q100-Y103 HydrophobicContact CG-CG 3.96Å; Q100-Y103 VanDerWaalsContact NE2-CZ 3.28Å; Q100-Y103 PolarHBondContact NE2-OH 3.25Å; Q100-Y103 WeakPolarHBondContact O-CD1 3.41Å; Q100-Y103 WeakPolarHBondContact O-CE1 3.47Å |
| 101 | D | 50.8 | Low | 57.8 | Low | 152 Ų | 152 | 104.4 Ų | 104.4 | 81% | 0.813 | 56% | 0.561 | S | S | * | * | S | Bend | trans | -121.6 | -8.4 | 179.3 | -73.9 | -32.7 | 0 | 0 | 0 | 115.2 | P99 | P99-D101 VanDerWaalsContact C-N 3.31Å; P99-D101 PolarHBondContact O-N 3.46Å |
| 102 | C | 51.1 | Low | 58.3 | Low | 125 Ų | 125 | 110.4 Ų | 110.4 | 85% | 0.845 | 57% | 0.573 | S | S | * | * | S | Bend | trans | -116.1 | 47.3 | 173.2 | -159.4 | 0 | 0 | 0 | 0 | 111.7 | ||
| 103 | Y | 53.2 | Low | 58.9 | Low | 116 Ų | 116 | 113.8 Ų | 113.8 | 46% | 0.455 | 59% | 0.592 | S | S | . | * | S | Bend | trans | -124.8 | -12.4 | -175.4 | 75.6 | -65.6 | 0 | 0 | 0 | 114.2 | Q100 | Q100-Y103 VanDerWaalsContact C-CD1 3.41Å; Q100-Y103 HydrophobicContact CB-CD1 4.34Å; Q100-Y103 HydrophobicContact CB-CE1 4.26Å; Q100-Y103 HydrophobicContact CG-CD1 3.64Å; Q100-Y103 HydrophobicContact CG-CD2 4.09Å; Q100-Y103 HydrophobicContact CG-CE1 3.51Å; Q100-Y103 HydrophobicContact CG-CE2 3.85Å; Q100-Y103 HydrophobicContact CG-CG 3.96Å; Q100-Y103 VanDerWaalsContact NE2-CZ 3.28Å; Q100-Y103 PolarHBondContact NE2-OH 3.25Å; Q100-Y103 WeakPolarHBondContact O-CD1 3.41Å; Q100-Y103 WeakPolarHBondContact O-CE1 3.47Å |
| 104 | L | 50.6 | Low | 59.5 | Low | 131 Ų | 131 | 112.2 Ų | 112.2 | 69% | 0.686 | 58% | 0.582 | S | S | * | * | S | Bend | trans | -97.7 | -11.9 | -176.1 | -70.3 | -167.1 | 0 | 0 | 0 | 116 | ||
| 105 | I | 51.3 | Low | 60.2 | Low | 171 Ų | 171 | 111.1 Ų | 111.1 | 88% | 0.877 | 58% | 0.578 | S | S | * | * | S | Bend | trans | -110.2 | -15.4 | -176.5 | -61.1 | 174.5 | 0 | 0 | 0 | 112.5 | ||
| 106 | E | 52.2 | Low | 61.4 | Low | 120 Ų | 120 | 115.2 Ų | 115.2 | 56% | 0.561 | 59% | 0.588 | S | S | * | * | trans | -125.6 | 78.8 | 174.3 | -142.5 | -166.8 | 139.2 | 0 | 0 | 107.6 | A108 P109 | E106-A108 HydrophobicContact CB-CB 4.35Å; E106-A108 HydrophobicContact CG-CB 4.2Å; E106-A108 VanDerWaalsContact O-CA 3.24Å; E106-A108 WeakPolarHBondContact O-CA 3.41Å; E106-A108 VanDerWaalsContact O-CB 3.24Å; E106-A108 WeakPolarHBondContact O-CB 3.35Å; E106-A108 PolarHBondContact O-N 3.16Å; E106-P109 WeakPolarHBondContact OE1-CD 3.41Å | ||
| 107 | E | 53.2 | Low | 62.7 | Low | 190 Ų | 190 | 111.3 Ų | 111.3 | 89% | 0.888 | 58% | 0.575 | S | S | * | * | trans | -57 | 78.9 | 157.3 | 41.9 | 171.5 | -178.7 | 0 | 0 | 107.9 | ||||
| 108 | A | 60.9 | Low | 64 | Low | 23 Ų | 23 | 108.8 Ų | 108.8 | 19% | 0.19 | 56% | 0.555 | C | S | . | * | trans | -70.7 | 145.7 | -138.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | E106 H110 N111 | E106-A108 HydrophobicContact CB-CB 4.35Å; E106-A108 HydrophobicContact CG-CB 4.2Å; E106-A108 VanDerWaalsContact O-CA 3.24Å; E106-A108 WeakPolarHBondContact O-CA 3.41Å; E106-A108 VanDerWaalsContact O-CB 3.24Å; E106-A108 WeakPolarHBondContact O-CB 3.35Å; E106-A108 PolarHBondContact O-N 3.16Å; A108-H110 WeakPolarHBondContact CA-ND1 3.25Å; A108-H110 HydrophobicContact CB-CB 4.35Å; A108-H110 WeakPolarHBondContact CB-ND1 3.46Å; A108-H110 PolarHBondContact O-N 3.01Å; A108-H110 PolarHBondContact O-ND1 2.74Å; A108-N111 PolarHBondContact O-N 2.94Å | ||
| 109 | P | 55.8 | Low | 65.3 | Low | 85 Ų | 85 | 108.1 Ų | 108.1 | 55% | 0.552 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -49.7 | -14.9 | 172.7 | 20.8 | -33.4 | 0 | 0 | 0 | 113.9 | E106 N111 R112 L113 | E106-P109 WeakPolarHBondContact OE1-CD 3.41Å; P109-N111 PolarHBondContact O-N 3.45Å; P109-R112 PolarHBondContact O-N 3.32Å; P109-L113 PolarHBondContact O-N 3.46Å |
| 110 | H | 67.6 | Low | 67.1 | Low | 102 Ų | 102 | 104.8 Ų | 104.8 | 47% | 0.472 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -53.8 | -43.6 | 173.7 | 82.7 | -67.9 | 0 | 0 | 0 | 115.1 | A108 R112 L113 R114 | A108-H110 WeakPolarHBondContact CA-ND1 3.25Å; A108-H110 HydrophobicContact CB-CB 4.35Å; A108-H110 WeakPolarHBondContact CB-ND1 3.46Å; A108-H110 PolarHBondContact O-N 3.01Å; A108-H110 PolarHBondContact O-ND1 2.74Å; H110-R112 VanDerWaalsContact C-N 3.34Å; H110-L113 PolarHBondContact O-N 3.02Å; H110-R114 WeakPolarHBondContact O-CB 3.39Å; H110-R114 PolarHBondContact O-N 3.08Å |
| 111 | N | 68.4 | Low | 68.3 | Low | 93 Ų | 93 | 101.8 Ų | 101.8 | 50% | 0.497 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -70.2 | -36.3 | -177.4 | -175.2 | 57.7 | 0 | 0 | 0 | 110.8 | A108 P109 T115 | A108-N111 PolarHBondContact O-N 2.94Å; P109-N111 PolarHBondContact O-N 3.45Å; N111-T115 WeakPolarHBondContact O-CB 3.43Å; N111-T115 PolarHBondContact O-N 3.37Å; N111-T115 PolarHBondContact O-OG1 3.28Å |
