| 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 | G | 54.7 | Low | 69.2 | Low | 98 Ų | 98 | 116.1 Ų | 116.1 | 100% | 1.01 | 62% | 0.624 | S | S | * | * | 0 | -68.4 | 0 | 0 | 0 | 0 | 0 | 0 | 112.4 | |||||
| 2 | R | 57.5 | Low | 69.7 | Low | 220 Ų | 220 | 111.3 Ų | 111.3 | 83% | 0.83 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -67.5 | -41.3 | -171.7 | -69.4 | -169.8 | -89 | -122.5 | 2.6 | 115.1 | S4 I5 E6 | R2-S4 VanDerWaalsContact C-N 3.34Å; R2-S4 PolarHBondContact O-N 3.41Å; R2-I5 PolarHBondContact O-N 3.23Å; R2-E6 PolarHBondContact O-N 3.33Å |
| 3 | C | 59 | Low | 70.5 | Confident | 111 Ų | 111 | 105.2 Ų | 105.2 | 75% | 0.75 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -64.9 | -29.8 | -176.5 | -52.2 | 0 | 0 | 0 | 0 | 115 | F7 | C3-F7 PolarHBondContact O-N 3.21Å |
| 4 | S | 69.7 | Low | 71 | Confident | 79 Ų | 79 | 107 Ų | 107 | 55% | 0.552 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -76.6 | -26.3 | 179.3 | -54 | 0 | 0 | 0 | 0 | 112.8 | R2 L8 | R2-S4 VanDerWaalsContact C-N 3.34Å; R2-S4 PolarHBondContact O-N 3.41Å; S4-L8 WeakPolarHBondContact O-CB 3.24Å; S4-L8 WeakPolarHBondContact O-CD1 3.22Å; S4-L8 VanDerWaalsContact O-CG 3.25Å; S4-L8 WeakPolarHBondContact O-CG 3.4Å; S4-L8 PolarHBondContact O-N 3.42Å; S4-L8 VanDerWaalsContact O-N 3.09Å |
| 5 | I | 67.6 | Low | 71.5 | Confident | 73 Ų | 73 | 105.8 Ų | 105.8 | 37% | 0.374 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -74.1 | -42 | 179.7 | -57.6 | 174.6 | 0 | 0 | 0 | 109.7 | R2 F7 L8 Y9 | R2-I5 PolarHBondContact O-N 3.23Å; I5-F7 VanDerWaalsContact C-N 3.33Å; I5-F7 PolarHBondContact O-N 3.44Å; I5-L8 PolarHBondContact O-N 3.5Å; I5-Y9 WeakPolarHBondContact O-CB 3.39Å; I5-Y9 PolarHBondContact O-N 3.22Å |
| 6 | E | 75.3 | Confident | 72 | Confident | 141 Ų | 141 | 101.5 Ų | 101.5 | 66% | 0.659 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -57.2 | -45.7 | 173.4 | -63.2 | -64.6 | 141.8 | 0 | 0 | 111.7 | R2 Y9 S10 | R2-E6 PolarHBondContact O-N 3.33Å; E6-Y9 PolarHBondContact O-N 3.26Å; E6-S10 WeakPolarHBondContact O-CB 2.74Å; E6-S10 PolarHBondContact O-N 2.67Å |
| 7 | F | 76.3 | Confident | 72.5 | Confident | 137 Ų | 137 | 101.8 Ų | 101.8 | 60% | 0.601 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -66.7 | -39.8 | 179.4 | -169.2 | -106 | 0 | 0 | 0 | 112.7 | C3 I5 Y9 S10 I11 | C3-F7 PolarHBondContact O-N 3.21Å; I5-F7 VanDerWaalsContact C-N 3.33Å; I5-F7 PolarHBondContact O-N 3.44Å; F7-Y9 VanDerWaalsContact C-N 3.34Å; F7-S10 PolarHBondContact O-N 3.19Å; F7-I11 HydrophobicContact CD1-CD1 3.61Å; F7-I11 HydrophobicContact CD1-CG1 4.46Å; F7-I11 HydrophobicContact CE1-CD1 3.14Å; F7-I11 HydrophobicContact CE1-CG1 4.2Å; F7-I11 HydrophobicContact CE2-CD1 4.43Å; F7-I11 HydrophobicContact CG-CD1 4.44Å; F7-I11 HydrophobicContact CZ-CD1 3.62Å; F7-I11 HydrophobicContact CZ-CG1 4.36Å; F7-I11 PolarHBondContact O-N 3.41Å |
| 8 | L | 69.8 | Low | 72.7 | Confident | 84 Ų | 84 | 101.2 Ų | 101.2 | 44% | 0.44 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -62.2 | -43 | 173.7 | -76.9 | 168.2 | 0 | 0 | 0 | 111.4 | S4 I5 S10 I11 F12 | S4-L8 WeakPolarHBondContact O-CB 3.24Å; S4-L8 WeakPolarHBondContact O-CD1 3.22Å; S4-L8 VanDerWaalsContact O-CG 3.25Å; S4-L8 WeakPolarHBondContact O-CG 3.4Å; S4-L8 PolarHBondContact O-N 3.42Å; S4-L8 VanDerWaalsContact O-N 3.09Å; I5-L8 PolarHBondContact O-N 3.5Å; L8-S10 VanDerWaalsContact C-N 3.35Å; L8-I11 PolarHBondContact O-N 3.29Å; L8-F12 WeakPolarHBondContact O-CB 3.28Å; L8-F12 PolarHBondContact O-N 3.25Å |
| 9 | Y | 74 | Confident | 72.7 | Confident | 181 Ų | 181 | 96.7 Ų | 96.7 | 71% | 0.71 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -65.6 | -39.3 | 178.7 | -151.3 | -94.9 | 0 | 0 | 0 | 111.8 | I5 E6 F7 F12 G13 | I5-Y9 WeakPolarHBondContact O-CB 3.39Å; I5-Y9 PolarHBondContact O-N 3.22Å; E6-Y9 PolarHBondContact O-N 3.26Å; F7-Y9 VanDerWaalsContact C-N 3.34Å; Y9-F12 PolarHBondContact O-N 3.44Å; Y9-G13 PolarHBondContact O-N 3.15Å |
| 10 | S | 79.7 | Confident | 72.9 | Confident | 81 Ų | 81 | 96.1 Ų | 96.1 | 57% | 0.566 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -64.7 | -46.8 | 175.5 | -174.2 | 0 | 0 | 0 | 0 | 112.4 | E6 F7 L8 F12 G13 F14 | E6-S10 WeakPolarHBondContact O-CB 2.74Å; E6-S10 PolarHBondContact O-N 2.67Å; F7-S10 PolarHBondContact O-N 3.19Å; L8-S10 VanDerWaalsContact C-N 3.35Å; S10-F12 VanDerWaalsContact C-N 3.34Å; S10-F12 PolarHBondContact O-N 2.96Å; S10-G13 PolarHBondContact O-N 3.24Å; S10-F14 WeakPolarHBondContact O-CB 3.3Å; S10-F14 PolarHBondContact O-N 3.26Å |
| 11 | I | 77.6 | Confident | 73.1 | Confident | 72 Ų | 72 | 96 Ų | 96 | 37% | 0.369 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -61.7 | -42.8 | 175 | -77.3 | 174.9 | 0 | 0 | 0 | 111.1 | F7 L8 F14 N15 | F7-I11 HydrophobicContact CD1-CD1 3.61Å; F7-I11 HydrophobicContact CD1-CG1 4.46Å; F7-I11 HydrophobicContact CE1-CD1 3.14Å; F7-I11 HydrophobicContact CE1-CG1 4.2Å; F7-I11 HydrophobicContact CE2-CD1 4.43Å; F7-I11 HydrophobicContact CG-CD1 4.44Å; F7-I11 HydrophobicContact CZ-CD1 3.62Å; F7-I11 HydrophobicContact CZ-CG1 4.36Å; F7-I11 PolarHBondContact O-N 3.41Å; L8-I11 PolarHBondContact O-N 3.29Å; I11-F14 PolarHBondContact O-N 2.87Å; I11-N15 PolarHBondContact O-N 2.86Å; I11-N15 PolarHBondContact O-ND2 3.43Å |
| 12 | F | 75.6 | Confident | 74.1 | Confident | 58 Ų | 58 | 95 Ų | 95 | 25% | 0.254 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -65.3 | -45.3 | 178.1 | -123.9 | -84.4 | 0 | 0 | 0 | 111.4 | L8 Y9 S10 F14 N15 V16 I54 V57 | L8-F12 WeakPolarHBondContact O-CB 3.28Å; L8-F12 PolarHBondContact O-N 3.25Å; Y9-F12 PolarHBondContact O-N 3.44Å; S10-F12 VanDerWaalsContact C-N 3.34Å; S10-F12 PolarHBondContact O-N 2.96Å; F12-F14 VanDerWaalsContact C-N 3.32Å; F12-F14 PolarHBondContact O-N 3.19Å; F12-N15 PolarHBondContact O-N 2.89Å; F12-V16 HydrophobicContact CD1-CG2 4.18Å; F12-V16 WeakPolarHBondContact O-CB 3.26Å; F12-V16 VanDerWaalsContact O-CG2 3.24Å; F12-V16 WeakPolarHBondContact O-CG2 3.1Å; F12-V16 PolarHBondContact O-N 2.88Å; F12-I54 HydrophobicContact CE1-CG1 4.35Å; F12-V57 HydrophobicContact CD1-CG2 4.16Å; F12-V57 HydrophobicContact CD2-CG1 4.41Å; F12-V57 HydrophobicContact CD2-CG2 4.42Å; F12-V57 HydrophobicContact CE1-CG2 3.4Å; F12-V57 VanDerWaalsContact CE1-CG2 3.4Å; F12-V57 HydrophobicContact CE2-CG1 4.28Å; F12-V57 HydrophobicContact CE2-CG2 3.7Å; F12-V57 HydrophobicContact CZ-CB 4.42Å; F12-V57 HydrophobicContact CZ-CG1 4.48Å; F12-V57 HydrophobicContact CZ-CG2 3.14Å |
| 13 | G | 80 | Confident | 74.8 | Confident | 33 Ų | 33 | 86.7 Ų | 86.7 | 34% | 0.34 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -56.9 | -45.1 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | Y9 S10 V16 L17 | Y9-G13 PolarHBondContact O-N 3.15Å; S10-G13 PolarHBondContact O-N 3.24Å; G13-V16 PolarHBondContact O-N 3.43Å; G13-L17 WeakPolarHBondContact O-CB 2.74Å; G13-L17 PolarHBondContact O-N 2.95Å |
| 14 | F | 76.8 | Confident | 75.6 | Confident | 130 Ų | 130 | 85.5 Ų | 85.5 | 57% | 0.57 | 45% | 0.448 | S | S | * | . | H | α-helix | trans | -64.8 | -44.8 | 177.3 | 179.4 | -102.3 | 0 | 0 | 0 | 112.7 | S10 I11 F12 V16 L17 L18 | S10-F14 WeakPolarHBondContact O-CB 3.3Å; S10-F14 PolarHBondContact O-N 3.26Å; I11-F14 PolarHBondContact O-N 2.87Å; F12-F14 VanDerWaalsContact C-N 3.32Å; F12-F14 PolarHBondContact O-N 3.19Å; F14-V16 VanDerWaalsContact C-N 3.31Å; F14-V16 PolarHBondContact O-N 3.43Å; F14-L17 PolarHBondContact O-N 3.07Å; F14-L18 HydrophobicContact CE1-CD2 4.11Å; F14-L18 HydrophobicContact CZ-CD2 4.38Å; F14-L18 VanDerWaalsContact O-CB 3.27Å; F14-L18 WeakPolarHBondContact O-CB 3.42Å; F14-L18 PolarHBondContact O-N 3.45Å |
| 15 | N | 79.5 | Confident | 75.6 | Confident | 89 Ų | 89 | 86.3 Ų | 86.3 | 48% | 0.476 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -63 | -37.5 | 177.1 | -82.4 | -82.9 | 0 | 0 | 0 | 112.1 | I11 F12 A19 | I11-N15 PolarHBondContact O-N 2.86Å; I11-N15 PolarHBondContact O-ND2 3.43Å; F12-N15 PolarHBondContact O-N 2.89Å; N15-A19 VanDerWaalsContact O-CB 3.29Å; N15-A19 WeakPolarHBondContact O-CB 3.39Å; N15-A19 PolarHBondContact O-N 3.2Å |
| 16 | V | 78.8 | Confident | 75.8 | Confident | 37 Ų | 37 | 85.7 Ų | 85.7 | 22% | 0.224 | 45% | 0.449 | C | S | . | . | H | α-helix | trans | -70.2 | -42.6 | 176.6 | 172.5 | 0 | 0 | 0 | 0 | 111.4 | F12 G13 F14 A19 L20 I54 | F12-V16 HydrophobicContact CD1-CG2 4.18Å; F12-V16 WeakPolarHBondContact O-CB 3.26Å; F12-V16 VanDerWaalsContact O-CG2 3.24Å; F12-V16 WeakPolarHBondContact O-CG2 3.1Å; F12-V16 PolarHBondContact O-N 2.88Å; G13-V16 PolarHBondContact O-N 3.43Å; F14-V16 VanDerWaalsContact C-N 3.31Å; F14-V16 PolarHBondContact O-N 3.43Å; V16-A19 PolarHBondContact O-N 3.42Å; V16-L20 HydrophobicContact CG1-CD1 4.09Å; V16-L20 WeakPolarHBondContact O-CB 3.31Å; V16-L20 PolarHBondContact O-N 3.39Å; V16-I54 HydrophobicContact CB-CD1 4.46Å; V16-I54 HydrophobicContact CG1-CD1 3.96Å; V16-I54 HydrophobicContact CG2-CD1 3.58Å; V16-I54 HydrophobicContact CG2-CG1 3.81Å |