| 112 | R | 75.5 | Confident | 70 | Confident | 208 Ų | 208 | 98.6 Ų | 98.6 | 79% | 0.785 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -65.6 | -43.9 | 173.5 | -57.8 | -138.6 | 85.5 | -129 | 3.6 | 111.2 | P109 H110 T115 F116 | P109-R112 PolarHBondContact O-N 3.32Å; H110-R112 VanDerWaalsContact C-N 3.34Å; R112-T115 PolarHBondContact O-N 2.91Å; R112-F116 WeakPolarHBondContact O-CB 3.26Å; R112-F116 PolarHBondContact O-N 3.49Å |
| 113 | L | 79.5 | Confident | 71.6 | Confident | 115 Ų | 115 | 96.3 Ų | 96.3 | 60% | 0.602 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -62 | -46.5 | 176 | -179.6 | 62.9 | 0 | 0 | 0 | 111.8 | P109 H110 T115 F116 V117 | P109-L113 PolarHBondContact O-N 3.46Å; H110-L113 PolarHBondContact O-N 3.02Å; L113-T115 PolarHBondContact O-N 3.36Å; L113-F116 WeakPolarHBondContact O-CB 3.23Å; L113-F116 PolarHBondContact O-N 3.47Å; L113-V117 WeakPolarHBondContact O-CG2 3.39Å; L113-V117 PolarHBondContact O-N 3.23Å |
| 114 | R | 77.5 | Confident | 73.1 | Confident | 43 Ų | 43 | 92.4 Ų | 92.4 | 16% | 0.162 | 47% | 0.473 | C | S | . | . | H | α-helix | trans | -59.1 | -47 | 176.2 | 172 | -176.1 | -76.7 | -88 | 1.9 | 111.7 | C88 H110 F116 V117 E118 | C88-R114 PolarHBondContact O-NH2 2.84Å; H110-R114 WeakPolarHBondContact O-CB 3.39Å; H110-R114 PolarHBondContact O-N 3.08Å; R114-F116 VanDerWaalsContact C-N 3.29Å; R114-F116 PolarHBondContact O-N 3.41Å; R114-V117 WeakPolarHBondContact O-CB 3.48Å; R114-V117 PolarHBondContact O-N 3.12Å; R114-E118 PolarHBondContact O-N 3.26Å |
| 115 | T | 80.5 | Confident | 74.6 | Confident | 68 Ų | 68 | 87.9 Ų | 87.9 | 42% | 0.417 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -62.1 | -41.2 | 179.3 | -55.4 | 0 | 0 | 0 | 0 | 110.3 | N111 R112 L113 E118 V119 | N111-T115 WeakPolarHBondContact O-CB 3.43Å; N111-T115 PolarHBondContact O-N 3.37Å; N111-T115 PolarHBondContact O-OG1 3.28Å; R112-T115 PolarHBondContact O-N 2.91Å; L113-T115 PolarHBondContact O-N 3.36Å; T115-E118 PolarHBondContact O-N 3.05Å; T115-V119 HydrophobicContact CG2-CG2 4.47Å; T115-V119 VanDerWaalsContact O-CG2 3.29Å; T115-V119 WeakPolarHBondContact O-CG2 3.21Å; T115-V119 PolarHBondContact O-N 3.41Å |
| 116 | F | 85.9 | Confident | 76.3 | Confident | 153 Ų | 153 | 83.2 Ų | 83.2 | 67% | 0.671 | 43% | 0.43 | S | S | * | . | H | α-helix | trans | -62 | -44.1 | 175.4 | -173.2 | -98.2 | 0 | 0 | 0 | 112.3 | R112 L113 R114 E118 V119 A120 | R112-F116 WeakPolarHBondContact O-CB 3.26Å; R112-F116 PolarHBondContact O-N 3.49Å; L113-F116 WeakPolarHBondContact O-CB 3.23Å; L113-F116 PolarHBondContact O-N 3.47Å; R114-F116 VanDerWaalsContact C-N 3.29Å; R114-F116 PolarHBondContact O-N 3.41Å; F116-E118 VanDerWaalsContact C-N 3.33Å; F116-E118 PolarHBondContact O-N 3.29Å; F116-V119 PolarHBondContact O-N 2.86Å; F116-A120 VanDerWaalsContact O-CB 3.31Å; F116-A120 WeakPolarHBondContact O-CB 3.46Å; F116-A120 PolarHBondContact O-N 3.28Å |
| 117 | V | 84.8 | Confident | 77.7 | Confident | 22 Ų | 22 | 80.4 Ų | 80.4 | 13% | 0.133 | 42% | 0.421 | C | S | . | . | H | α-helix | trans | -59.9 | -42.2 | 174.5 | 164.6 | 0 | 0 | 0 | 0 | 111.7 | M84 L113 R114 A120 W121 | M84-V117 HydrophobicContact CE-CG1 3.47Å; M84-V117 VanDerWaalsContact CE-CG1 3.47Å; M84-V117 HydrophobicContact CG-CG1 3.93Å; M84-V117 HydrophobicContact SD-CB 4.5Å; M84-V117 HydrophobicContact SD-CG1 3.64Å; M84-V117 HydrophobicContact SD-CG2 4.09Å; L113-V117 WeakPolarHBondContact O-CG2 3.39Å; L113-V117 PolarHBondContact O-N 3.23Å; R114-V117 WeakPolarHBondContact O-CB 3.48Å; R114-V117 PolarHBondContact O-N 3.12Å; V117-A120 PolarHBondContact O-N 3.43Å; V117-W121 WeakPolarHBondContact O-CB 3.49Å; V117-W121 PolarHBondContact O-N 3.38Å |
| 118 | E | 82.7 | Confident | 79.1 | Confident | 59 Ų | 59 | 71.9 Ų | 71.9 | 28% | 0.276 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -68.5 | -41.3 | 178.2 | -177.8 | 157.6 | -151.6 | 0 | 0 | 112.4 | K29 R114 T115 F116 W121 I122 | K29-E118 IonicContact NZ-OE1 2.71Å; K29-E118 PolarHBondContact NZ-OE1 2.81Å; R114-E118 PolarHBondContact O-N 3.26Å; T115-E118 PolarHBondContact O-N 3.05Å; F116-E118 VanDerWaalsContact C-N 3.33Å; F116-E118 PolarHBondContact O-N 3.29Å; E118-W121 HydrophobicContact CG-CE3 4.4Å; E118-W121 WeakPolarHBondContact O-CB 3.39Å; E118-W121 PolarHBondContact O-N 3.4Å; E118-I122 HydrophobicContact CG-CD1 4.48Å; E118-I122 WeakPolarHBondContact O-CG1 3.46Å; E118-I122 PolarHBondContact O-N 3.29Å |
| 119 | V | 85.5 | Confident | 80.1 | Confident | 87 Ų | 87 | 75.2 Ų | 75.2 | 53% | 0.527 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -63.6 | -44.3 | 174.4 | 172.9 | 0 | 0 | 0 | 0 | 110.8 | T115 F116 W121 I122 C123 | T115-V119 HydrophobicContact CG2-CG2 4.47Å; T115-V119 VanDerWaalsContact O-CG2 3.29Å; T115-V119 WeakPolarHBondContact O-CG2 3.21Å; T115-V119 PolarHBondContact O-N 3.41Å; F116-V119 PolarHBondContact O-N 2.86Å; V119-W121 VanDerWaalsContact C-N 3.28Å; V119-W121 PolarHBondContact O-N 3.3Å; V119-I122 PolarHBondContact O-N 2.95Å; V119-C123 PolarHBondContact O-N 3.33Å |