| 17 | L | 79.9 | Confident | 75.4 | Confident | 107 Ų | 107 | 81.1 Ų | 81.1 | 56% | 0.56 | 43% | 0.428 | S | S | * | . | H | α-helix | trans | -60.5 | -45.5 | 173.2 | -104.3 | 160.7 | 0 | 0 | 0 | 111.4 | G13 F14 A19 L20 L21 | G13-L17 WeakPolarHBondContact O-CB 2.74Å; G13-L17 PolarHBondContact O-N 2.95Å; F14-L17 PolarHBondContact O-N 3.07Å; L17-A19 VanDerWaalsContact C-N 3.34Å; L17-A19 PolarHBondContact O-N 3.48Å; L17-L20 PolarHBondContact O-N 3.46Å; L17-L21 WeakPolarHBondContact O-CB 3.04Å; L17-L21 VanDerWaalsContact O-CG 3.27Å; L17-L21 WeakPolarHBondContact O-CG 3.43Å; L17-L21 PolarHBondContact O-N 3.47Å |
| 18 | L | 76.6 | Confident | 75 | Confident | 91 Ų | 91 | 79.3 Ų | 79.3 | 48% | 0.476 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -64.5 | -39.2 | 178.9 | -168.3 | 63.6 | 0 | 0 | 0 | 111.6 | F14 L21 C22 | F14-L18 HydrophobicContact CE1-CD2 4.11Å; F14-L18 HydrophobicContact CZ-CD2 4.38Å; F14-L18 VanDerWaalsContact O-CB 3.27Å; F14-L18 WeakPolarHBondContact O-CB 3.42Å; F14-L18 PolarHBondContact O-N 3.45Å; L18-L21 PolarHBondContact O-N 3.37Å; L18-C22 VanDerWaalsContact O-CB 3.31Å; L18-C22 WeakPolarHBondContact O-CB 3.47Å; L18-C22 PolarHBondContact O-N 3.49Å |
| 19 | A | 73.1 | Confident | 74.8 | Confident | 16 Ų | 16 | 79 Ų | 79 | 13% | 0.132 | 44% | 0.436 | C | S | . | . | H | α-helix | trans | -64.1 | -43.3 | 173.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | N15 V16 L17 C22 F23 F50 | N15-A19 VanDerWaalsContact O-CB 3.29Å; N15-A19 WeakPolarHBondContact O-CB 3.39Å; N15-A19 PolarHBondContact O-N 3.2Å; V16-A19 PolarHBondContact O-N 3.42Å; L17-A19 VanDerWaalsContact C-N 3.34Å; L17-A19 PolarHBondContact O-N 3.48Å; A19-C22 PolarHBondContact O-N 3.21Å; A19-F23 VanDerWaalsContact O-CB 3.27Å; A19-F23 WeakPolarHBondContact O-CB 3.11Å; A19-F23 PolarHBondContact O-N 3.2Å; A19-F50 HydrophobicContact CB-CD1 3.91Å; A19-F50 HydrophobicContact CB-CD2 4.23Å; A19-F50 HydrophobicContact CB-CE1 3.37Å; A19-F50 HydrophobicContact CB-CE2 3.76Å; A19-F50 HydrophobicContact CB-CG 4.32Å; A19-F50 HydrophobicContact CB-CZ 3.31Å |
| 20 | L | 75.8 | Confident | 74 | Confident | 84 Ų | 84 | 74.6 Ų | 74.6 | 44% | 0.44 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -63 | -43.3 | 174.6 | -97 | 153.1 | 0 | 0 | 0 | 111.8 | V16 L17 F23 L24 | V16-L20 HydrophobicContact CG1-CD1 4.09Å; V16-L20 WeakPolarHBondContact O-CB 3.31Å; V16-L20 PolarHBondContact O-N 3.39Å; L17-L20 PolarHBondContact O-N 3.46Å; L20-F23 WeakPolarHBondContact O-CB 3.43Å; L20-F23 PolarHBondContact O-N 3.26Å; L20-L24 WeakPolarHBondContact O-CB 3.28Å; L20-L24 WeakPolarHBondContact O-CG 3.09Å; L20-L24 PolarHBondContact O-N 3.36Å |
| 21 | L | 77.9 | Confident | 72.9 | Confident | 93 Ų | 93 | 74.3 Ų | 74.3 | 49% | 0.487 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -62.4 | -47.2 | 174.9 | -72.6 | 169.1 | 0 | 0 | 0 | 110.6 | L17 L18 F23 L24 T25 | L17-L21 WeakPolarHBondContact O-CB 3.04Å; L17-L21 VanDerWaalsContact O-CG 3.27Å; L17-L21 WeakPolarHBondContact O-CG 3.43Å; L17-L21 PolarHBondContact O-N 3.47Å; L18-L21 PolarHBondContact O-N 3.37Å; L21-F23 VanDerWaalsContact C-N 3.3Å; L21-F23 PolarHBondContact O-N 3.42Å; L21-L24 PolarHBondContact O-N 3.08Å; L21-L24 VanDerWaalsContact O-N 3.14Å; L21-T25 PolarHBondContact O-N 3.16Å; L21-T25 PolarHBondContact O-OG1 3.46Å |
| 22 | C | 76.3 | Confident | 71.9 | Confident | 77 Ų | 77 | 78.8 Ų | 78.8 | 52% | 0.52 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -59 | -41.8 | 175.9 | -174.2 | 0 | 0 | 0 | 0 | 112.2 | L18 A19 T25 T26 | L18-C22 VanDerWaalsContact O-CB 3.31Å; L18-C22 WeakPolarHBondContact O-CB 3.47Å; L18-C22 PolarHBondContact O-N 3.49Å; A19-C22 PolarHBondContact O-N 3.21Å; C22-T25 PolarHBondContact O-N 3.08Å; C22-T26 VanDerWaalsContact O-CB 3.31Å; C22-T26 WeakPolarHBondContact O-CB 3.24Å; C22-T26 PolarHBondContact O-N 3.45Å; C22-T26 PolarHBondContact O-OG1 2.99Å |
| 23 | F | 72.4 | Confident | 70.8 | Confident | 46 Ų | 46 | 80.1 Ų | 80.1 | 20% | 0.202 | 45% | 0.447 | C | S | . | . | H | α-helix | trans | -60.7 | -47.3 | 173.5 | 173 | -88 | 0 | 0 | 0 | 111.8 | A19 L20 L21 T26 F27 T43 L47 | A19-F23 VanDerWaalsContact O-CB 3.27Å; A19-F23 WeakPolarHBondContact O-CB 3.11Å; A19-F23 PolarHBondContact O-N 3.2Å; L20-F23 WeakPolarHBondContact O-CB 3.43Å; L20-F23 PolarHBondContact O-N 3.26Å; L21-F23 VanDerWaalsContact C-N 3.3Å; L21-F23 PolarHBondContact O-N 3.42Å; F23-T26 PolarHBondContact O-N 3.3Å; F23-F27 VanDerWaalsContact O-CB 3.25Å; F23-F27 WeakPolarHBondContact O-CB 3.4Å; F23-F27 PolarHBondContact O-N 3.3Å; F23-T43 HydrophobicContact CD2-CG2 3.82Å; F23-T43 HydrophobicContact CE2-CG2 3.43Å; F23-T43 VanDerWaalsContact CE2-CG2 3.43Å; F23-T43 VanDerWaalsContact CE2-O 3.27Å; F23-T43 WeakPolarHBondContact CE2-O 3.49Å; F23-T43 HydrophobicContact CZ-CG2 3.87Å; F23-L47 HydrophobicContact CD1-CD1 4.25Å; F23-L47 HydrophobicContact CD2-CB 4.48Å; F23-L47 HydrophobicContact CD2-CD1 4.17Å; F23-L47 HydrophobicContact CE1-CD1 3.8Å; F23-L47 HydrophobicContact CE2-CB 3.99Å; F23-L47 HydrophobicContact CE2-CD1 3.64Å; F23-L47 HydrophobicContact CE2-CG 4.44Å; F23-L47 HydrophobicContact CG-CD1 4.44Å; F23-L47 HydrophobicContact CZ-CD1 3.47Å; F23-L47 VanDerWaalsContact CZ-CD1 3.47Å |
| 24 | L | 74.6 | Confident | 69.8 | Low | 86 Ų | 86 | 86.2 Ų | 86.2 | 45% | 0.45 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -64 | -44.3 | 178.9 | -72.5 | 167.9 | 0 | 0 | 0 | 111.2 | L20 L21 T26 F27 V28 | L20-L24 WeakPolarHBondContact O-CB 3.28Å; L20-L24 WeakPolarHBondContact O-CG 3.09Å; L20-L24 PolarHBondContact O-N 3.36Å; L21-L24 PolarHBondContact O-N 3.08Å; L21-L24 VanDerWaalsContact O-N 3.14Å; L24-T26 VanDerWaalsContact C-N 3.32Å; L24-T26 PolarHBondContact O-N 3.47Å; L24-F27 PolarHBondContact O-N 2.95Å; L24-V28 WeakPolarHBondContact O-CB 3.24Å; L24-V28 VanDerWaalsContact O-CG2 3.24Å; L24-V28 WeakPolarHBondContact O-CG2 2.86Å; L24-V28 PolarHBondContact O-N 3.32Å |
| 25 | T | 71.1 | Confident | 68.8 | Low | 97 Ų | 97 | 83.9 Ų | 83.9 | 60% | 0.595 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -63.5 | -40 | 176.9 | -43 | 0 | 0 | 0 | 0 | 111.1 | L21 C22 A29 | L21-T25 PolarHBondContact O-N 3.16Å; L21-T25 PolarHBondContact O-OG1 3.46Å; C22-T25 PolarHBondContact O-N 3.08Å; T25-A29 VanDerWaalsContact O-CB 3.22Å; T25-A29 WeakPolarHBondContact O-CB 3.14Å; T25-A29 PolarHBondContact O-N 3.45Å |
| 26 | T | 71 | Confident | 67.6 | Low | 59 Ų | 59 | 85.6 Ų | 85.6 | 36% | 0.362 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -66.8 | -39.6 | 174.7 | -57.3 | 0 | 0 | 0 | 0 | 111.6 | C22 F23 L24 R30 | C22-T26 VanDerWaalsContact O-CB 3.31Å; C22-T26 WeakPolarHBondContact O-CB 3.24Å; C22-T26 PolarHBondContact O-N 3.45Å; C22-T26 PolarHBondContact O-OG1 2.99Å; F23-T26 PolarHBondContact O-N 3.3Å; L24-T26 VanDerWaalsContact C-N 3.32Å; L24-T26 PolarHBondContact O-N 3.47Å; T26-R30 HydrophobicContact CG2-CG 4.49Å; T26-R30 VanDerWaalsContact O-CB 3.3Å; T26-R30 WeakPolarHBondContact O-CB 3.42Å; T26-R30 WeakPolarHBondContact O-CG 3.18Å; T26-R30 PolarHBondContact O-N 3.08Å |
| 27 | F | 66.9 | Low | 66.4 | Low | 46 Ų | 46 | 92.9 Ų | 92.9 | 20% | 0.202 | 49% | 0.491 | C | S | . | . | H | α-helix | trans | -65.7 | -47.6 | 176.5 | -178.3 | -101.6 | 0 | 0 | 0 | 110.9 | F23 L24 A29 R30 Q31 K40 T43 | F23-F27 VanDerWaalsContact O-CB 3.25Å; F23-F27 WeakPolarHBondContact O-CB 3.4Å; F23-F27 PolarHBondContact O-N 3.3Å; L24-F27 PolarHBondContact O-N 2.95Å; F27-A29 VanDerWaalsContact C-N 3.35Å; F27-A29 PolarHBondContact O-N 3.23Å; F27-R30 CarbonylContact O-C 3.44Å; F27-R30 WeakPolarHBondContact O-CA 3.23Å; F27-R30 WeakPolarHBondContact O-CB 3.34Å; F27-R30 PolarHBondContact O-N 3.09Å; F27-Q31 HydrophobicContact CD1-CG 3.92Å; F27-Q31 HydrophobicContact CE1-CG 3.66Å; F27-Q31 HydrophobicContact CE2-CG 4.48Å; F27-Q31 HydrophobicContact CG-CG 4.43Å; F27-Q31 HydrophobicContact CZ-CG 3.96Å; F27-Q31 WeakPolarHBondContact O-CG 3.46Å; F27-Q31 PolarHBondContact O-N 3.46Å; F27-K40 HydrophobicContact CE2-CG 4.47Å; F27-T43 HydrophobicContact CB-CG2 4.33Å; F27-T43 HydrophobicContact CD2-CG2 4.38Å |
| 28 | V | 67.4 | Low | 65.3 | Low | 99 Ų | 99 | 91 Ų | 91 | 60% | 0.6 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -62 | -41.6 | 176.1 | 172 | 0 | 0 | 0 | 0 | 111.1 | L24 R30 Q31 | L24-V28 WeakPolarHBondContact O-CB 3.24Å; L24-V28 VanDerWaalsContact O-CG2 3.24Å; L24-V28 WeakPolarHBondContact O-CG2 2.86Å; L24-V28 PolarHBondContact O-N 3.32Å; V28-R30 PolarHBondContact O-N 3.29Å; V28-Q31 PolarHBondContact O-N 3.07Å |
| 29 | A | 66.1 | Low | 64.5 | Low | 76 Ų | 76 | 87.2 Ų | 87.2 | 63% | 0.628 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -64.1 | -27.4 | 173.7 | 0 | 0 | 0 | 0 | 0 | 113 | T25 F27 | T25-A29 VanDerWaalsContact O-CB 3.22Å; T25-A29 WeakPolarHBondContact O-CB 3.14Å; T25-A29 PolarHBondContact O-N 3.45Å; F27-A29 VanDerWaalsContact C-N 3.35Å; F27-A29 PolarHBondContact O-N 3.23Å |
| 30 | R | 57.6 | Low | 63.8 | Low | 89 Ų | 89 | 90.9 Ų | 90.9 | 34% | 0.336 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -88.7 | -10.1 | 176.6 | -71.9 | -88.7 | -172.2 | 160.1 | -0.1 | 113.8 | T26 F27 V28 L32 P33 F93 | T26-R30 HydrophobicContact CG2-CG 4.49Å; T26-R30 VanDerWaalsContact O-CB 3.3Å; T26-R30 WeakPolarHBondContact O-CB 3.42Å; T26-R30 WeakPolarHBondContact O-CG 3.18Å; T26-R30 PolarHBondContact O-N 3.08Å; F27-R30 CarbonylContact O-C 3.44Å; F27-R30 WeakPolarHBondContact O-CA 3.23Å; F27-R30 WeakPolarHBondContact O-CB 3.34Å; F27-R30 PolarHBondContact O-N 3.09Å; V28-R30 PolarHBondContact O-N 3.29Å; R30-L32 VanDerWaalsContact C-N 3.28Å; R30-L32 PolarHBondContact O-N 3.4Å; R30-P33 WeakPolarHBondContact O-CD 3.33Å; R30-F93 VanDerWaalsContact NH1-CZ 3.31Å |