| 120 | A | 85.8 | Confident | 81.4 | Confident | 36 Ų | 36 | 76.1 Ų | 76.1 | 30% | 0.298 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -58.5 | -41.6 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | F116 V117 C123 S124 | F116-A120 VanDerWaalsContact O-CB 3.31Å; F116-A120 WeakPolarHBondContact O-CB 3.46Å; F116-A120 PolarHBondContact O-N 3.28Å; V117-A120 PolarHBondContact O-N 3.43Å; A120-C123 WeakPolarHBondContact O-CB 3.29Å; A120-C123 PolarHBondContact O-N 3.13Å; A120-S124 PolarHBondContact O-N 2.86Å; A120-S124 PolarHBondContact O-OG 3.42Å; A120-S124 VanDerWaalsContact O-OG 3.09Å |
| 121 | W | 82.1 | Confident | 81.9 | Confident | 38 Ų | 38 | 74 Ų | 74 | 14% | 0.144 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -63 | -46 | 175.7 | 166.9 | 67 | 0 | 0 | 0 | 113.1 | K29 M81 I85 V117 E118 V119 C123 S124 T125 | K29-W121 HydrophobicContact CB-CH2 4.42Å; K29-W121 HydrophobicContact CB-CZ2 3.91Å; K29-W121 HydrophobicContact CD-CD2 4.16Å; K29-W121 HydrophobicContact CD-CE3 3.97Å; K29-W121 HydrophobicContact CD-CH2 3.25Å; K29-W121 HydrophobicContact CD-CZ2 3.39Å; K29-W121 HydrophobicContact CD-CZ3 3.56Å; K29-W121 HydrophobicContact CG-CH2 3.44Å; K29-W121 VanDerWaalsContact CG-CH2 3.44Å; K29-W121 HydrophobicContact CG-CZ2 3.43Å; K29-W121 VanDerWaalsContact CG-CZ2 3.43Å; K29-W121 HydrophobicContact CG-CZ3 4.25Å; M81-W121 HydrophobicContact CB-CG 4.49Å; M81-W121 HydrophobicContact SD-CB 4.47Å; I85-W121 HydrophobicContact CD1-CB 4.3Å; I85-W121 HydrophobicContact CD1-CD2 3.87Å; I85-W121 HydrophobicContact CD1-CE3 4.45Å; I85-W121 HydrophobicContact CD1-CG 3.74Å; V117-W121 WeakPolarHBondContact O-CB 3.49Å; V117-W121 PolarHBondContact O-N 3.38Å; E118-W121 HydrophobicContact CG-CE3 4.4Å; E118-W121 WeakPolarHBondContact O-CB 3.39Å; E118-W121 PolarHBondContact O-N 3.4Å; V119-W121 VanDerWaalsContact C-N 3.28Å; V119-W121 PolarHBondContact O-N 3.3Å; W121-C123 VanDerWaalsContact C-N 3.27Å; W121-C123 PolarHBondContact O-N 3.41Å; W121-S124 PolarHBondContact O-N 3.17Å; W121-T125 PolarHBondContact NE1-OG1 3.27Å; W121-T125 PolarHBondContact O-N 2.81Å; W121-T125 PolarHBondContact O-OG1 2.94Å |
| 122 | I | 85.7 | Confident | 82.4 | Confident | 86 Ų | 86 | 72 Ų | 72 | 44% | 0.441 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -59.4 | -44.8 | 177.2 | -64.5 | 168.5 | 0 | 0 | 0 | 109.2 | E118 V119 S124 T125 V126 | E118-I122 HydrophobicContact CG-CD1 4.48Å; E118-I122 WeakPolarHBondContact O-CG1 3.46Å; E118-I122 PolarHBondContact O-N 3.29Å; V119-I122 PolarHBondContact O-N 2.95Å; I122-S124 PolarHBondContact O-N 3.44Å; I122-T125 PolarHBondContact O-N 3.42Å; I122-V126 HydrophobicContact CG2-CG2 4.39Å; I122-V126 WeakPolarHBondContact O-CG2 3.36Å; I122-V126 PolarHBondContact O-N 3.46Å |
| 123 | C | 86.1 | Confident | 82.7 | Confident | 77 Ų | 77 | 66.8 Ų | 66.8 | 52% | 0.52 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -57.7 | -48.1 | 176 | -171.1 | 0 | 0 | 0 | 0 | 111.9 | V119 A120 W121 T125 V126 V127 | V119-C123 PolarHBondContact O-N 3.33Å; A120-C123 WeakPolarHBondContact O-CB 3.29Å; A120-C123 PolarHBondContact O-N 3.13Å; W121-C123 VanDerWaalsContact C-N 3.27Å; W121-C123 PolarHBondContact O-N 3.41Å; C123-T125 VanDerWaalsContact C-N 3.27Å; C123-T125 PolarHBondContact O-N 3.29Å; C123-V126 PolarHBondContact O-N 2.89Å; C123-V127 WeakPolarHBondContact O-CG2 3.34Å; C123-V127 PolarHBondContact O-N 2.85Å |
| 124 | S | 83.6 | Confident | 82.4 | Confident | 33 Ų | 33 | 62.4 Ų | 62.4 | 23% | 0.231 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -61.2 | -34.7 | 177 | -59.4 | 0 | 0 | 0 | 0 | 113.1 | A120 W121 I122 G128 | A120-S124 PolarHBondContact O-N 2.86Å; A120-S124 PolarHBondContact O-OG 3.42Å; A120-S124 VanDerWaalsContact O-OG 3.09Å; W121-S124 PolarHBondContact O-N 3.17Å; I122-S124 PolarHBondContact O-N 3.44Å; S124-G128 PolarHBondContact O-N 2.84Å |
| 125 | T | 83.3 | Confident | 82.1 | Confident | 36 Ų | 36 | 61.8 Ų | 61.8 | 22% | 0.221 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -70.9 | -43.2 | 178.6 | -42.5 | 0 | 0 | 0 | 0 | 110.9 | W121 I122 C123 G128 I129 | W121-T125 PolarHBondContact NE1-OG1 3.27Å; W121-T125 PolarHBondContact O-N 2.81Å; W121-T125 PolarHBondContact O-OG1 2.94Å; I122-T125 PolarHBondContact O-N 3.42Å; C123-T125 VanDerWaalsContact C-N 3.27Å; C123-T125 PolarHBondContact O-N 3.29Å; T125-G128 PolarHBondContact O-N 3.43Å; T125-I129 HydrophobicContact CG2-CD1 4.08Å; T125-I129 WeakPolarHBondContact O-CB 3.33Å; T125-I129 VanDerWaalsContact O-CG1 3.24Å; T125-I129 WeakPolarHBondContact O-CG1 3.43Å; T125-I129 PolarHBondContact O-N 3.43Å |