| 31 | Q | 56.7 | Low | 63.2 | Low | 75 Ų | 75 | 91.1 Ų | 91.1 | 35% | 0.35 | 48% | 0.483 | S | S | . | . | S | Bend | trans | -79.5 | -4.6 | -177.5 | -76.8 | -88.7 | 84.6 | 0 | 0 | 113.7 | F27 V28 Y36 | F27-Q31 HydrophobicContact CD1-CG 3.92Å; F27-Q31 HydrophobicContact CE1-CG 3.66Å; F27-Q31 HydrophobicContact CE2-CG 4.48Å; F27-Q31 HydrophobicContact CG-CG 4.43Å; F27-Q31 HydrophobicContact CZ-CG 3.96Å; F27-Q31 WeakPolarHBondContact O-CG 3.46Å; F27-Q31 PolarHBondContact O-N 3.46Å; V28-Q31 PolarHBondContact O-N 3.07Å; Q31-Y36 VanDerWaalsContact OE1-CD2 3.26Å |
| 32 | L | 56.8 | Low | 62.8 | Low | 166 Ų | 166 | 87.6 Ų | 87.6 | 87% | 0.869 | 46% | 0.464 | S | S | * | . | S | Bend | trans | -115.4 | 4.7 | -178.2 | -104.6 | 85.8 | 0 | 0 | 0 | 119.7 | R30 | R30-L32 VanDerWaalsContact C-N 3.28Å; R30-L32 PolarHBondContact O-N 3.4Å |
| 33 | P | 51.4 | Low | 62.6 | Low | 86 Ų | 86 | 84.3 Ų | 84.3 | 56% | 0.558 | 44% | 0.441 | S | S | * | . | S | Bend | trans | -121.6 | 100.2 | 167.6 | 30.1 | -11.5 | 0 | 0 | 0 | 111.4 | R30 N35 | R30-P33 WeakPolarHBondContact O-CD 3.33Å; P33-N35 VanDerWaalsContact C-N 3.32Å; P33-N35 PolarHBondContact O-N 2.8Å |
| 34 | D | 58.2 | Low | 62.4 | Low | 161 Ų | 161 | 89 Ų | 89 | 86% | 0.861 | 46% | 0.462 | S | S | * | . | S | Bend | trans | 47.3 | 14.6 | 145 | -137.6 | 3.7 | 0 | 0 | 0 | 122.5 | ||
| 35 | N | 56.9 | Low | 62.3 | Low | 81 Ų | 81 | 86.9 Ų | 86.9 | 43% | 0.433 | 46% | 0.461 | S | S | . | . | trans | -161.1 | 81.5 | 168.6 | -95.7 | -37.8 | 0 | 0 | 0 | 112.4 | P33 Y37 E38 G39 | P33-N35 VanDerWaalsContact C-N 3.32Å; P33-N35 PolarHBondContact O-N 2.8Å; N35-Y37 PolarHBondContact O-N 2.97Å; N35-E38 HydrophobicContact CB-CB 3.88Å; N35-E38 HydrophobicContact CB-CG 3.8Å; N35-E38 VanDerWaalsContact CB-OE2 3.24Å; N35-E38 WeakPolarHBondContact CB-OE2 3.42Å; N35-E38 PolarHBondContact ND2-OE1 3.49Å; N35-E38 PolarHBondContact ND2-OE2 2.78Å; N35-E38 PolarHBondContact O-N 2.84Å; N35-E38 VanDerWaalsContact O-N 3.09Å; N35-G39 PolarHBondContact O-N 3.27Å | ||
| 36 | Y | 55 | Low | 62.4 | Low | 126 Ų | 126 | 84.8 Ų | 84.8 | 49% | 0.494 | 45% | 0.445 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -54.9 | -22.3 | -179.1 | -166.3 | -96.5 | 0 | 0 | 0 | 114.4 | Q31 K40 | Q31-Y36 VanDerWaalsContact OE1-CD2 3.26Å; Y36-K40 HydrophobicContact CD1-CD 4.45Å; Y36-K40 HydrophobicContact CE1-CD 4.32Å; Y36-K40 WeakPolarHBondContact O-CD 3.48Å; Y36-K40 WeakPolarHBondContact O-CG 3.48Å |
| 37 | Y | 53.6 | Low | 62.5 | Low | 190 Ų | 190 | 85 Ų | 85 | 75% | 0.745 | 44% | 0.444 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -94.3 | -26.6 | -179 | -40.1 | -76.2 | 0 | 0 | 0 | 113.3 | N35 | N35-Y37 PolarHBondContact O-N 2.97Š|
| 38 | E | 56.5 | Low | 62.9 | Low | 67 Ų | 67 | 85.8 Ų | 85.8 | 31% | 0.313 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -76.9 | -32.8 | -179.8 | -69.4 | -176.5 | 154.1 | 0 | 0 | 112.2 | N35 F93 L97 | N35-E38 HydrophobicContact CB-CB 3.88Å; N35-E38 HydrophobicContact CB-CG 3.8Å; N35-E38 VanDerWaalsContact CB-OE2 3.24Å; N35-E38 WeakPolarHBondContact CB-OE2 3.42Å; N35-E38 PolarHBondContact ND2-OE1 3.49Å; N35-E38 PolarHBondContact ND2-OE2 2.78Å; N35-E38 PolarHBondContact O-N 2.84Å; N35-E38 VanDerWaalsContact O-N 3.09Å; E38-F93 HydrophobicContact CB-CE2 4.02Å; E38-F93 HydrophobicContact CB-CZ 4.47Å; E38-L97 HydrophobicContact CB-CD1 4.13Å; E38-L97 HydrophobicContact CG-CD1 3.98Å; E38-L97 WeakPolarHBondContact OE1-CD1 3.24Å; E38-L97 WeakPolarHBondContact OE1-CG 3.11Å; E38-L97 WeakPolarHBondContact OE2-CD1 3.4Å |
| 39 | G | 60 | Low | 63.1 | Low | 12 Ų | 12 | 83.7 Ų | 83.7 | 12% | 0.124 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -74.8 | -25.1 | 179.4 | 0 | 0 | 0 | 0 | 0 | 114.8 | N35 T43 | N35-G39 PolarHBondContact O-N 3.27Å; G39-T43 PolarHBondContact O-OG1 3.38Å |
| 40 | K | 58.4 | Low | 63.4 | Low | 93 Ų | 93 | 84 Ų | 84 | 40% | 0.404 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -71.9 | -29.7 | -175.5 | -75.4 | 175.8 | 94.3 | 84.3 | 0 | 113.5 | F27 Y36 T43 F44 | F27-K40 HydrophobicContact CE2-CG 4.47Å; Y36-K40 HydrophobicContact CD1-CD 4.45Å; Y36-K40 HydrophobicContact CE1-CD 4.32Å; Y36-K40 WeakPolarHBondContact O-CD 3.48Å; Y36-K40 WeakPolarHBondContact O-CG 3.48Å; K40-T43 WeakPolarHBondContact CA-OG1 3.33Å; K40-T43 PolarHBondContact O-OG1 3.47Å; K40-F44 WeakPolarHBondContact O-CB 3.37Å; K40-F44 PolarHBondContact O-N 2.88Å |
| 41 | C | 61.6 | Low | 64.1 | Low | 89 Ų | 89 | 84.5 Ų | 84.5 | 60% | 0.601 | 43% | 0.431 | S | S | * | . | H | α-helix | trans | -67.7 | -37.5 | -178.2 | -122.5 | 0 | 0 | 0 | 0 | 112.6 | G45 | C41-G45 PolarHBondContact O-N 3.28Å; C41-G45 VanDerWaalsContact O-N 3.14Å |
| 42 | I | 69.5 | Low | 65.1 | Low | 18 Ų | 18 | 85.1 Ų | 85.1 | 9% | 0.092 | 44% | 0.44 | C | S | . | . | H | α-helix | trans | -65.8 | -48.2 | 177.2 | -74.2 | 154.5 | 0 | 0 | 0 | 111.4 | G45 M46 L89 F93 | I42-G45 PolarHBondContact O-N 3.08Å; I42-M46 PolarHBondContact O-N 3.16Å; I42-M46 VanDerWaalsContact O-N 3.15Å; I42-L89 HydrophobicContact CB-CD2 4.2Å; I42-L89 HydrophobicContact CG1-CD2 4.25Å; I42-L89 HydrophobicContact CG2-CD1 3.79Å; I42-L89 HydrophobicContact CG2-CD2 3.61Å; I42-L89 HydrophobicContact CG2-CG 4.22Å; I42-F93 HydrophobicContact CD1-CB 3.91Å; I42-F93 HydrophobicContact CD1-CD2 3.18Å; I42-F93 HydrophobicContact CD1-CE2 3.73Å; I42-F93 HydrophobicContact CD1-CG 3.63Å; I42-F93 HydrophobicContact CG1-CB 4.38Å; I42-F93 HydrophobicContact CG1-CD2 4.07Å |
| 43 | T | 72.8 | Confident | 65.9 | Low | 8 Ų | 8 | 79.2 Ų | 79.2 | 5% | 0.049 | 41% | 0.406 | C | S | . | . | H | α-helix | trans | -64.8 | -47.4 | -179.6 | 26.9 | 0 | 0 | 0 | 0 | 109.2 | F23 F27 G39 K40 G45 M46 L47 | F23-T43 HydrophobicContact CD2-CG2 3.82Å; F23-T43 HydrophobicContact CE2-CG2 3.43Å; F23-T43 VanDerWaalsContact CE2-CG2 3.43Å; F23-T43 VanDerWaalsContact CE2-O 3.27Å; F23-T43 WeakPolarHBondContact CE2-O 3.49Å; F23-T43 HydrophobicContact CZ-CG2 3.87Å; F27-T43 HydrophobicContact CB-CG2 4.33Å; F27-T43 HydrophobicContact CD2-CG2 4.38Å; G39-T43 PolarHBondContact O-OG1 3.38Å; K40-T43 WeakPolarHBondContact CA-OG1 3.33Å; K40-T43 PolarHBondContact O-OG1 3.47Å; T43-G45 VanDerWaalsContact C-N 3.3Å; T43-G45 PolarHBondContact O-N 3.44Å; T43-M46 PolarHBondContact O-N 2.96Å; T43-M46 VanDerWaalsContact O-N 3.13Å; T43-L47 WeakPolarHBondContact O-CB 3.25Å; T43-L47 PolarHBondContact O-N 3.42Å |
| 44 | F | 69.1 | Low | 66.9 | Low | 144 Ų | 144 | 78 Ų | 78 | 63% | 0.632 | 39% | 0.394 | S | S | * | . | H | α-helix | trans | -55.6 | -42.4 | 177.5 | -169 | -103.6 | 0 | 0 | 0 | 113.2 | K40 L47 V48 | K40-F44 WeakPolarHBondContact O-CB 3.37Å; K40-F44 PolarHBondContact O-N 2.88Å; F44-L47 PolarHBondContact O-N 2.91Å; F44-V48 HydrophobicContact CD1-CG2 4.21Å; F44-V48 HydrophobicContact CE1-CG2 3.9Å; F44-V48 HydrophobicContact CE2-CG2 4.43Å; F44-V48 HydrophobicContact CZ-CG2 4.02Å; F44-V48 WeakPolarHBondContact O-CG2 3.38Å; F44-V48 PolarHBondContact O-N 3.45Å |
| 45 | G | 72.1 | Confident | 67.7 | Low | 42 Ų | 42 | 74.2 Ų | 74.2 | 43% | 0.433 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -63.8 | -42.1 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.9 | C41 I42 T43 L47 F49 | C41-G45 PolarHBondContact O-N 3.28Å; C41-G45 VanDerWaalsContact O-N 3.14Å; I42-G45 PolarHBondContact O-N 3.08Å; T43-G45 VanDerWaalsContact C-N 3.3Å; T43-G45 PolarHBondContact O-N 3.44Å; G45-L47 VanDerWaalsContact C-N 3.32Å; G45-L47 PolarHBondContact O-N 3.25Å; G45-F49 WeakPolarHBondContact O-CB 3.3Å; G45-F49 PolarHBondContact O-N 2.97Å; G45-F49 VanDerWaalsContact O-N 3.16Å |
| 46 | M | 72.9 | Confident | 68.2 | Low | 54 Ų | 54 | 76.2 Ų | 76.2 | 27% | 0.266 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -63 | -39.5 | 174.7 | -77 | -63.4 | -155.6 | 0 | 0 | 111.9 | I42 T43 F49 F50 L89 | I42-M46 PolarHBondContact O-N 3.16Å; I42-M46 VanDerWaalsContact O-N 3.15Å; T43-M46 PolarHBondContact O-N 2.96Å; T43-M46 VanDerWaalsContact O-N 3.13Å; M46-F49 PolarHBondContact O-N 3.15Å; M46-F50 VanDerWaalsContact O-CD2 3.26Å; M46-F50 WeakPolarHBondContact O-CD2 3.49Å; M46-F50 PolarHBondContact O-N 3.14Å; M46-F50 VanDerWaalsContact O-N 3.15Å; M46-L89 HydrophobicContact CE-CD1 3.14Å; M46-L89 HydrophobicContact CE-CG 3.8Å; M46-L89 HydrophobicContact CG-CD1 3.93Å; M46-L89 HydrophobicContact CG-CD2 4.39Å; M46-L89 HydrophobicContact SD-CD1 4.23Å |
| 47 | L | 72.6 | Confident | 68.9 | Low | 62 Ų | 62 | 71.4 Ų | 71.4 | 33% | 0.325 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -72.1 | -42.5 | -176.5 | -160.1 | 140.5 | 0 | 0 | 0 | 112.2 | F23 T43 F44 G45 F49 F50 I51 | F23-L47 HydrophobicContact CD1-CD1 4.25Å; F23-L47 HydrophobicContact CD2-CB 4.48Å; F23-L47 HydrophobicContact CD2-CD1 4.17Å; F23-L47 HydrophobicContact CE1-CD1 3.8Å; F23-L47 HydrophobicContact CE2-CB 3.99Å; F23-L47 HydrophobicContact CE2-CD1 3.64Å; F23-L47 HydrophobicContact CE2-CG 4.44Å; F23-L47 HydrophobicContact CG-CD1 4.44Å; F23-L47 HydrophobicContact CZ-CD1 3.47Å; F23-L47 VanDerWaalsContact CZ-CD1 3.47Å; T43-L47 WeakPolarHBondContact O-CB 3.25Å; T43-L47 PolarHBondContact O-N 3.42Å; F44-L47 PolarHBondContact O-N 2.91Å; G45-L47 VanDerWaalsContact C-N 3.32Å; G45-L47 PolarHBondContact O-N 3.25Å; L47-F49 VanDerWaalsContact C-N 3.31Å; L47-F49 PolarHBondContact O-N 3.13Å; L47-F50 PolarHBondContact O-N 3.15Å; L47-I51 HydrophobicContact CD2-CD1 3.66Å; L47-I51 HydrophobicContact CD2-CG1 4.46Å; L47-I51 WeakPolarHBondContact O-CG1 3.45Å; L47-I51 PolarHBondContact O-N 2.92Å; L47-I51 VanDerWaalsContact O-N 3.08Å |