| 126 | V | 85.2 | Confident | 81.7 | Confident | 74 Ų | 74 | 62.2 Ų | 62.2 | 45% | 0.448 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -63.7 | -48 | 177.9 | 173.7 | 0 | 0 | 0 | 0 | 110.8 | I122 C123 G128 I129 I130 | I122-V126 HydrophobicContact CG2-CG2 4.39Å; I122-V126 WeakPolarHBondContact O-CG2 3.36Å; I122-V126 PolarHBondContact O-N 3.46Å; C123-V126 PolarHBondContact O-N 2.89Å; V126-G128 VanDerWaalsContact C-N 3.32Å; V126-G128 PolarHBondContact O-N 2.91Å; V126-I129 PolarHBondContact O-N 3.07Å; V126-I130 HydrophobicContact CG1-CD1 3.74Å; V126-I130 HydrophobicContact CG1-CG1 4.42Å; V126-I130 VanDerWaalsContact O-CG1 3.31Å; V126-I130 WeakPolarHBondContact O-CG1 3.43Å; V126-I130 PolarHBondContact O-N 3.43Å |
| 127 | V | 81.7 | Confident | 81.1 | Confident | 60 Ų | 60 | 57.6 Ų | 57.6 | 36% | 0.364 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -61 | -42.6 | 176.3 | 174.3 | 0 | 0 | 0 | 0 | 110.8 | C123 I129 I130 L131 | C123-V127 WeakPolarHBondContact O-CG2 3.34Å; C123-V127 PolarHBondContact O-N 2.85Å; V127-I129 PolarHBondContact O-N 3.38Å; V127-I130 PolarHBondContact O-N 2.97Å; V127-L131 HydrophobicContact CG1-CD1 3.74Å; V127-L131 HydrophobicContact CG1-CG 4.36Å; V127-L131 WeakPolarHBondContact O-CB 3.44Å; V127-L131 VanDerWaalsContact O-CG 3.31Å; V127-L131 WeakPolarHBondContact O-CG 3.38Å; V127-L131 PolarHBondContact O-N 3.39Å |
| 128 | G | 82.4 | Confident | 80.2 | Confident | 11 Ų | 11 | 59.1 Ų | 59.1 | 11% | 0.113 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -60.5 | -42.7 | 175.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | S124 T125 V126 F132 | S124-G128 PolarHBondContact O-N 2.84Å; T125-G128 PolarHBondContact O-N 3.43Å; V126-G128 VanDerWaalsContact C-N 3.32Å; V126-G128 PolarHBondContact O-N 2.91Å; G128-F132 VanDerWaalsContact O-CB 3.28Å; G128-F132 WeakPolarHBondContact O-CB 3.42Å; G128-F132 PolarHBondContact O-N 3.25Å |
| 129 | I | 82.9 | Confident | 79.5 | Confident | 93 Ų | 93 | 61 Ų | 61 | 48% | 0.477 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -67.6 | -45 | 177 | -69.3 | 166 | 0 | 0 | 0 | 111.1 | T125 V126 V127 L131 F132 L133 | T125-I129 HydrophobicContact CG2-CD1 4.08Å; T125-I129 WeakPolarHBondContact O-CB 3.33Å; T125-I129 VanDerWaalsContact O-CG1 3.24Å; T125-I129 WeakPolarHBondContact O-CG1 3.43Å; T125-I129 PolarHBondContact O-N 3.43Å; V126-I129 PolarHBondContact O-N 3.07Å; V127-I129 PolarHBondContact O-N 3.38Å; I129-L131 VanDerWaalsContact C-N 3.34Å; I129-L131 PolarHBondContact O-N 3.35Å; I129-F132 PolarHBondContact O-N 3.22Å; I129-L133 HydrophobicContact CG2-CD1 3.9Å; I129-L133 HydrophobicContact CG2-CG 4.38Å; I129-L133 WeakPolarHBondContact O-CB 3.42Å; I129-L133 WeakPolarHBondContact O-CG 3.39Å; I129-L133 PolarHBondContact O-N 3.41Å |
| 130 | I | 83 | Confident | 78.5 | Confident | 104 Ų | 104 | 59.8 Ų | 59.8 | 53% | 0.533 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -61.1 | -45.5 | 178.6 | -69.8 | 169.6 | 0 | 0 | 0 | 110.3 | V126 V127 L133 A134 | V126-I130 HydrophobicContact CG1-CD1 3.74Å; V126-I130 HydrophobicContact CG1-CG1 4.42Å; V126-I130 VanDerWaalsContact O-CG1 3.31Å; V126-I130 WeakPolarHBondContact O-CG1 3.43Å; V126-I130 PolarHBondContact O-N 3.43Å; V127-I130 PolarHBondContact O-N 2.97Å; I130-L133 PolarHBondContact O-N 3.39Å; I130-A134 VanDerWaalsContact O-CB 3.25Å; I130-A134 WeakPolarHBondContact O-CB 3.41Å; I130-A134 PolarHBondContact O-N 3.11Å |
| 131 | L | 77.3 | Confident | 77.1 | Confident | 57 Ų | 57 | 59.6 Ų | 59.6 | 30% | 0.298 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -65.8 | -41.4 | 177.2 | -71.8 | 170.7 | 0 | 0 | 0 | 111.8 | L74 V127 I129 A134 V135 | L74-L131 HydrophobicContact CD1-CB 3.53Å; L74-L131 HydrophobicContact CD1-CD1 3.7Å; L74-L131 HydrophobicContact CD1-CG 4.27Å; L74-L131 HydrophobicContact CD2-CD1 3.82Å; L74-L131 HydrophobicContact CG-CD1 4.32Å; V127-L131 HydrophobicContact CG1-CD1 3.74Å; V127-L131 HydrophobicContact CG1-CG 4.36Å; V127-L131 WeakPolarHBondContact O-CB 3.44Å; V127-L131 VanDerWaalsContact O-CG 3.31Å; V127-L131 WeakPolarHBondContact O-CG 3.38Å; V127-L131 PolarHBondContact O-N 3.39Å; I129-L131 VanDerWaalsContact C-N 3.34Å; I129-L131 PolarHBondContact O-N 3.35Å; L131-A134 PolarHBondContact O-N 2.85Å; L131-V135 WeakPolarHBondContact O-CB 3.38Å; L131-V135 VanDerWaalsContact O-CG2 3.23Å; L131-V135 WeakPolarHBondContact O-CG2 3.07Å; L131-V135 PolarHBondContact O-N 3.34Å |