| 48 | V | 75 | Confident | 69.5 | Low | 63 Ų | 63 | 66.2 Ų | 66.2 | 38% | 0.382 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -62.8 | -39.7 | 174.7 | 173.1 | 0 | 0 | 0 | 0 | 111 | F44 F50 I51 V52 | F44-V48 HydrophobicContact CD1-CG2 4.21Å; F44-V48 HydrophobicContact CE1-CG2 3.9Å; F44-V48 HydrophobicContact CE2-CG2 4.43Å; F44-V48 HydrophobicContact CZ-CG2 4.02Å; F44-V48 WeakPolarHBondContact O-CG2 3.38Å; F44-V48 PolarHBondContact O-N 3.45Å; V48-F50 PolarHBondContact O-N 3.01Å; V48-I51 PolarHBondContact O-N 3.3Å; V48-V52 WeakPolarHBondContact O-CG2 3.18Å; V48-V52 PolarHBondContact O-N 3.47Å; V48-V52 VanDerWaalsContact O-N 3.08Å |
| 49 | F | 72 | Confident | 70 | Confident | 55 Ų | 55 | 66 Ų | 66 | 24% | 0.241 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -60.9 | -44.6 | 176.4 | -176.9 | -103.4 | 0 | 0 | 0 | 112.4 | G45 M46 L47 I51 V52 W53 Y81 | G45-F49 WeakPolarHBondContact O-CB 3.3Å; G45-F49 PolarHBondContact O-N 2.97Å; G45-F49 VanDerWaalsContact O-N 3.16Å; M46-F49 PolarHBondContact O-N 3.15Å; L47-F49 VanDerWaalsContact C-N 3.31Å; L47-F49 PolarHBondContact O-N 3.13Å; F49-I51 PolarHBondContact O-N 2.9Å; F49-V52 PolarHBondContact O-N 3.35Å; F49-W53 WeakPolarHBondContact O-CB 3.33Å; F49-W53 PolarHBondContact O-N 3.41Å; F49-W53 VanDerWaalsContact O-N 3.08Å; F49-Y81 HydrophobicContact CD1-CD1 4.42Å; F49-Y81 AromaticContact CD2-CD1 3.86Å; F49-Y81 HydrophobicContact CD2-CD1 3.86Å; F49-Y81 AromaticContact CD2-CE1 3.74Å; F49-Y81 HydrophobicContact CD2-CE1 3.74Å; F49-Y81 AromaticContact CE1-CD1 3.74Å; F49-Y81 HydrophobicContact CE1-CD1 3.74Å; F49-Y81 HydrophobicContact CE1-CD2 4.34Å; F49-Y81 HydrophobicContact CE1-CE1 4.45Å; F49-Y81 AromaticContact CE1-CG 3.66Å; F49-Y81 HydrophobicContact CE1-CG 3.66Å; F49-Y81 AromaticContact CE2-CD1 3.12Å; F49-Y81 HydrophobicContact CE2-CD1 3.12Å; F49-Y81 AromaticContact CE2-CD2 3.94Å; F49-Y81 HydrophobicContact CE2-CD2 3.94Å; F49-Y81 AromaticContact CE2-CE1 2.98Å; F49-Y81 HydrophobicContact CE2-CE1 2.98Å; F49-Y81 AromaticContact CE2-CE2 3.83Å; F49-Y81 HydrophobicContact CE2-CE2 3.83Å; F49-Y81 AromaticContact CE2-CG 3.6Å; F49-Y81 HydrophobicContact CE2-CG 3.6Å; F49-Y81 AromaticContact CE2-CZ 3.34Å; F49-Y81 HydrophobicContact CG-CD1 4.48Å; F49-Y81 VanDerWaalsContact CZ-CB 3.49Å; F49-Y81 AromaticContact CZ-CD1 3.05Å; F49-Y81 HydrophobicContact CZ-CD1 3.05Å; F49-Y81 AromaticContact CZ-CD2 3.4Å; F49-Y81 HydrophobicContact CZ-CD2 3.4Å; F49-Y81 AromaticContact CZ-CE1 3.44Å; F49-Y81 HydrophobicContact CZ-CE1 3.44Å; F49-Y81 VanDerWaalsContact CZ-CE1 3.44Å; F49-Y81 AromaticContact CZ-CE2 3.74Å; F49-Y81 HydrophobicContact CZ-CE2 3.74Å; F49-Y81 AromaticContact CZ-CG 3.01Å; F49-Y81 HydrophobicContact CZ-CG 3.01Å; F49-Y81 AromaticContact CZ-CZ 3.74Å |
| 50 | F | 72 | Confident | 70.2 | Confident | 82 Ų | 82 | 67.8 Ų | 67.8 | 36% | 0.36 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -62.5 | -39.2 | 174.9 | -89.9 | -71.9 | 0 | 0 | 0 | 113.1 | A19 M46 L47 V48 W53 I54 | A19-F50 HydrophobicContact CB-CD1 3.91Å; A19-F50 HydrophobicContact CB-CD2 4.23Å; A19-F50 HydrophobicContact CB-CE1 3.37Å; A19-F50 HydrophobicContact CB-CE2 3.76Å; A19-F50 HydrophobicContact CB-CG 4.32Å; A19-F50 HydrophobicContact CB-CZ 3.31Å; M46-F50 VanDerWaalsContact O-CD2 3.26Å; M46-F50 WeakPolarHBondContact O-CD2 3.49Å; M46-F50 PolarHBondContact O-N 3.14Å; M46-F50 VanDerWaalsContact O-N 3.15Å; L47-F50 PolarHBondContact O-N 3.15Å; V48-F50 PolarHBondContact O-N 3.01Å; F50-W53 WeakPolarHBondContact O-CB 3.39Å; F50-W53 PolarHBondContact O-N 2.94Å; F50-I54 WeakPolarHBondContact O-CD1 3.35Å; F50-I54 WeakPolarHBondContact O-CG1 3.35Å; F50-I54 PolarHBondContact O-N 3.32Å |
| 51 | I | 73.7 | Confident | 70.3 | Confident | 101 Ų | 101 | 66.2 Ų | 66.2 | 52% | 0.518 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -64.9 | -45.2 | 178.6 | -68.6 | 170.7 | 0 | 0 | 0 | 111.4 | L47 V48 F49 W53 I54 S55 | L47-I51 HydrophobicContact CD2-CD1 3.66Å; L47-I51 HydrophobicContact CD2-CG1 4.46Å; L47-I51 WeakPolarHBondContact O-CG1 3.45Å; L47-I51 PolarHBondContact O-N 2.92Å; L47-I51 VanDerWaalsContact O-N 3.08Å; V48-I51 PolarHBondContact O-N 3.3Å; F49-I51 PolarHBondContact O-N 2.9Å; I51-W53 VanDerWaalsContact C-N 3.28Å; I51-W53 PolarHBondContact O-N 3.45Å; I51-I54 PolarHBondContact O-N 3.4Å; I51-S55 WeakPolarHBondContact O-CB 3.27Å; I51-S55 PolarHBondContact O-N 3.43Å |
| 52 | V | 76.1 | Confident | 70.4 | Confident | 88 Ų | 88 | 66.8 Ų | 66.8 | 53% | 0.533 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -61.1 | -41.2 | 177.2 | 172.4 | 0 | 0 | 0 | 0 | 110.5 | V48 F49 S55 F56 | V48-V52 WeakPolarHBondContact O-CG2 3.18Å; V48-V52 PolarHBondContact O-N 3.47Å; V48-V52 VanDerWaalsContact O-N 3.08Å; F49-V52 PolarHBondContact O-N 3.35Å; V52-S55 PolarHBondContact O-N 2.83Å; V52-F56 PolarHBondContact O-N 3.3Å |
| 53 | W | 74.1 | Confident | 70 | Confident | 42 Ų | 42 | 70.9 Ų | 70.9 | 16% | 0.159 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -61.2 | -46.5 | 176.5 | -168.2 | -115.1 | 0 | 0 | 0 | 112.8 | F49 F50 I51 F56 F74 L77 A78 | F49-W53 WeakPolarHBondContact O-CB 3.33Å; F49-W53 PolarHBondContact O-N 3.41Å; F49-W53 VanDerWaalsContact O-N 3.08Å; F50-W53 WeakPolarHBondContact O-CB 3.39Å; F50-W53 PolarHBondContact O-N 2.94Å; I51-W53 VanDerWaalsContact C-N 3.28Å; I51-W53 PolarHBondContact O-N 3.45Å; W53-F56 WeakPolarHBondContact O-CB 3.24Å; W53-F56 PolarHBondContact O-N 3.46Å; W53-F74 HydrophobicContact CD2-CD1 4.25Å; W53-F74 AromaticContact CD2-CE1 3.88Å; W53-F74 HydrophobicContact CD2-CE1 3.88Å; W53-F74 AromaticContact CE2-CD1 3.42Å; W53-F74 VanDerWaalsContact CE2-CD1 3.42Å; W53-F74 AromaticContact CE2-CE1 3.51Å; W53-F74 HydrophobicContact CE3-CE1 4.03Å; W53-F74 HydrophobicContact CH2-CB 4.13Å; W53-F74 AromaticContact CH2-CD1 3.23Å; W53-F74 HydrophobicContact CH2-CD1 3.23Å; W53-F74 HydrophobicContact CH2-CD2 4.28Å; W53-F74 AromaticContact CH2-CE1 3.48Å; W53-F74 HydrophobicContact CH2-CE1 3.48Å; W53-F74 VanDerWaalsContact CH2-CE1 3.48Å; W53-F74 AromaticContact CH2-CG 3.64Å; W53-F74 HydrophobicContact CH2-CG 3.64Å; W53-F74 HydrophobicContact CH2-CZ 4.17Å; W53-F74 HydrophobicContact CZ2-CB 3.96Å; W53-F74 AromaticContact CZ2-CD1 2.9Å; W53-F74 HydrophobicContact CZ2-CD1 2.9Å; W53-F74 AromaticContact CZ2-CE1 3.39Å; W53-F74 HydrophobicContact CZ2-CE1 3.39Å; W53-F74 AromaticContact CZ2-CG 3.64Å; W53-F74 HydrophobicContact CZ2-CG 3.64Å; W53-F74 HydrophobicContact CZ2-CZ 4.47Å; W53-F74 HydrophobicContact CZ3-CD1 4.06Å; W53-F74 AromaticContact CZ3-CE1 3.82Å; W53-F74 HydrophobicContact CZ3-CE1 3.82Å; W53-F74 HydrophobicContact CZ3-CZ 4.28Å; W53-F74 AromaticContact NE1-CD1 3.99Å; W53-L77 HydrophobicContact CH2-CB 3.48Å; W53-L77 VanDerWaalsContact CH2-CB 3.48Å; W53-L77 HydrophobicContact CH2-CD1 3.87Å; W53-L77 HydrophobicContact CH2-CG 4.34Å; W53-L77 HydrophobicContact CZ2-CB 4.41Å; W53-L77 HydrophobicContact CZ3-CB 4Å; W53-L77 HydrophobicContact CZ3-CD1 3.97Å; W53-A78 HydrophobicContact CZ2-CB 4.34Å |
| 54 | I | 72.7 | Confident | 69 | Low | 61 Ų | 61 | 78.5 Ų | 78.5 | 31% | 0.313 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -66 | -39 | 179.4 | -65.6 | 160.1 | 0 | 0 | 0 | 111.2 | F12 V16 F50 I51 F56 V57 P58 | F12-I54 HydrophobicContact CE1-CG1 4.35Å; V16-I54 HydrophobicContact CB-CD1 4.46Å; V16-I54 HydrophobicContact CG1-CD1 3.96Å; V16-I54 HydrophobicContact CG2-CD1 3.58Å; V16-I54 HydrophobicContact CG2-CG1 3.81Å; F50-I54 WeakPolarHBondContact O-CD1 3.35Å; F50-I54 WeakPolarHBondContact O-CG1 3.35Å; F50-I54 PolarHBondContact O-N 3.32Å; I51-I54 PolarHBondContact O-N 3.4Å; I54-F56 PolarHBondContact O-N 2.96Å; I54-V57 WeakPolarHBondContact O-CB 3.42Å; I54-V57 WeakPolarHBondContact O-CG2 3.26Å; I54-V57 PolarHBondContact O-N 2.91Å; I54-V57 VanDerWaalsContact O-N 3.15Å; I54-P58 WeakPolarHBondContact O-CD 3.4Å |
| 55 | S | 74.5 | Confident | 68.5 | Low | 80 Ų | 80 | 75 Ų | 75 | 56% | 0.559 | 44% | 0.435 | S | S | * | . | H | α-helix | trans | -63.8 | -26.2 | 177.5 | -175.5 | 0 | 0 | 0 | 0 | 112.8 | I51 V52 V57 P58 | I51-S55 WeakPolarHBondContact O-CB 3.27Å; I51-S55 PolarHBondContact O-N 3.43Å; V52-S55 PolarHBondContact O-N 2.83Å; S55-V57 VanDerWaalsContact C-N 3.3Å; S55-V57 PolarHBondContact O-N 2.9Å; S55-P58 VanDerWaalsContact O-CD 3.28Å; S55-P58 WeakPolarHBondContact O-CD 3.22Å; S55-P58 WeakPolarHBondContact O-CG 3.48Å |
| 56 | F | 67.9 | Low | 67.8 | Low | 123 Ų | 123 | 82 Ų | 82 | 54% | 0.539 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -72.8 | -21.7 | 177 | -137.5 | -90.7 | 0 | 0 | 0 | 113.2 | V52 W53 I54 Y60 F74 | V52-F56 PolarHBondContact O-N 3.3Å; W53-F56 WeakPolarHBondContact O-CB 3.24Å; W53-F56 PolarHBondContact O-N 3.46Å; I54-F56 PolarHBondContact O-N 2.96Å; F56-Y60 VanDerWaalsContact O-CB 3.28Å; F56-Y60 WeakPolarHBondContact O-CB 3.38Å; F56-Y60 PolarHBondContact O-N 2.88Å; F56-F74 HydrophobicContact CB-CZ 4.19Å; F56-F74 HydrophobicContact CD1-CE2 4.2Å; F56-F74 AromaticContact CD1-CZ 3.81Å; F56-F74 HydrophobicContact CD1-CZ 3.81Å; F56-F74 HydrophobicContact CG-CZ 4.39Å |
| 57 | V | 70.4 | Confident | 67.2 | Low | 25 Ų | 25 | 82 Ų | 82 | 15% | 0.152 | 45% | 0.452 | C | S | . | . | H | α-helix | trans | -68.3 | -48.6 | -178 | -176 | 0 | 0 | 0 | 0 | 114 | F12 I54 S55 A59 Y60 L61 | F12-V57 HydrophobicContact CD1-CG2 4.16Å; F12-V57 HydrophobicContact CD2-CG1 4.41Å; F12-V57 HydrophobicContact CD2-CG2 4.42Å; F12-V57 HydrophobicContact CE1-CG2 3.4Å; F12-V57 VanDerWaalsContact CE1-CG2 3.4Å; F12-V57 HydrophobicContact CE2-CG1 4.28Å; F12-V57 HydrophobicContact CE2-CG2 3.7Å; F12-V57 HydrophobicContact CZ-CB 4.42Å; F12-V57 HydrophobicContact CZ-CG1 4.48Å; F12-V57 HydrophobicContact CZ-CG2 3.14Å; I54-V57 WeakPolarHBondContact O-CB 3.42Å; I54-V57 WeakPolarHBondContact O-CG2 3.26Å; I54-V57 PolarHBondContact O-N 2.91Å; I54-V57 VanDerWaalsContact O-N 3.15Å; S55-V57 VanDerWaalsContact C-N 3.3Å; S55-V57 PolarHBondContact O-N 2.9Å; V57-A59 VanDerWaalsContact C-N 3.32Å; V57-A59 PolarHBondContact O-N 2.99Å; V57-Y60 VanDerWaalsContact O-CB 3.3Å; V57-Y60 WeakPolarHBondContact O-CB 3.48Å; V57-Y60 PolarHBondContact O-N 3.32Å; V57-L61 HydrophobicContact CG1-CD1 4.09Å; V57-L61 WeakPolarHBondContact O-CG 3.47Å; V57-L61 PolarHBondContact O-N 3.39Å |
| 58 | P | 65.2 | Low | 66.8 | Low | 82 Ų | 82 | 87.6 Ų | 87.6 | 53% | 0.532 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -67.3 | -33.7 | 176.2 | 24 | -33 | 0 | 0 | 0 | 112.2 | I54 S55 Y60 L61 S62 | I54-P58 WeakPolarHBondContact O-CD 3.4Å; S55-P58 VanDerWaalsContact O-CD 3.28Å; S55-P58 WeakPolarHBondContact O-CD 3.22Å; S55-P58 WeakPolarHBondContact O-CG 3.48Å; P58-Y60 VanDerWaalsContact C-N 3.3Å; P58-L61 PolarHBondContact O-N 2.95Å; P58-S62 PolarHBondContact O-N 3.41Å |
| 59 | A | 68.4 | Low | 66.6 | Low | 62 Ų | 62 | 88.9 Ų | 88.9 | 51% | 0.512 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -62.9 | -40 | 171.1 | 0 | 0 | 0 | 0 | 0 | 111.1 | V57 S62 | V57-A59 VanDerWaalsContact C-N 3.32Å; V57-A59 PolarHBondContact O-N 2.99Å; A59-S62 PolarHBondContact O-N 3.33Å |
| 60 | Y | 63.7 | Low | 66.5 | Low | 49 Ų | 49 | 87.1 Ų | 87.1 | 19% | 0.192 | 48% | 0.478 | C | S | . | . | H | α-helix | trans | -62.8 | -46.8 | 173.4 | -169.8 | -113.5 | 0 | 0 | 0 | 111.8 | F56 V57 P58 S62 T63 F67 A70 V71 | F56-Y60 VanDerWaalsContact O-CB 3.28Å; F56-Y60 WeakPolarHBondContact O-CB 3.38Å; F56-Y60 PolarHBondContact O-N 2.88Å; V57-Y60 VanDerWaalsContact O-CB 3.3Å; V57-Y60 WeakPolarHBondContact O-CB 3.48Å; V57-Y60 PolarHBondContact O-N 3.32Å; P58-Y60 VanDerWaalsContact C-N 3.3Å; Y60-S62 PolarHBondContact O-N 2.79Å; Y60-T63 PolarHBondContact O-N 3.06Å; Y60-F67 HydrophobicContact CD1-CD1 4.29Å; Y60-F67 HydrophobicContact CD1-CG 4.41Å; Y60-F67 HydrophobicContact CD2-CD1 4.03Å; Y60-F67 AromaticContact CD2-CE1 3.99Å; Y60-F67 HydrophobicContact CD2-CE1 3.99Å; Y60-F67 HydrophobicContact CE1-CB 3.62Å; Y60-F67 AromaticContact CE1-CD1 3.69Å; Y60-F67 HydrophobicContact CE1-CD1 3.69Å; Y60-F67 HydrophobicContact CE1-CD2 4.45Å; Y60-F67 HydrophobicContact CE1-CE1 4.39Å; Y60-F67 AromaticContact CE1-CG 3.7Å; Y60-F67 HydrophobicContact CE1-CG 3.7Å; Y60-F67 AromaticContact CE2-CD1 3.3Å; Y60-F67 HydrophobicContact CE2-CD1 3.3Å; Y60-F67 AromaticContact CE2-CE1 3.68Å; Y60-F67 HydrophobicContact CE2-CE1 3.68Å; Y60-F67 HydrophobicContact CE2-CG 4.18Å; Y60-F67 HydrophobicContact CG-CD1 4.45Å; Y60-F67 HydrophobicContact CG-CE1 4.41Å; Y60-F67 AromaticContact CZ-CD1 3.15Å; Y60-F67 AromaticContact CZ-CE1 3.95Å; Y60-F67 AromaticContact CZ-CG 3.57Å; Y60-F67 VanDerWaalsContact O-CE1 3.26Å; Y60-F67 WeakPolarHBondContact O-CE1 3.18Å; Y60-F67 WeakPolarHBondContact O-CE2 3.32Å; Y60-F67 WeakPolarHBondContact O-CZ 3.14Å; Y60-F67 WeakPolarHBondContact OH-CA 3.47Å; Y60-F67 WeakPolarHBondContact OH-CB 3.42Å; Y60-F67 VanDerWaalsContact OH-CD1 3.31Å; Y60-F67 WeakPolarHBondContact OH-CD1 3.25Å; Y60-F67 PolarHBondContact OH-O 3.45Å; Y60-A70 HydrophobicContact CD2-CB 4.16Å; Y60-A70 HydrophobicContact CE1-CB 4.47Å; Y60-A70 HydrophobicContact CE2-CB 3.08Å; Y60-A70 WeakPolarHBondContact OH-CA 3.31Å; Y60-A70 WeakPolarHBondContact OH-CB 3.17Å; Y60-A70 PolarHBondContact OH-N 3.08Å; Y60-V71 PolarHBondContact OH-N 3.11Å |
| 61 | L | 61 | Low | 66.4 | Low | 61 Ų | 61 | 87.5 Ų | 87.5 | 32% | 0.319 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -65.6 | -19.5 | -179.3 | -74.5 | 162.8 | 0 | 0 | 0 | 114.7 | V57 P58 T63 K64 | V57-L61 HydrophobicContact CG1-CD1 4.09Å; V57-L61 WeakPolarHBondContact O-CG 3.47Å; V57-L61 PolarHBondContact O-N 3.39Å; P58-L61 PolarHBondContact O-N 2.95Å; L61-T63 VanDerWaalsContact C-N 3.3Å; L61-T63 PolarHBondContact O-N 3.44Å; L61-K64 VanDerWaalsContact O-CG 3.22Å; L61-K64 WeakPolarHBondContact O-CG 3.15Å |
| 62 | S | 61.8 | Low | 66.2 | Low | 101 Ų | 101 | 88.7 Ų | 88.7 | 71% | 0.706 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -67.9 | -27.1 | -179.4 | -159.6 | 0 | 0 | 0 | 0 | 113.1 | P58 A59 Y60 K64 | P58-S62 PolarHBondContact O-N 3.41Å; A59-S62 PolarHBondContact O-N 3.33Å; Y60-S62 PolarHBondContact O-N 2.79Å; S62-K64 PolarHBondContact O-N 2.79Å |
| 63 | T | 61.6 | Low | 66.3 | Low | 103 Ų | 103 | 88.4 Ų | 88.4 | 63% | 0.632 | 48% | 0.484 | S | S | * | . | S | Bend | trans | -95.3 | 45 | -172.9 | -43.3 | 0 | 0 | 0 | 0 | 113 | Y60 L61 G65 F67 | Y60-T63 PolarHBondContact O-N 3.06Å; L61-T63 VanDerWaalsContact C-N 3.3Å; L61-T63 PolarHBondContact O-N 3.44Å; T63-G65 PolarHBondContact O-N 3.28Å; T63-F67 VanDerWaalsContact C-CE2 3.49Å; T63-F67 WeakPolarHBondContact O-CE1 3.39Å; T63-F67 VanDerWaalsContact O-CE2 3.24Å; T63-F67 WeakPolarHBondContact O-CE2 3.46Å; T63-F67 WeakPolarHBondContact O-CZ 3.27Å |
| 64 | K | 53.1 | Low | 66.2 | Low | 168 Ų | 168 | 87.7 Ų | 87.7 | 73% | 0.73 | 48% | 0.482 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -46.4 | 117 | -165.1 | -65.6 | -174.5 | -178.9 | 176 | 0 | 115.6 | L61 S62 F67 | L61-K64 VanDerWaalsContact O-CG 3.22Å; L61-K64 WeakPolarHBondContact O-CG 3.15Å; S62-K64 PolarHBondContact O-N 2.79Å; K64-F67 VanDerWaalsContact CA-CE2 3.44Å |
| 65 | G | 58.3 | Low | 66.2 | Low | 71 Ų | 71 | 87.7 Ų | 87.7 | 73% | 0.732 | 49% | 0.492 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 149.8 | -29.2 | 157.7 | 0 | 0 | 0 | 0 | 0 | 117.7 | T63 | T63-G65 PolarHBondContact O-N 3.28Š|
| 66 | K | 56.2 | Low | 66.6 | Low | 188 Ų | 188 | 89.3 Ų | 89.3 | 82% | 0.817 | 49% | 0.493 | S | S | * | . | trans | -112.4 | 17.8 | -164.5 | -67.8 | 176.9 | 172.5 | 168.3 | 0 | 115.4 | K68 | K66-K68 PolarHBondContact O-N 2.8Š| ||
| 67 | F | 60.7 | Low | 67.1 | Low | 54 Ų | 54 | 86.2 Ų | 86.2 | 24% | 0.237 | 48% | 0.482 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -88.5 | 7.1 | -153.9 | -64.9 | -46.1 | 0 | 0 | 0 | 118.1 | Y60 T63 K64 V69 V71 | Y60-F67 HydrophobicContact CD1-CD1 4.29Å; Y60-F67 HydrophobicContact CD1-CG 4.41Å; Y60-F67 HydrophobicContact CD2-CD1 4.03Å; Y60-F67 AromaticContact CD2-CE1 3.99Å; Y60-F67 HydrophobicContact CD2-CE1 3.99Å; Y60-F67 HydrophobicContact CE1-CB 3.62Å; Y60-F67 AromaticContact CE1-CD1 3.69Å; Y60-F67 HydrophobicContact CE1-CD1 3.69Å; Y60-F67 HydrophobicContact CE1-CD2 4.45Å; Y60-F67 HydrophobicContact CE1-CE1 4.39Å; Y60-F67 AromaticContact CE1-CG 3.7Å; Y60-F67 HydrophobicContact CE1-CG 3.7Å; Y60-F67 AromaticContact CE2-CD1 3.3Å; Y60-F67 HydrophobicContact CE2-CD1 3.3Å; Y60-F67 AromaticContact CE2-CE1 3.68Å; Y60-F67 HydrophobicContact CE2-CE1 3.68Å; Y60-F67 HydrophobicContact CE2-CG 4.18Å; Y60-F67 HydrophobicContact CG-CD1 4.45Å; Y60-F67 HydrophobicContact CG-CE1 4.41Å; Y60-F67 AromaticContact CZ-CD1 3.15Å; Y60-F67 AromaticContact CZ-CE1 3.95Å; Y60-F67 AromaticContact CZ-CG 3.57Å; Y60-F67 VanDerWaalsContact O-CE1 3.26Å; Y60-F67 WeakPolarHBondContact O-CE1 3.18Å; Y60-F67 WeakPolarHBondContact O-CE2 3.32Å; Y60-F67 WeakPolarHBondContact O-CZ 3.14Å; Y60-F67 WeakPolarHBondContact OH-CA 3.47Å; Y60-F67 WeakPolarHBondContact OH-CB 3.42Å; Y60-F67 VanDerWaalsContact OH-CD1 3.31Å; Y60-F67 WeakPolarHBondContact OH-CD1 3.25Å; Y60-F67 PolarHBondContact OH-O 3.45Å; T63-F67 VanDerWaalsContact C-CE2 3.49Å; T63-F67 WeakPolarHBondContact O-CE1 3.39Å; T63-F67 VanDerWaalsContact O-CE2 3.24Å; T63-F67 WeakPolarHBondContact O-CE2 3.46Å; T63-F67 WeakPolarHBondContact O-CZ 3.27Å; K64-F67 VanDerWaalsContact CA-CE2 3.44Å; F67-V69 PolarHBondContact O-N 2.77Å; F67-V71 PolarHBondContact O-N 2.94Å |
| 68 | K | 65.1 | Low | 67.3 | Low | 180 Ų | 180 | 87.6 Ų | 87.6 | 78% | 0.783 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -61.4 | -40.8 | 170.5 | -162.1 | -170.7 | -178.2 | -167.6 | 0 | 110.5 | K66 A70 V71 E72 | K66-K68 PolarHBondContact O-N 2.8Å; K68-A70 PolarHBondContact O-N 2.97Å; K68-V71 WeakPolarHBondContact O-CG1 3.34Å; K68-V71 PolarHBondContact O-N 2.93Å; K68-E72 PolarHBondContact O-N 3.35Å |
| 69 | V | 70.8 | Confident | 68 | Low | 90 Ų | 90 | 87.9 Ų | 87.9 | 55% | 0.545 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -62.7 | -45 | -178.9 | 169.6 | 0 | 0 | 0 | 0 | 111.8 | F67 E72 I73 | F67-V69 PolarHBondContact O-N 2.77Å; V69-E72 VanDerWaalsContact O-CB 3.23Å; V69-E72 WeakPolarHBondContact O-CB 2.82Å; V69-E72 PolarHBondContact O-N 3.33Å; V69-I73 HydrophobicContact CG1-CD1 3.77Å; V69-I73 HydrophobicContact CG1-CG1 4.48Å; V69-I73 WeakPolarHBondContact O-CG1 3.49Å; V69-I73 PolarHBondContact O-N 2.97Å; V69-I73 VanDerWaalsContact O-N 3.07Å |