| 132 | F | 80 | Confident | 75.8 | Confident | 53 Ų | 53 | 63 Ų | 63 | 23% | 0.232 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -59.6 | -47.8 | 174.9 | 178.1 | -115.5 | 0 | 0 | 0 | 112 | L40 L71 G128 I129 V135 L136 | L40-F132 HydrophobicContact CD2-CD2 4.24Å; L40-F132 HydrophobicContact CD2-CE2 3.57Å; L40-F132 HydrophobicContact CD2-CZ 4.26Å; L71-F132 HydrophobicContact CD1-CB 4.4Å; L71-F132 HydrophobicContact CD1-CD2 3.44Å; L71-F132 VanDerWaalsContact CD1-CD2 3.44Å; L71-F132 HydrophobicContact CD1-CE2 4.1Å; L71-F132 HydrophobicContact CD1-CG 4.31Å; L71-F132 HydrophobicContact CD2-CD2 4.01Å; L71-F132 HydrophobicContact CD2-CE2 4Å; L71-F132 HydrophobicContact CG-CD2 4.35Å; G128-F132 VanDerWaalsContact O-CB 3.28Å; G128-F132 WeakPolarHBondContact O-CB 3.42Å; G128-F132 PolarHBondContact O-N 3.25Å; I129-F132 PolarHBondContact O-N 3.22Å; F132-V135 PolarHBondContact O-N 2.88Å; F132-L136 HydrophobicContact CD1-CD1 4.1Å; F132-L136 HydrophobicContact CD2-CD1 4.48Å; F132-L136 HydrophobicContact CE1-CD1 3.58Å; F132-L136 HydrophobicContact CE2-CD1 4.03Å; F132-L136 HydrophobicContact CE2-CD2 4.46Å; F132-L136 HydrophobicContact CE2-CG 4.2Å; F132-L136 HydrophobicContact CZ-CD1 3.57Å; F132-L136 HydrophobicContact CZ-CG 4.24Å; F132-L136 WeakPolarHBondContact O-CG 2.96Å; F132-L136 PolarHBondContact O-N 2.92Å |
| 133 | L | 80.9 | Confident | 74.3 | Confident | 97 Ų | 97 | 64.3 Ų | 64.3 | 51% | 0.508 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -62.8 | -45.9 | 176.2 | -72.9 | 172.2 | 0 | 0 | 0 | 111.5 | I129 I130 V135 L136 V137 | I129-L133 HydrophobicContact CG2-CD1 3.9Å; I129-L133 HydrophobicContact CG2-CG 4.38Å; I129-L133 WeakPolarHBondContact O-CB 3.42Å; I129-L133 WeakPolarHBondContact O-CG 3.39Å; I129-L133 PolarHBondContact O-N 3.41Å; I130-L133 PolarHBondContact O-N 3.39Å; L133-V135 VanDerWaalsContact C-N 3.3Å; L133-V135 PolarHBondContact O-N 3.33Å; L133-L136 PolarHBondContact O-N 2.95Å; L133-V137 WeakPolarHBondContact O-CB 3.48Å; L133-V137 VanDerWaalsContact O-CG2 3.25Å; L133-V137 WeakPolarHBondContact O-CG2 3.2Å; L133-V137 PolarHBondContact O-N 3.44Å |
| 134 | A | 73.8 | Confident | 72.6 | Confident | 23 Ų | 23 | 63.3 Ų | 63.3 | 19% | 0.19 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -61.4 | -38.3 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | I130 L131 C138 I159 | I130-A134 VanDerWaalsContact O-CB 3.25Å; I130-A134 WeakPolarHBondContact O-CB 3.41Å; I130-A134 PolarHBondContact O-N 3.11Å; L131-A134 PolarHBondContact O-N 2.85Å; A134-C138 VanDerWaalsContact O-CB 3.26Å; A134-C138 WeakPolarHBondContact O-CB 3.26Å; A134-C138 PolarHBondContact O-N 3.29Å; A134-I159 HydrophobicContact CB-CD1 4.37Å |
| 135 | V | 71.1 | Confident | 71.2 | Confident | 31 Ų | 31 | 69.9 Ų | 69.9 | 19% | 0.188 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -69.6 | -44 | 177.4 | 168.6 | 0 | 0 | 0 | 0 | 111.6 | A67 L131 F132 L133 V137 C138 H139 | A67-V135 HydrophobicContact CB-CG1 3.43Å; A67-V135 VanDerWaalsContact CB-CG1 3.43Å; L131-V135 WeakPolarHBondContact O-CB 3.38Å; L131-V135 VanDerWaalsContact O-CG2 3.23Å; L131-V135 WeakPolarHBondContact O-CG2 3.07Å; L131-V135 PolarHBondContact O-N 3.34Å; F132-V135 PolarHBondContact O-N 2.88Å; L133-V135 VanDerWaalsContact C-N 3.3Å; L133-V135 PolarHBondContact O-N 3.33Å; V135-V137 VanDerWaalsContact C-N 3.31Å; V135-V137 PolarHBondContact O-N 3.23Å; V135-C138 PolarHBondContact O-N 3.5Å; V135-H139 WeakPolarHBondContact O-CB 3.45Å; V135-H139 PolarHBondContact O-N 3.03Å |
| 136 | L | 72.4 | Confident | 69.9 | Low | 76 Ų | 76 | 75.1 Ų | 75.1 | 40% | 0.398 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -60.8 | -41.8 | 174.7 | -72.9 | 177.4 | 0 | 0 | 0 | 111.9 | F132 L133 H139 S140 | F132-L136 HydrophobicContact CD1-CD1 4.1Å; F132-L136 HydrophobicContact CD2-CD1 4.48Å; F132-L136 HydrophobicContact CE1-CD1 3.58Å; F132-L136 HydrophobicContact CE2-CD1 4.03Å; F132-L136 HydrophobicContact CE2-CD2 4.46Å; F132-L136 HydrophobicContact CE2-CG 4.2Å; F132-L136 HydrophobicContact CZ-CD1 3.57Å; F132-L136 HydrophobicContact CZ-CG 4.24Å; F132-L136 WeakPolarHBondContact O-CG 2.96Å; F132-L136 PolarHBondContact O-N 2.92Å; L133-L136 PolarHBondContact O-N 2.95Å; L136-H139 PolarHBondContact O-N 3.19Å; L136-S140 WeakPolarHBondContact O-CB 3.31Å; L136-S140 PolarHBondContact O-N 3.41Å; L136-S140 PolarHBondContact O-OG 2.92Å |
| 137 | V | 73.4 | Confident | 68.5 | Low | 56 Ų | 56 | 76.3 Ų | 76.3 | 34% | 0.339 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -64.6 | -41.7 | 174.7 | 172.9 | 0 | 0 | 0 | 0 | 110.5 | L133 V135 S140 C141 | L133-V137 WeakPolarHBondContact O-CB 3.48Å; L133-V137 VanDerWaalsContact O-CG2 3.25Å; L133-V137 WeakPolarHBondContact O-CG2 3.2Å; L133-V137 PolarHBondContact O-N 3.44Å; V135-V137 VanDerWaalsContact C-N 3.31Å; V135-V137 PolarHBondContact O-N 3.23Å; V137-S140 WeakPolarHBondContact CA-OG 3.31Å; V137-S140 PolarHBondContact O-OG 3.44Å; V137-S140 VanDerWaalsContact O-OG 3.08Å; V137-C141 WeakPolarHBondContact O-CB 3.43Å; V137-C141 PolarHBondContact O-N 3.21Å |
| 138 | C | 66 | Low | 67.3 | Low | 55 Ų | 55 | 76.6 Ų | 76.6 | 37% | 0.372 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -65.7 | -43.3 | 177.3 | -169 | 0 | 0 | 0 | 0 | 112.2 | A134 V135 C141 N142 | A134-C138 VanDerWaalsContact O-CB 3.26Å; A134-C138 WeakPolarHBondContact O-CB 3.26Å; A134-C138 PolarHBondContact O-N 3.29Å; V135-C138 PolarHBondContact O-N 3.5Å; C138-C141 PolarHBondContact O-N 2.99Å; C138-N142 PolarHBondContact O-N 2.81Å; C138-N142 PolarHBondContact O-ND2 2.95Å |
| 139 | H | 66.4 | Low | 65.9 | Low | 99 Ų | 99 | 82.9 Ų | 82.9 | 46% | 0.458 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -61.1 | -52.5 | 176.2 | 178 | -90.6 | 0 | 0 | 0 | 111.5 | L64 V135 L136 C141 N142 N143 | L64-H139 WeakPolarHBondContact CD1-NE2 3.44Å; V135-H139 WeakPolarHBondContact O-CB 3.45Å; V135-H139 PolarHBondContact O-N 3.03Å; L136-H139 PolarHBondContact O-N 3.19Å; H139-C141 PolarHBondContact O-N 3.33Å; H139-N142 PolarHBondContact O-N 3.09Å; H139-N143 PolarHBondContact O-N 3.22Å |
| 140 | S | 64.5 | Low | 64.7 | Low | 60 Ų | 60 | 82.7 Ų | 82.7 | 42% | 0.42 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -62.3 | -32.7 | 176 | 50.8 | 0 | 0 | 0 | 0 | 112.1 | L136 V137 N143 C144 | L136-S140 WeakPolarHBondContact O-CB 3.31Å; L136-S140 PolarHBondContact O-N 3.41Å; L136-S140 PolarHBondContact O-OG 2.92Å; V137-S140 WeakPolarHBondContact CA-OG 3.31Å; V137-S140 PolarHBondContact O-OG 3.44Å; V137-S140 VanDerWaalsContact O-OG 3.08Å; S140-N143 PolarHBondContact O-N 3Å; S140-C144 PolarHBondContact O-N 3.32Å; S140-C144 PolarHBondContact O-SG 2.84Å; S140-C144 VanDerWaalsContact O-SG 3.39Å |
| 141 | C | 57.4 | Low | 63.4 | Low | 33 Ų | 33 | 85.7 Ų | 85.7 | 22% | 0.223 | 49% | 0.485 | C | S | . | . | H | α-helix | trans | -71.2 | -29.7 | 177.4 | -164.5 | 0 | 0 | 0 | 0 | 113.8 | V137 C138 H139 C144 F145 F152 | V137-C141 WeakPolarHBondContact O-CB 3.43Å; V137-C141 PolarHBondContact O-N 3.21Å; C138-C141 PolarHBondContact O-N 2.99Å; H139-C141 PolarHBondContact O-N 3.33Å; C141-C144 PolarHBondContact O-N 2.89Å; C141-F145 PolarHBondContact O-N 3.41Å; C141-F152 WeakPolarHBondContact SG-CB 3.48Å |
| 142 | N | 54 | Low | 62.5 | Low | 110 Ų | 110 | 87.8 Ų | 87.8 | 59% | 0.588 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -65 | -41.8 | 171.4 | -76.7 | -67.7 | 0 | 0 | 0 | 110.8 | C138 H139 F145 | C138-N142 PolarHBondContact O-N 2.81Å; C138-N142 PolarHBondContact O-ND2 2.95Å; H139-N142 PolarHBondContact O-N 3.09Å; N142-F145 PolarHBondContact O-N 3.42Å |
| 143 | N | 54 | Low | 61.3 | Low | 112 Ų | 112 | 93.8 Ų | 93.8 | 60% | 0.599 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -66.9 | -35.9 | 173.2 | -163 | 63.4 | 0 | 0 | 0 | 112.2 | H139 S140 F145 D146 T147 | H139-N143 PolarHBondContact O-N 3.22Å; S140-N143 PolarHBondContact O-N 3Å; N143-F145 VanDerWaalsContact C-N 3.32Å; N143-F145 PolarHBondContact O-N 3.04Å; N143-D146 WeakPolarHBondContact O-CB 3.39Å; N143-D146 PolarHBondContact O-N 2.96Å; N143-T147 PolarHBondContact O-N 3.47Å |
| 144 | C | 52.1 | Low | 60.4 | Low | 57 Ų | 57 | 96.1 Ų | 96.1 | 39% | 0.385 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -70.9 | -22.7 | 174.3 | -74.3 | 0 | 0 | 0 | 0 | 113.8 | S140 C141 D146 T147 G148 | S140-C144 PolarHBondContact O-N 3.32Å; S140-C144 PolarHBondContact O-SG 2.84Å; S140-C144 VanDerWaalsContact O-SG 3.39Å; C141-C144 PolarHBondContact O-N 2.89Å; C144-D146 VanDerWaalsContact C-N 3.26Å; C144-T147 CarbonylContact O-C 3.06Å; C144-T147 WeakPolarHBondContact O-CA 3.45Å; C144-T147 PolarHBondContact O-N 3.39Å; C144-T147 VanDerWaalsContact O-N 3.14Å; C144-G148 PolarHBondContact O-N 3.3Å |
| 145 | F | 52.4 | Low | 60 | Low | 170 Ų | 170 | 100.8 Ų | 100.8 | 75% | 0.746 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -68.7 | -32.1 | 174.7 | -168.8 | -100.7 | 0 | 0 | 0 | 111.1 | C141 N142 N143 T147 | C141-F145 PolarHBondContact O-N 3.41Å; N142-F145 PolarHBondContact O-N 3.42Å; N143-F145 VanDerWaalsContact C-N 3.32Å; N143-F145 PolarHBondContact O-N 3.04Å; F145-T147 PolarHBondContact O-N 3.44Å |
| 146 | D | 56.6 | Low | 59.6 | Low | 146 Ų | 146 | 106.6 Ų | 106.6 | 78% | 0.781 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -67.7 | -30.1 | 171.1 | -150.2 | 19.8 | 0 | 0 | 0 | 111.3 | N143 C144 | N143-D146 WeakPolarHBondContact O-CB 3.39Å; N143-D146 PolarHBondContact O-N 2.96Å; C144-D146 VanDerWaalsContact C-N 3.26Å |
| 147 | T | 56.8 | Low | 59.4 | Low | 99 Ų | 99 | 108.4 Ų | 108.4 | 61% | 0.607 | 56% | 0.562 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.1 | 52.4 | 174.6 | -35.8 | 0 | 0 | 0 | 0 | 112.6 | N143 C144 F145 H149 | N143-T147 PolarHBondContact O-N 3.47Å; C144-T147 CarbonylContact O-C 3.06Å; C144-T147 WeakPolarHBondContact O-CA 3.45Å; C144-T147 PolarHBondContact O-N 3.39Å; C144-T147 VanDerWaalsContact O-N 3.14Å; F145-T147 PolarHBondContact O-N 3.44Å; T147-H149 PolarHBondContact O-CD2 3.15Å; T147-H149 PolarHBondContact O-N 3.28Å; T147-H149 VanDerWaalsContact O-N 3.11Å |