| 70 | A | 70.1 | Confident | 68.5 | Low | 19 Ų | 19 | 87.5 Ų | 87.5 | 16% | 0.157 | 49% | 0.493 | C | S | . | . | H | α-helix | trans | -84.4 | -12.2 | -177.8 | 0 | 0 | 0 | 0 | 0 | 114.3 | Y60 K68 E72 I73 F74 | Y60-A70 HydrophobicContact CD2-CB 4.16Å; Y60-A70 HydrophobicContact CE1-CB 4.47Å; Y60-A70 HydrophobicContact CE2-CB 3.08Å; Y60-A70 WeakPolarHBondContact OH-CA 3.31Å; Y60-A70 WeakPolarHBondContact OH-CB 3.17Å; Y60-A70 PolarHBondContact OH-N 3.08Å; K68-A70 PolarHBondContact O-N 2.97Å; A70-E72 PolarHBondContact O-N 2.83Å; A70-I73 HydrophobicContact CB-CD1 4.21Å; A70-F74 VanDerWaalsContact O-CB 3.24Å; A70-F74 WeakPolarHBondContact O-CB 3.1Å; A70-F74 WeakPolarHBondContact O-CD2 3.16Å; A70-F74 PolarHBondContact O-N 2.8Å |
| 71 | V | 68.7 | Low | 69.1 | Low | 89 Ų | 89 | 90 Ų | 90 | 54% | 0.539 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -64 | -35.6 | 162.1 | 102.3 | 0 | 0 | 0 | 0 | 110.8 | Y60 F67 K68 F74 A75 | Y60-V71 PolarHBondContact OH-N 3.11Å; F67-V71 PolarHBondContact O-N 2.94Å; K68-V71 WeakPolarHBondContact O-CG1 3.34Å; K68-V71 PolarHBondContact O-N 2.93Å; V71-F74 PolarHBondContact O-N 3.09Å; V71-A75 PolarHBondContact O-N 3.5Å |
| 72 | E | 70.1 | Confident | 69.5 | Low | 127 Ų | 127 | 89 Ų | 89 | 59% | 0.593 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -69.9 | -45.1 | 178.5 | -153.3 | 171.7 | -167.7 | 0 | 0 | 111.1 | K68 V69 A70 F74 A75 I76 | K68-E72 PolarHBondContact O-N 3.35Å; V69-E72 VanDerWaalsContact O-CB 3.23Å; V69-E72 WeakPolarHBondContact O-CB 2.82Å; V69-E72 PolarHBondContact O-N 3.33Å; A70-E72 PolarHBondContact O-N 2.83Å; E72-F74 VanDerWaalsContact C-N 3.31Å; E72-F74 PolarHBondContact O-N 3Å; E72-A75 WeakPolarHBondContact O-CB 3.36Å; E72-A75 PolarHBondContact O-N 3.15Å; E72-A75 VanDerWaalsContact O-N 3.16Å; E72-I76 WeakPolarHBondContact O-CG1 3.41Å; E72-I76 PolarHBondContact O-N 3.27Å; E72-I76 VanDerWaalsContact O-N 3.08Å |
| 73 | I | 78.4 | Confident | 70.1 | Confident | 82 Ų | 82 | 90 Ų | 90 | 42% | 0.421 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -62.1 | -41 | 173.5 | -60.3 | 162.5 | 0 | 0 | 0 | 110.5 | V69 A70 A75 I76 L77 | V69-I73 HydrophobicContact CG1-CD1 3.77Å; V69-I73 HydrophobicContact CG1-CG1 4.48Å; V69-I73 WeakPolarHBondContact O-CG1 3.49Å; V69-I73 PolarHBondContact O-N 2.97Å; V69-I73 VanDerWaalsContact O-N 3.07Å; A70-I73 HydrophobicContact CB-CD1 4.21Å; I73-A75 VanDerWaalsContact C-N 3.31Å; I73-A75 PolarHBondContact O-N 2.9Å; I73-I76 PolarHBondContact O-N 2.89Å; I73-L77 HydrophobicContact CG2-CD1 3.79Å; I73-L77 HydrophobicContact CG2-CG 4.22Å; I73-L77 WeakPolarHBondContact O-CB 3.4Å; I73-L77 VanDerWaalsContact O-CG 3.24Å; I73-L77 WeakPolarHBondContact O-CG 3.29Å; I73-L77 PolarHBondContact O-N 3.36Å |
| 74 | F | 72.1 | Confident | 70.7 | Confident | 27 Ų | 27 | 89.4 Ų | 89.4 | 12% | 0.118 | 50% | 0.497 | C | S | . | . | H | α-helix | trans | -62.9 | -37.2 | 175.5 | -94.7 | -110.5 | 0 | 0 | 0 | 112.2 | W53 F56 A70 V71 E72 L77 A78 | W53-F74 HydrophobicContact CD2-CD1 4.25Å; W53-F74 AromaticContact CD2-CE1 3.88Å; W53-F74 HydrophobicContact CD2-CE1 3.88Å; W53-F74 AromaticContact CE2-CD1 3.42Å; W53-F74 VanDerWaalsContact CE2-CD1 3.42Å; W53-F74 AromaticContact CE2-CE1 3.51Å; W53-F74 HydrophobicContact CE3-CE1 4.03Å; W53-F74 HydrophobicContact CH2-CB 4.13Å; W53-F74 AromaticContact CH2-CD1 3.23Å; W53-F74 HydrophobicContact CH2-CD1 3.23Å; W53-F74 HydrophobicContact CH2-CD2 4.28Å; W53-F74 AromaticContact CH2-CE1 3.48Å; W53-F74 HydrophobicContact CH2-CE1 3.48Å; W53-F74 VanDerWaalsContact CH2-CE1 3.48Å; W53-F74 AromaticContact CH2-CG 3.64Å; W53-F74 HydrophobicContact CH2-CG 3.64Å; W53-F74 HydrophobicContact CH2-CZ 4.17Å; W53-F74 HydrophobicContact CZ2-CB 3.96Å; W53-F74 AromaticContact CZ2-CD1 2.9Å; W53-F74 HydrophobicContact CZ2-CD1 2.9Å; W53-F74 AromaticContact CZ2-CE1 3.39Å; W53-F74 HydrophobicContact CZ2-CE1 3.39Å; W53-F74 AromaticContact CZ2-CG 3.64Å; W53-F74 HydrophobicContact CZ2-CG 3.64Å; W53-F74 HydrophobicContact CZ2-CZ 4.47Å; W53-F74 HydrophobicContact CZ3-CD1 4.06Å; W53-F74 AromaticContact CZ3-CE1 3.82Å; W53-F74 HydrophobicContact CZ3-CE1 3.82Å; W53-F74 HydrophobicContact CZ3-CZ 4.28Å; W53-F74 AromaticContact NE1-CD1 3.99Å; F56-F74 HydrophobicContact CB-CZ 4.19Å; F56-F74 HydrophobicContact CD1-CE2 4.2Å; F56-F74 AromaticContact CD1-CZ 3.81Å; F56-F74 HydrophobicContact CD1-CZ 3.81Å; F56-F74 HydrophobicContact CG-CZ 4.39Å; A70-F74 VanDerWaalsContact O-CB 3.24Å; A70-F74 WeakPolarHBondContact O-CB 3.1Å; A70-F74 WeakPolarHBondContact O-CD2 3.16Å; A70-F74 PolarHBondContact O-N 2.8Å; V71-F74 PolarHBondContact O-N 3.09Å; E72-F74 VanDerWaalsContact C-N 3.31Å; E72-F74 PolarHBondContact O-N 3Å; F74-L77 PolarHBondContact O-N 2.93Å; F74-A78 WeakPolarHBondContact O-CB 3.44Å; F74-A78 PolarHBondContact O-N 3.35Å |
| 75 | A | 71.4 | Confident | 71.6 | Confident | 61 Ų | 61 | 82.1 Ų | 82.1 | 50% | 0.504 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -65.3 | -41.9 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | V71 E72 I73 A78 S79 | V71-A75 PolarHBondContact O-N 3.5Å; E72-A75 WeakPolarHBondContact O-CB 3.36Å; E72-A75 PolarHBondContact O-N 3.15Å; E72-A75 VanDerWaalsContact O-N 3.16Å; I73-A75 VanDerWaalsContact C-N 3.31Å; I73-A75 PolarHBondContact O-N 2.9Å; A75-A78 PolarHBondContact O-N 3.42Å; A75-S79 WeakPolarHBondContact O-CB 3.41Å; A75-S79 PolarHBondContact O-N 2.98Å |
| 76 | I | 83 | Confident | 72 | Confident | 113 Ų | 113 | 83.1 Ų | 83.1 | 58% | 0.579 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -64.7 | -45.1 | 176.1 | -63.2 | 165.1 | 0 | 0 | 0 | 110.7 | E72 I73 S79 S80 | E72-I76 WeakPolarHBondContact O-CG1 3.41Å; E72-I76 PolarHBondContact O-N 3.27Å; E72-I76 VanDerWaalsContact O-N 3.08Å; I73-I76 PolarHBondContact O-N 2.89Å; I76-S79 PolarHBondContact O-N 2.84Å; I76-S80 WeakPolarHBondContact O-CB 3.27Å; I76-S80 PolarHBondContact O-N 3.38Å; I76-S80 PolarHBondContact O-OG 3.43Å |
| 77 | L | 78.6 | Confident | 72.8 | Confident | 59 Ų | 59 | 77.6 Ų | 77.6 | 31% | 0.309 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -64.2 | -46.7 | 177 | -72.7 | 172.7 | 0 | 0 | 0 | 111.2 | W53 I73 F74 S79 S80 Y81 | W53-L77 HydrophobicContact CH2-CB 3.48Å; W53-L77 VanDerWaalsContact CH2-CB 3.48Å; W53-L77 HydrophobicContact CH2-CD1 3.87Å; W53-L77 HydrophobicContact CH2-CG 4.34Å; W53-L77 HydrophobicContact CZ2-CB 4.41Å; W53-L77 HydrophobicContact CZ3-CB 4Å; W53-L77 HydrophobicContact CZ3-CD1 3.97Å; I73-L77 HydrophobicContact CG2-CD1 3.79Å; I73-L77 HydrophobicContact CG2-CG 4.22Å; I73-L77 WeakPolarHBondContact O-CB 3.4Å; I73-L77 VanDerWaalsContact O-CG 3.24Å; I73-L77 WeakPolarHBondContact O-CG 3.29Å; I73-L77 PolarHBondContact O-N 3.36Å; F74-L77 PolarHBondContact O-N 2.93Å; L77-S79 VanDerWaalsContact C-N 3.31Å; L77-S79 PolarHBondContact O-N 3.48Å; L77-S80 WeakPolarHBondContact CA-OG 3.19Å; L77-S80 PolarHBondContact O-N 2.84Å; L77-S80 PolarHBondContact O-OG 2.82Å; L77-Y81 HydrophobicContact CB-CD2 4.42Å; L77-Y81 HydrophobicContact CD2-CE2 4.25Å; L77-Y81 WeakPolarHBondContact O-CB 3.27Å; L77-Y81 VanDerWaalsContact O-CD2 3.3Å; L77-Y81 WeakPolarHBondContact O-CD2 3.4Å; L77-Y81 PolarHBondContact O-N 3.49Å |
| 78 | A | 74.4 | Confident | 73.1 | Confident | 53 Ų | 53 | 80.4 Ų | 80.4 | 44% | 0.438 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -60.3 | -41.5 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | W53 F74 A75 G82 | W53-A78 HydrophobicContact CZ2-CB 4.34Å; F74-A78 WeakPolarHBondContact O-CB 3.44Å; F74-A78 PolarHBondContact O-N 3.35Å; A75-A78 PolarHBondContact O-N 3.42Å; A78-G82 PolarHBondContact O-N 3.48Å |
| 79 | S | 80.1 | Confident | 73 | Confident | 89 Ų | 89 | 74.1 Ų | 74.1 | 62% | 0.622 | 43% | 0.433 | S | S | * | . | H | α-helix | trans | -65.7 | -45.2 | 176.7 | -171.2 | 0 | 0 | 0 | 0 | 112 | A75 I76 L77 L83 | A75-S79 WeakPolarHBondContact O-CB 3.41Å; A75-S79 PolarHBondContact O-N 2.98Å; I76-S79 PolarHBondContact O-N 2.84Å; L77-S79 VanDerWaalsContact C-N 3.31Å; L77-S79 PolarHBondContact O-N 3.48Å; S79-L83 PolarHBondContact O-N 3Å; S79-L83 VanDerWaalsContact O-N 3.08Å |
| 80 | S | 80 | Confident | 72.5 | Confident | 54 Ų | 54 | 72.7 Ų | 72.7 | 38% | 0.378 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -69.1 | -42 | 179 | 54.3 | 0 | 0 | 0 | 0 | 112.7 | I76 L77 L83 L84 | I76-S80 WeakPolarHBondContact O-CB 3.27Å; I76-S80 PolarHBondContact O-N 3.38Å; I76-S80 PolarHBondContact O-OG 3.43Å; L77-S80 WeakPolarHBondContact CA-OG 3.19Å; L77-S80 PolarHBondContact O-N 2.84Å; L77-S80 PolarHBondContact O-OG 2.82Å; S80-L83 PolarHBondContact O-N 2.98Å; S80-L84 WeakPolarHBondContact O-CB 3.27Å; S80-L84 PolarHBondContact O-N 3.31Å |