| 148 | G | 55.4 | Low | 59.3 | Low | 67 Ų | 67 | 110.5 Ų | 110.5 | 69% | 0.691 | 57% | 0.57 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 62 | 24.3 | 145.1 | 0 | 0 | 0 | 0 | 0 | 122.3 | C144 | C144-G148 PolarHBondContact O-N 3.3Š|
| 149 | H | 52.7 | Low | 59.4 | Low | 143 Ų | 143 | 110.6 Ų | 110.6 | 66% | 0.662 | 57% | 0.567 | S | S | * | * | trans | -121.7 | 107.2 | 175.9 | -76.5 | -92.4 | 0 | 0 | 0 | 115.2 | T147 H151 | T147-H149 PolarHBondContact O-CD2 3.15Å; T147-H149 PolarHBondContact O-N 3.28Å; T147-H149 VanDerWaalsContact O-N 3.11Å; H149-H151 VanDerWaalsContact C-N 3.32Å; H149-H151 PolarHBondContact O-N 2.76Å | ||
| 150 | A | 58.3 | Low | 59.6 | Low | 89 Ų | 89 | 111.6 Ų | 111.6 | 74% | 0.736 | 58% | 0.575 | S | S | * | * | G | 310 helix | trans | -67.9 | -11.2 | -173.2 | 0 | 0 | 0 | 0 | 0 | 117 | F152 | A150-F152 VanDerWaalsContact C-N 3.29Å; A150-F152 PolarHBondContact O-N 3.22Å |
| 151 | H | 56.5 | Low | 60.1 | Low | 166 Ų | 166 | 111.6 Ų | 111.6 | 77% | 0.769 | 58% | 0.575 | S | S | * | * | G | 310 helix | trans | -69.7 | -19.7 | -173.2 | -86.6 | -99.4 | 0 | 0 | 0 | 114.6 | H149 R153 | H149-H151 VanDerWaalsContact C-N 3.32Å; H149-H151 PolarHBondContact O-N 2.76Å; H151-R153 PolarHBondContact O-N 2.94Å |
| 152 | F | 57 | Low | 60.6 | Low | 102 Ų | 102 | 113.8 Ų | 113.8 | 45% | 0.447 | 59% | 0.589 | S | S | . | * | G | 310 helix | trans | -86 | -3.4 | -174.3 | -76.4 | -86.4 | 0 | 0 | 0 | 115.3 | C141 A150 H154 F155 R156 | C141-F152 WeakPolarHBondContact SG-CB 3.48Å; A150-F152 VanDerWaalsContact C-N 3.29Å; A150-F152 PolarHBondContact O-N 3.22Å; F152-H154 PolarHBondContact O-N 3.14Å; F152-F155 PolarHBondContact O-N 3.47Å; F152-R156 PolarHBondContact O-N 3.35Å |
| 153 | R | 55.4 | Low | 61.2 | Low | 179 Ų | 179 | 111.1 Ų | 111.1 | 68% | 0.675 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -60.5 | -32.6 | 177.5 | -175.4 | 170 | 175 | 169.2 | -2.5 | 112.9 | H151 H157 | H151-R153 PolarHBondContact O-N 2.94Å; R153-H157 PolarHBondContact O-N 3.48Å |
| 154 | H | 61.9 | Low | 62.2 | Low | 146 Ų | 146 | 114.4 Ų | 114.4 | 68% | 0.676 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -71.4 | -37.6 | 179.8 | -67.6 | -54.2 | 0 | 0 | 0 | 113 | F152 R156 H157 I158 | F152-H154 PolarHBondContact O-N 3.14Å; H154-R156 VanDerWaalsContact C-N 3.33Å; H154-R156 PolarHBondContact O-N 3.07Å; H154-H157 PolarHBondContact O-N 3.44Å; H154-I158 PolarHBondContact O-N 3.35Å; H154-I158 VanDerWaalsContact O-N 3.12Å |
| 155 | F | 66.3 | Low | 63.3 | Low | 121 Ų | 121 | 120.3 Ų | 120.3 | 53% | 0.531 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -66.1 | -38.3 | 178.6 | -124.2 | -93.3 | 0 | 0 | 0 | 111.5 | F152 H157 I158 I159 | F152-F155 PolarHBondContact O-N 3.47Å; F155-H157 VanDerWaalsContact C-N 3.31Å; F155-H157 PolarHBondContact O-N 3.29Å; F155-I158 PolarHBondContact O-N 2.91Å; F155-I159 HydrophobicContact CD1-CD1 4.11Å; F155-I159 WeakPolarHBondContact O-CG1 3.47Å; F155-I159 PolarHBondContact O-N 3.23Å |
| 156 | R | 62.2 | Low | 64.2 | Low | 152 Ų | 152 | 118.7 Ų | 118.7 | 57% | 0.574 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -60.2 | -39.3 | 174.3 | -159 | -179.9 | 83.2 | -161.8 | 7.7 | 112.3 | F152 H154 L160 | F152-R156 PolarHBondContact O-N 3.35Å; H154-R156 VanDerWaalsContact C-N 3.33Å; H154-R156 PolarHBondContact O-N 3.07Å; R156-L160 WeakPolarHBondContact O-CB 3.49Å; R156-L160 PolarHBondContact O-N 3.33Å |
| 157 | H | 68.6 | Low | 64.9 | Low | 114 Ų | 114 | 120.3 Ų | 120.3 | 53% | 0.528 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -68.2 | -40.8 | 177.2 | -107.6 | -89.5 | 0 | 0 | 0 | 112.7 | R153 H154 F155 I159 L160 S161 | R153-H157 PolarHBondContact O-N 3.48Å; H154-H157 PolarHBondContact O-N 3.44Å; F155-H157 VanDerWaalsContact C-N 3.31Å; F155-H157 PolarHBondContact O-N 3.29Å; H157-I159 VanDerWaalsContact C-N 3.34Å; H157-L160 PolarHBondContact O-N 3.04Å; H157-S161 WeakPolarHBondContact O-CB 3.48Å; H157-S161 PolarHBondContact O-N 3.32Å |
| 158 | I | 71.5 | Confident | 65.2 | Low | 100 Ų | 100 | 122.3 Ų | 122.3 | 51% | 0.513 | 62% | 0.623 | S | S | . | * | H | α-helix | trans | -62.6 | -43.1 | 176.2 | -77 | 165 | 0 | 0 | 0 | 110.7 | H154 F155 S161 C162 | H154-I158 PolarHBondContact O-N 3.35Å; H154-I158 VanDerWaalsContact O-N 3.12Å; F155-I158 PolarHBondContact O-N 2.91Å; I158-S161 PolarHBondContact O-N 3.5Å; I158-C162 WeakPolarHBondContact O-CB 3.14Å; I158-C162 PolarHBondContact O-N 3.41Å |
| 159 | I | 68 | Low | 65.7 | Low | 57 Ų | 57 | 125.1 Ų | 125.1 | 29% | 0.292 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -67.1 | -44.1 | 178.7 | -67.3 | 162.7 | 0 | 0 | 0 | 111.2 | A134 F155 H157 S161 C162 A163 | A134-I159 HydrophobicContact CB-CD1 4.37Å; F155-I159 HydrophobicContact CD1-CD1 4.11Å; F155-I159 WeakPolarHBondContact O-CG1 3.47Å; F155-I159 PolarHBondContact O-N 3.23Å; H157-I159 VanDerWaalsContact C-N 3.34Å; I159-S161 VanDerWaalsContact C-N 3.26Å; I159-S161 PolarHBondContact O-N 3.36Å; I159-C162 PolarHBondContact O-N 3.23Å; I159-A163 WeakPolarHBondContact O-CB 3.39Å; I159-A163 PolarHBondContact O-N 3.48Å |
| 160 | L | 69.9 | Low | 66.4 | Low | 121 Ų | 121 | 124.2 Ų | 124.2 | 63% | 0.634 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -61.8 | -38.9 | 175.2 | -167.7 | 73.4 | 0 | 0 | 0 | 111.1 | R156 H157 A163 Y164 | R156-L160 WeakPolarHBondContact O-CB 3.49Å; R156-L160 PolarHBondContact O-N 3.33Å; H157-L160 PolarHBondContact O-N 3.04Å; L160-A163 PolarHBondContact O-N 3.41Å; L160-Y164 WeakPolarHBondContact O-CB 3.4Å; L160-Y164 PolarHBondContact O-N 2.87Å |
| 161 | S | 74.1 | Confident | 66.8 | Low | 59 Ų | 59 | 126.1 Ų | 126.1 | 41% | 0.413 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -65.6 | -46.3 | 175.8 | -163.3 | 0 | 0 | 0 | 0 | 111.1 | H157 I158 I159 A163 Y164 Y165 | H157-S161 WeakPolarHBondContact O-CB 3.48Å; H157-S161 PolarHBondContact O-N 3.32Å; I158-S161 PolarHBondContact O-N 3.5Å; I159-S161 VanDerWaalsContact C-N 3.26Å; I159-S161 PolarHBondContact O-N 3.36Å; S161-A163 VanDerWaalsContact C-N 3.34Å; S161-A163 PolarHBondContact O-N 2.97Å; S161-Y164 PolarHBondContact O-N 3.16Å; S161-Y165 WeakPolarHBondContact O-CB 3.43Å; S161-Y165 VanDerWaalsContact O-CD2 3.29Å; S161-Y165 WeakPolarHBondContact O-CD2 3.31Å; S161-Y165 PolarHBondContact O-N 3.08Å |
| 162 | C | 68.9 | Low | 67.5 | Low | 79 Ų | 79 | 123.8 Ų | 123.8 | 53% | 0.534 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -60.2 | -40.8 | 174.1 | -80.2 | 0 | 0 | 0 | 0 | 112.7 | I158 I159 Y165 L166 | I158-C162 WeakPolarHBondContact O-CB 3.14Å; I158-C162 PolarHBondContact O-N 3.41Å; I159-C162 PolarHBondContact O-N 3.23Å; C162-Y165 PolarHBondContact O-N 3.47Å; C162-L166 WeakPolarHBondContact O-CB 3.23Å; C162-L166 PolarHBondContact O-N 2.91Å |
| 163 | A | 66.1 | Low | 68.1 | Low | 54 Ų | 54 | 125.1 Ų | 125.1 | 45% | 0.446 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -65.3 | -40.4 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | I159 L160 S161 L166 Q167 | I159-A163 WeakPolarHBondContact O-CB 3.39Å; I159-A163 PolarHBondContact O-N 3.48Å; L160-A163 PolarHBondContact O-N 3.41Å; S161-A163 VanDerWaalsContact C-N 3.34Å; S161-A163 PolarHBondContact O-N 2.97Å; A163-L166 PolarHBondContact O-N 2.88Å; A163-Q167 PolarHBondContact O-N 3.31Å; A163-Q167 VanDerWaalsContact O-N 3.13Å |
| 164 | Y | 75.8 | Confident | 69 | Low | 182 Ų | 182 | 121.5 Ų | 121.5 | 71% | 0.714 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -65.6 | -39.4 | 174.8 | -160.6 | -87.2 | 0 | 0 | 0 | 111.9 | L160 S161 L166 Q167 S168 | L160-Y164 WeakPolarHBondContact O-CB 3.4Å; L160-Y164 PolarHBondContact O-N 2.87Å; S161-Y164 PolarHBondContact O-N 3.16Å; Y164-L166 VanDerWaalsContact C-N 3.34Å; Y164-Q167 PolarHBondContact O-N 3.16Å; Y164-S168 PolarHBondContact O-N 3.46Å; Y164-S168 VanDerWaalsContact O-N 3.17Å |
| 165 | Y | 74.5 | Confident | 69.5 | Low | 181 Ų | 181 | 119.8 Ų | 119.8 | 71% | 0.71 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -66.7 | -32.2 | 174.5 | -94.7 | -79 | 0 | 0 | 0 | 113.2 | S161 C162 | S161-Y165 WeakPolarHBondContact O-CB 3.43Å; S161-Y165 VanDerWaalsContact O-CD2 3.29Å; S161-Y165 WeakPolarHBondContact O-CD2 3.31Å; S161-Y165 PolarHBondContact O-N 3.08Å; C162-Y165 PolarHBondContact O-N 3.47Å |
| 166 | L | 71.6 | Confident | 69.7 | Low | 135 Ų | 135 | 119.7 Ų | 119.7 | 71% | 0.707 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -79 | -23.8 | 178.6 | -167.1 | 67.5 | 0 | 0 | 0 | 112.4 | C162 A163 Y164 | C162-L166 WeakPolarHBondContact O-CB 3.23Å; C162-L166 PolarHBondContact O-N 2.91Å; A163-L166 PolarHBondContact O-N 2.88Å; Y164-L166 VanDerWaalsContact C-N 3.34Å |
| 167 | Q | 70.6 | Confident | 70.3 | Confident | 180 Ų | 180 | 117 Ų | 117 | 84% | 0.841 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -89.2 | -15.4 | 177.5 | -170.6 | 137.8 | -38 | 0 | 0 | 113.6 | A163 Y164 | A163-Q167 PolarHBondContact O-N 3.31Å; A163-Q167 VanDerWaalsContact O-N 3.13Å; Y164-Q167 PolarHBondContact O-N 3.16Å |
| 168 | S | 64.3 | Low | 70.5 | Confident | 142 Ų | 142 | 117.3 Ų | 117.3 | 99% | 0.993 | 62% | 0.618 | S | S | * | * | trans | -93.7 | 0 | 175.3 | -171 | 0 | 0 | 0 | 0 | 112.4 | Y164 | Y164-S168 PolarHBondContact O-N 3.46Å; Y164-S168 VanDerWaalsContact O-N 3.17Å |
Retrieved 168 of 168 residues in 36.4 ms
(Link to these results)