| 81 | Y | 75.1 | Confident | 72.1 | Confident | 100 Ų | 100 | 78.3 Ų | 78.3 | 39% | 0.392 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -69.1 | -33.3 | 176 | -87.1 | -77.6 | 0 | 0 | 0 | 113.2 | F49 L77 G85 | F49-Y81 HydrophobicContact CD1-CD1 4.42Å; F49-Y81 AromaticContact CD2-CD1 3.86Å; F49-Y81 HydrophobicContact CD2-CD1 3.86Å; F49-Y81 AromaticContact CD2-CE1 3.74Å; F49-Y81 HydrophobicContact CD2-CE1 3.74Å; F49-Y81 AromaticContact CE1-CD1 3.74Å; F49-Y81 HydrophobicContact CE1-CD1 3.74Å; F49-Y81 HydrophobicContact CE1-CD2 4.34Å; F49-Y81 HydrophobicContact CE1-CE1 4.45Å; F49-Y81 AromaticContact CE1-CG 3.66Å; F49-Y81 HydrophobicContact CE1-CG 3.66Å; F49-Y81 AromaticContact CE2-CD1 3.12Å; F49-Y81 HydrophobicContact CE2-CD1 3.12Å; F49-Y81 AromaticContact CE2-CD2 3.94Å; F49-Y81 HydrophobicContact CE2-CD2 3.94Å; F49-Y81 AromaticContact CE2-CE1 2.98Å; F49-Y81 HydrophobicContact CE2-CE1 2.98Å; F49-Y81 AromaticContact CE2-CE2 3.83Å; F49-Y81 HydrophobicContact CE2-CE2 3.83Å; F49-Y81 AromaticContact CE2-CG 3.6Å; F49-Y81 HydrophobicContact CE2-CG 3.6Å; F49-Y81 AromaticContact CE2-CZ 3.34Å; F49-Y81 HydrophobicContact CG-CD1 4.48Å; F49-Y81 VanDerWaalsContact CZ-CB 3.49Å; F49-Y81 AromaticContact CZ-CD1 3.05Å; F49-Y81 HydrophobicContact CZ-CD1 3.05Å; F49-Y81 AromaticContact CZ-CD2 3.4Å; F49-Y81 HydrophobicContact CZ-CD2 3.4Å; F49-Y81 AromaticContact CZ-CE1 3.44Å; F49-Y81 HydrophobicContact CZ-CE1 3.44Å; F49-Y81 VanDerWaalsContact CZ-CE1 3.44Å; F49-Y81 AromaticContact CZ-CE2 3.74Å; F49-Y81 HydrophobicContact CZ-CE2 3.74Å; F49-Y81 AromaticContact CZ-CG 3.01Å; F49-Y81 HydrophobicContact CZ-CG 3.01Å; F49-Y81 AromaticContact CZ-CZ 3.74Å; L77-Y81 HydrophobicContact CB-CD2 4.42Å; L77-Y81 HydrophobicContact CD2-CE2 4.25Å; L77-Y81 WeakPolarHBondContact O-CB 3.27Å; L77-Y81 VanDerWaalsContact O-CD2 3.3Å; L77-Y81 WeakPolarHBondContact O-CD2 3.4Å; L77-Y81 PolarHBondContact O-N 3.49Å; Y81-G85 WeakPolarHBondContact O-CA 3.44Å; Y81-G85 PolarHBondContact O-N 3.45Å |
| 82 | G | 71 | Confident | 71.7 | Confident | 41 Ų | 41 | 77.4 Ų | 77.4 | 42% | 0.423 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -62.2 | -46 | 170.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | A78 C86 | A78-G82 PolarHBondContact O-N 3.48Å; G82-C86 VanDerWaalsContact O-CB 3.32Å; G82-C86 WeakPolarHBondContact O-CB 3.16Å; G82-C86 PolarHBondContact O-N 3.2Å |
| 83 | L | 73.2 | Confident | 71.3 | Confident | 122 Ų | 122 | 73.6 Ų | 73.6 | 64% | 0.639 | 43% | 0.425 | S | S | * | . | H | α-helix | trans | -68.3 | -44.3 | 177.5 | -170.1 | 71.5 | 0 | 0 | 0 | 112 | S79 S80 C86 V87 | S79-L83 PolarHBondContact O-N 3Å; S79-L83 VanDerWaalsContact O-N 3.08Å; S80-L83 PolarHBondContact O-N 2.98Å; L83-C86 PolarHBondContact O-N 3.26Å; L83-V87 WeakPolarHBondContact O-CG2 3.35Å; L83-V87 PolarHBondContact O-N 2.81Å |
| 84 | L | 74.5 | Confident | 70.8 | Confident | 90 Ų | 90 | 74.6 Ų | 74.6 | 47% | 0.471 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -63.8 | -45.9 | 179.1 | -158.8 | 74.3 | 0 | 0 | 0 | 110 | S80 V87 F88 | S80-L84 WeakPolarHBondContact O-CB 3.27Å; S80-L84 PolarHBondContact O-N 3.31Å; L84-V87 PolarHBondContact O-N 2.78Å; L84-F88 HydrophobicContact CD1-CD2 3.51Å; L84-F88 HydrophobicContact CD1-CE2 3.23Å; L84-F88 HydrophobicContact CD1-CZ 4.18Å; L84-F88 HydrophobicContact CG-CD2 3.66Å; L84-F88 HydrophobicContact CG-CE2 3.9Å; L84-F88 HydrophobicContact CG-CG 4.46Å; L84-F88 WeakPolarHBondContact O-CB 3.32Å; L84-F88 VanDerWaalsContact O-CD2 3.32Å; L84-F88 WeakPolarHBondContact O-CD2 3.39Å; L84-F88 PolarHBondContact O-N 2.99Å |
| 85 | G | 72.5 | Confident | 70.6 | Confident | 15 Ų | 15 | 78.9 Ų | 78.9 | 16% | 0.155 | 45% | 0.453 | C | S | . | . | H | α-helix | trans | -57.2 | -51.1 | 171.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | Y81 V87 L89 | Y81-G85 WeakPolarHBondContact O-CA 3.44Å; Y81-G85 PolarHBondContact O-N 3.45Å; G85-V87 VanDerWaalsContact C-N 3.29Å; G85-V87 PolarHBondContact O-N 3.42Å; G85-L89 WeakPolarHBondContact O-CB 3.35Å; G85-L89 WeakPolarHBondContact O-CG 3.04Å; G85-L89 PolarHBondContact O-N 3.22Å |
| 86 | C | 66.7 | Low | 70.1 | Confident | 93 Ų | 93 | 81.8 Ų | 81.8 | 63% | 0.628 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -58.8 | -34.6 | 179.2 | -92.1 | 0 | 0 | 0 | 0 | 114.2 | G82 L83 P90 | G82-C86 VanDerWaalsContact O-CB 3.32Å; G82-C86 WeakPolarHBondContact O-CB 3.16Å; G82-C86 PolarHBondContact O-N 3.2Å; L83-C86 PolarHBondContact O-N 3.26Å; C86-P90 WeakPolarHBondContact O-CD 3.43Å; C86-P90 VanDerWaalsContact O-CG 3.32Å; C86-P90 WeakPolarHBondContact O-CG 3.49Å |
| 87 | V | 72.5 | Confident | 68.9 | Low | 71 Ų | 71 | 79.7 Ų | 79.7 | 43% | 0.43 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -91.8 | -36 | -177.5 | 178 | 0 | 0 | 0 | 0 | 112.5 | L83 L84 G85 P90 | L83-V87 WeakPolarHBondContact O-CG2 3.35Å; L83-V87 PolarHBondContact O-N 2.81Å; L84-V87 PolarHBondContact O-N 2.78Å; G85-V87 VanDerWaalsContact C-N 3.29Å; G85-V87 PolarHBondContact O-N 3.42Å; V87-P90 WeakPolarHBondContact O-CD 3.31Å; V87-P90 WeakPolarHBondContact O-CG 3.42Å |
| 88 | F | 66.5 | Low | 67.6 | Low | 114 Ų | 114 | 87.3 Ų | 87.3 | 50% | 0.5 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -80.9 | -32.4 | -179.1 | -83 | -100.9 | 0 | 0 | 0 | 112.8 | L84 K91 C92 | L84-F88 HydrophobicContact CD1-CD2 3.51Å; L84-F88 HydrophobicContact CD1-CE2 3.23Å; L84-F88 HydrophobicContact CD1-CZ 4.18Å; L84-F88 HydrophobicContact CG-CD2 3.66Å; L84-F88 HydrophobicContact CG-CE2 3.9Å; L84-F88 HydrophobicContact CG-CG 4.46Å; L84-F88 WeakPolarHBondContact O-CB 3.32Å; L84-F88 VanDerWaalsContact O-CD2 3.32Å; L84-F88 WeakPolarHBondContact O-CD2 3.39Å; L84-F88 PolarHBondContact O-N 2.99Å; F88-K91 PolarHBondContact O-N 2.78Å; F88-C92 VanDerWaalsContact O-CB 3.25Å; F88-C92 WeakPolarHBondContact O-CB 3.47Å; F88-C92 PolarHBondContact O-N 3.45Å; F88-C92 PolarHBondContact O-SG 2.83Å |
| 89 | L | 63.5 | Low | 66.6 | Low | 48 Ų | 48 | 87.7 Ų | 87.7 | 25% | 0.251 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -53.8 | -50.6 | 174.7 | -78.7 | -171.9 | 0 | 0 | 0 | 113.4 | I42 M46 G85 F93 | I42-L89 HydrophobicContact CB-CD2 4.2Å; I42-L89 HydrophobicContact CG1-CD2 4.25Å; I42-L89 HydrophobicContact CG2-CD1 3.79Å; I42-L89 HydrophobicContact CG2-CD2 3.61Å; I42-L89 HydrophobicContact CG2-CG 4.22Å; M46-L89 HydrophobicContact CE-CD1 3.14Å; M46-L89 HydrophobicContact CE-CG 3.8Å; M46-L89 HydrophobicContact CG-CD1 3.93Å; M46-L89 HydrophobicContact CG-CD2 4.39Å; M46-L89 HydrophobicContact SD-CD1 4.23Å; G85-L89 WeakPolarHBondContact O-CB 3.35Å; G85-L89 WeakPolarHBondContact O-CG 3.04Å; G85-L89 PolarHBondContact O-N 3.22Å; L89-F93 WeakPolarHBondContact O-CB 3.43Å; L89-F93 PolarHBondContact O-N 3.14Å; L89-F93 VanDerWaalsContact O-N 3.11Å |
| 90 | P | 59.8 | Low | 65.3 | Low | 60 Ų | 60 | 93 Ų | 93 | 39% | 0.39 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -69.4 | -38.9 | 177.8 | 24.9 | -32.7 | 0 | 0 | 0 | 112.1 | C86 V87 I94 | C86-P90 WeakPolarHBondContact O-CD 3.43Å; C86-P90 VanDerWaalsContact O-CG 3.32Å; C86-P90 WeakPolarHBondContact O-CG 3.49Å; V87-P90 WeakPolarHBondContact O-CD 3.31Å; V87-P90 WeakPolarHBondContact O-CG 3.42Å; P90-I94 WeakPolarHBondContact O-CB 3.06Å; P90-I94 VanDerWaalsContact O-CD1 3.31Å; P90-I94 WeakPolarHBondContact O-CD1 3.32Å; P90-I94 WeakPolarHBondContact O-CG1 3.24Å; P90-I94 PolarHBondContact O-N 2.75Å |
| 91 | K | 62.7 | Low | 64 | Low | 137 Ų | 137 | 100.4 Ų | 100.4 | 60% | 0.596 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -69.1 | -47.4 | -179.1 | -91.6 | -155.6 | 168.1 | 114.2 | 0 | 113.5 | F88 F93 I94 I95 | F88-K91 PolarHBondContact O-N 2.78Å; K91-F93 VanDerWaalsContact C-N 3.32Å; K91-I94 PolarHBondContact O-N 3.33Å; K91-I95 WeakPolarHBondContact O-CB 3.19Å; K91-I95 WeakPolarHBondContact O-CD1 3.31Å; K91-I95 VanDerWaalsContact O-CG1 3.27Å; K91-I95 WeakPolarHBondContact O-CG1 3.48Å; K91-I95 PolarHBondContact O-N 2.92Å |
| 92 | C | 60.7 | Low | 62.9 | Low | 70 Ų | 70 | 100.8 Ų | 100.8 | 47% | 0.473 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -65.9 | -37.4 | 176.5 | -68.1 | 0 | 0 | 0 | 0 | 111.2 | F88 I95 L96 | F88-C92 VanDerWaalsContact O-CB 3.25Å; F88-C92 WeakPolarHBondContact O-CB 3.47Å; F88-C92 PolarHBondContact O-N 3.45Å; F88-C92 PolarHBondContact O-SG 2.83Å; C92-I95 PolarHBondContact O-N 3.37Å; C92-L96 WeakPolarHBondContact O-CB 3.25Å; C92-L96 PolarHBondContact O-N 2.81Å |
| 93 | F | 60.6 | Low | 62.1 | Low | 46 Ų | 46 | 104 Ų | 104 | 20% | 0.202 | 52% | 0.524 | C | S | . | . | H | α-helix | trans | -63.5 | -45.7 | 175.6 | -179.7 | -106.2 | 0 | 0 | 0 | 112.5 | R30 E38 I42 L89 K91 I95 L96 L97 | R30-F93 VanDerWaalsContact NH1-CZ 3.31Å; E38-F93 HydrophobicContact CB-CE2 4.02Å; E38-F93 HydrophobicContact CB-CZ 4.47Å; I42-F93 HydrophobicContact CD1-CB 3.91Å; I42-F93 HydrophobicContact CD1-CD2 3.18Å; I42-F93 HydrophobicContact CD1-CE2 3.73Å; I42-F93 HydrophobicContact CD1-CG 3.63Å; I42-F93 HydrophobicContact CG1-CB 4.38Å; I42-F93 HydrophobicContact CG1-CD2 4.07Å; L89-F93 WeakPolarHBondContact O-CB 3.43Å; L89-F93 PolarHBondContact O-N 3.14Å; L89-F93 VanDerWaalsContact O-N 3.11Å; K91-F93 VanDerWaalsContact C-N 3.32Å; F93-I95 PolarHBondContact O-N 3.34Å; F93-L96 PolarHBondContact O-N 2.83Å; F93-L97 HydrophobicContact CD1-CD1 4.37Å; F93-L97 HydrophobicContact CD2-CD1 3.91Å; F93-L97 HydrophobicContact CE1-CD1 3.94Å; F93-L97 HydrophobicContact CE1-CD2 3.94Å; F93-L97 HydrophobicContact CE2-CD1 3.45Å; F93-L97 VanDerWaalsContact CE2-CD1 3.45Å; F93-L97 HydrophobicContact CG-CD1 4.36Å; F93-L97 HydrophobicContact CZ-CD1 3.45Å; F93-L97 VanDerWaalsContact CZ-CD1 3.45Å; F93-L97 HydrophobicContact CZ-CD2 4.04Å; F93-L97 HydrophobicContact CZ-CG 4.41Å; F93-L97 WeakPolarHBondContact O-CB 3.31Å; F93-L97 PolarHBondContact O-N 3.45Å |
| 94 | I | 67.8 | Low | 61.1 | Low | 104 Ų | 104 | 105.7 Ų | 105.7 | 53% | 0.533 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -64.3 | -41.2 | 178.4 | -69.5 | 163.8 | 0 | 0 | 0 | 111.3 | P90 K91 R98 | P90-I94 WeakPolarHBondContact O-CB 3.06Å; P90-I94 VanDerWaalsContact O-CD1 3.31Å; P90-I94 WeakPolarHBondContact O-CD1 3.32Å; P90-I94 WeakPolarHBondContact O-CG1 3.24Å; P90-I94 PolarHBondContact O-N 2.75Å; K91-I94 PolarHBondContact O-N 3.33Å; I94-R98 PolarHBondContact O-N 3.49Å |
| 95 | I | 67.8 | Low | 60.1 | Low | 116 Ų | 116 | 107.9 Ų | 107.9 | 60% | 0.595 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -68.1 | -37.2 | 177.8 | -69.5 | 165.1 | 0 | 0 | 0 | 111.2 | K91 C92 F93 R98 P99 | K91-I95 WeakPolarHBondContact O-CB 3.19Å; K91-I95 WeakPolarHBondContact O-CD1 3.31Å; K91-I95 VanDerWaalsContact O-CG1 3.27Å; K91-I95 WeakPolarHBondContact O-CG1 3.48Å; K91-I95 PolarHBondContact O-N 2.92Å; C92-I95 PolarHBondContact O-N 3.37Å; F93-I95 PolarHBondContact O-N 3.34Å; I95-R98 CarbonylContact O-C 3.47Å; I95-R98 PolarHBondContact O-N 2.88Å; I95-P99 WeakPolarHBondContact O-CD 3.3Å; I95-P99 WeakPolarHBondContact O-CG 3.07Å |
| 96 | L | 61.4 | Low | 59.2 | Low | 122 Ų | 122 | 112.3 Ų | 112.3 | 64% | 0.639 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -84.7 | -15.1 | -179.9 | -152.8 | 108.7 | 0 | 0 | 0 | 114.3 | C92 F93 P99 | C92-L96 WeakPolarHBondContact O-CB 3.25Å; C92-L96 PolarHBondContact O-N 2.81Å; F93-L96 PolarHBondContact O-N 2.83Å; L96-P99 HydrophobicContact CG-CG 4.42Å; L96-P99 WeakPolarHBondContact O-CD 3.22Å; L96-P99 VanDerWaalsContact O-CG 3.31Å; L96-P99 WeakPolarHBondContact O-CG 3.45Å |
| 97 | L | 57.8 | Low | 58.6 | Low | 70 Ų | 70 | 114.2 Ų | 114.2 | 37% | 0.366 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -74.8 | -30.6 | 161 | -112 | 68.2 | 0 | 0 | 0 | 111.8 | E38 F93 | E38-L97 HydrophobicContact CB-CD1 4.13Å; E38-L97 HydrophobicContact CG-CD1 3.98Å; E38-L97 WeakPolarHBondContact OE1-CD1 3.24Å; E38-L97 WeakPolarHBondContact OE1-CG 3.11Å; E38-L97 WeakPolarHBondContact OE2-CD1 3.4Å; F93-L97 HydrophobicContact CD1-CD1 4.37Å; F93-L97 HydrophobicContact CD2-CD1 3.91Å; F93-L97 HydrophobicContact CE1-CD1 3.94Å; F93-L97 HydrophobicContact CE1-CD2 3.94Å; F93-L97 HydrophobicContact CE2-CD1 3.45Å; F93-L97 VanDerWaalsContact CE2-CD1 3.45Å; F93-L97 HydrophobicContact CG-CD1 4.36Å; F93-L97 HydrophobicContact CZ-CD1 3.45Å; F93-L97 VanDerWaalsContact CZ-CD1 3.45Å; F93-L97 HydrophobicContact CZ-CD2 4.04Å; F93-L97 HydrophobicContact CZ-CG 4.41Å; F93-L97 WeakPolarHBondContact O-CB 3.31Å; F93-L97 PolarHBondContact O-N 3.45Å |
| 98 | R | 51.7 | Low | 57.7 | Low | 219 Ų | 219 | 114.3 Ų | 114.3 | 83% | 0.826 | 59% | 0.589 | S | S | * | * | S | Bend | trans | -94.3 | 24.5 | 176.9 | -74.6 | -140.2 | -173.6 | -150.8 | 5.3 | 119.2 | I94 I95 | I94-R98 PolarHBondContact O-N 3.49Å; I95-R98 CarbonylContact O-C 3.47Å; I95-R98 PolarHBondContact O-N 2.88Å |
| 99 | P | 53.7 | Low | 57 | Low | 61 Ų | 61 | 112.4 Ų | 112.4 | 40% | 0.396 | 60% | 0.601 | S | S | . | * | S | Bend | trans | -95.8 | -22.8 | 164.6 | 4.9 | 13.9 | 0 | 0 | 0 | 112.4 | I95 L96 R101 N102 | I95-P99 WeakPolarHBondContact O-CD 3.3Å; I95-P99 WeakPolarHBondContact O-CG 3.07Å; L96-P99 HydrophobicContact CG-CG 4.42Å; L96-P99 WeakPolarHBondContact O-CD 3.22Å; L96-P99 VanDerWaalsContact O-CG 3.31Å; L96-P99 WeakPolarHBondContact O-CG 3.45Å; P99-R101 PolarHBondContact O-N 2.78Å; P99-N102 PolarHBondContact O-N 2.95Å |
| 100 | K | 52.5 | Low | 56.1 | Low | 199 Ų | 199 | 121.2 Ų | 121.2 | 87% | 0.865 | 63% | 0.631 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.5 | 33.9 | -172.6 | -158.4 | -178.5 | 165.8 | 72.4 | 0 | 113.3 | ||
| 101 | R | 52.7 | Low | 55.7 | Low | 211 Ų | 211 | 123.6 Ų | 123.6 | 80% | 0.796 | 65% | 0.645 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -149.6 | 25.4 | 170.3 | -141.9 | -169.1 | 73.4 | 129.5 | 6.5 | 112.3 | P99 | P99-R101 PolarHBondContact O-N 2.78Š|
| 102 | N | 51 | Low | 54.9 | Low | 108 Ų | 108 | 123.4 Ų | 123.4 | 58% | 0.578 | 66% | 0.657 | S | S | * | * | S | Bend | trans | -132.5 | 12.2 | 175.7 | -163.9 | 62.9 | 0 | 0 | 0 | 113.3 | P99 | P99-N102 PolarHBondContact O-N 2.95Š|
| 103 | T | 54.3 | Low | 54.1 | Low | 109 Ų | 109 | 126 Ų | 126 | 67% | 0.669 | 67% | 0.671 | S | S | * | * | S | Bend | trans | -123.5 | 38 | 176.4 | -40.2 | 0 | 0 | 0 | 0 | 112.1 | ||
| 104 | D | 52.5 | Low | 53.8 | Low | 157 Ų | 157 | 131.8 Ų | 131.8 | 84% | 0.84 | 70% | 0.703 | S | S | * | * | S | Bend | trans | -128.9 | -8.2 | 158 | -91.7 | -53.3 | 0 | 0 | 0 | 114.1 | ||
| 105 | E | 53.9 | Low | 52.5 | Low | 135 Ų | 135 | 132.5 Ų | 132.5 | 63% | 0.631 | 71% | 0.708 | S | S | * | * | S | Bend | trans | -104.6 | -9.9 | -178.5 | -2.9 | -80.3 | 170.7 | 0 | 0 | 115.2 | ||
| 106 | T | 54.1 | Low | 51.6 | Low | 109 Ų | 109 | 135 Ų | 135 | 67% | 0.669 | 72% | 0.715 | S | S | * | * | S | Bend | trans | -137.1 | 27.9 | -170.4 | -37.8 | 0 | 0 | 0 | 0 | 114.9 | ||
| 107 | V | 52.6 | Low | 50.4 | Low | 133 Ų | 133 | 134.7 Ų | 134.7 | 81% | 0.806 | 72% | 0.723 | S | S | * | * | trans | -122 | 40.6 | 158.5 | -168.9 | 0 | 0 | 0 | 0 | 109.6 | G109 | V107-G109 VanDerWaalsContact C-N 3.32Š| ||
| 108 | G | 54.6 | Low | 50 | Low | 72 Ų | 72 | 139.4 Ų | 139.4 | 74% | 0.742 | 75% | 0.747 | S | S | * | * | trans | -99.1 | 42.2 | 161.1 | 0 | 0 | 0 | 0 | 0 | 110.8 | R110 | G108-R110 PolarHBondContact O-N 3.32Š| ||
| 109 | G | 50.8 | Low | 49.3 | Very low | 74 Ų | 74 | 136.6 Ų | 136.6 | 76% | 0.763 | 74% | 0.743 | S | S | * | * | trans | -67.6 | 83.6 | 170.7 | 0 | 0 | 0 | 0 | 0 | 110.2 | V107 | V107-G109 VanDerWaalsContact C-N 3.32Š| ||
| 110 | R | 45.3 | Very low | 48.7 | Very low | 233 Ų | 233 | 141.2 Ų | 141.2 | 88% | 0.879 | 76% | 0.763 | S | S | * | * | trans | -124 | 95.2 | 158.3 | -75.2 | -155.5 | -80.6 | 176.9 | -5.2 | 109.2 | G108 | G108-R110 PolarHBondContact O-N 3.32Š| ||
| 111 | V | 51.6 | Low | 48.4 | Very low | 111 Ų | 111 | 137.8 Ų | 137.8 | 67% | 0.673 | 76% | 0.759 | S | S | * | * | trans | 26.5 | 125.7 | 136.6 | -173.1 | 0 | 0 | 0 | 0 | 116.5 | T113 | V111-T113 HydrophobicContact CG1-CG2 4.29Å; V111-T113 PolarHBondContact O-N 3.04Å | ||
| 112 | P | 46.6 | Very low | 47.9 | Very low | 133 Ų | 133 | 131.8 Ų | 131.8 | 86% | 0.864 | 75% | 0.749 | S | S | * | * | trans | -72.2 | 92.6 | 170.1 | 30.7 | -30.5 | 0 | 0 | 0 | 109.7 | L114 | P112-L114 PolarHBondContact O-N 3.46Š| ||
| 113 | T | 43.2 | Very low | 47.7 | Very low | 123 Ų | 123 | 131 Ų | 131 | 76% | 0.755 | 76% | 0.758 | S | S | * | * | trans | -89.4 | 92.1 | 159.8 | 50.8 | 0 | 0 | 0 | 0 | 108.6 | V111 D115 | V111-T113 HydrophobicContact CG1-CG2 4.29Å; V111-T113 PolarHBondContact O-N 3.04Å; T113-D115 PolarHBondContact O-N 2.89Å | ||
| 114 | L | 54.5 | Low | 46.8 | Very low | 169 Ų | 169 | 130.6 Ų | 130.6 | 89% | 0.885 | 76% | 0.76 | S | S | * | * | trans | -43.6 | 114.7 | 147.5 | -177.2 | 87.9 | 0 | 0 | 0 | 109.1 | P112 | P112-L114 PolarHBondContact O-N 3.46Š| ||
| 115 | D | 40.1 | Very low | 46.5 | Very low | 119 Ų | 119 | 128.7 Ų | 128.7 | 64% | 0.636 | 75% | 0.754 | S | S | * | * | 170.7 | 139.9 | 129.8 | -171 | -134.4 | 0 | 0 | 0 | 111.5 | T113 | T113-D115 PolarHBondContact O-N 2.89Š| |||
| 116 | K | 48.4 | Very low | 46.1 | Very low | 169 Ų | 169 | 126.5 Ų | 126.5 | 74% | 0.735 | 75% | 0.753 | S | S | * | * | trans | 65 | 95.5 | 169.9 | -78.2 | 179.5 | -170.8 | 78.9 | 0 | 118.8 | ||||
| 117 | S | 36.5 | Very low | 45.5 | Very low | 115 Ų | 115 | 124.4 Ų | 124.4 | 80% | 0.804 | 74% | 0.743 | S | S | * | * | 177.4 | 76.7 | 106.1 | 35.3 | 0 | 0 | 0 | 0 | 111.9 | Q119 | S117-Q119 PolarHBondContact O-N 3.2Š| |||
| 118 | I | 49.3 | Very low | 45.3 | Very low | 169 Ų | 169 | 124.5 Ų | 124.5 | 87% | 0.867 | 74% | 0.735 | S | S | * | * | trans | -53 | 106.7 | 142.3 | -64.8 | 167.6 | 0 | 0 | 0 | 105.2 | ||||
| 119 | Q | 38.2 | Very low | 45 | Very low | 160 Ų | 160 | 127.7 Ų | 127.7 | 75% | 0.748 | 73% | 0.734 | S | S | * | * | trans | 166.2 | 59 | 161.1 | -91.1 | -80 | 75.2 | 0 | 0 | 113 | S117 | S117-Q119 PolarHBondContact O-N 3.2Š| ||
| 120 | L | 39.4 | Very low | 44.7 | Very low | 157 Ų | 157 | 129.2 Ų | 129.2 | 82% | 0.822 | 73% | 0.725 | S | S | * | * | trans | -174.8 | 67 | 147.5 | -126.6 | 68.6 | 0 | 0 | 0 | 110.4 | ||||
| 121 | T | 47.1 | Very low | 44.9 | Very low | 128 Ų | 128 | 123.3 Ų | 123.3 | 79% | 0.785 | 71% | 0.71 | S | S | * | * | -6.6 | 105.7 | 95.4 | -54.9 | 0 | 0 | 0 | 0 | 114 | |||||
| 122 | S | 42.3 | Very low | 44.9 | Very low | 84 Ų | 84 | 121.9 Ų | 121.9 | 59% | 0.587 | 70% | 0.702 | S | S | * | * | trans | 161.9 | -5.8 | 130.3 | 49.5 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 123 | A | 47.1 | Very low | 45 | Very low | 93 Ų | 93 | 118.7 Ų | 118.7 | 77% | 0.769 | 69% | 0.687 | S | S | * | * | S | Bend | trans | -96.7 | -30.2 | -174.7 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||
| 124 | S | 35.6 | Very low | 45.1 | Very low | 99 Ų | 99 | 120.3 Ų | 120.3 | 69% | 0.692 | 69% | 0.686 | S | S | * | * | S | Bend | trans | -97.2 | -11.2 | -177.3 | -163.4 | 0 | 0 | 0 | 0 | 114.8 | S126 S127 | S124-S126 VanDerWaalsContact C-N 3.33Å; S124-S127 PolarHBondContact O-OG 3.32Å |
| 125 | V | 45.5 | Very low | 44.7 | Very low | 118 Ų | 118 | 116.5 Ų | 116.5 | 72% | 0.715 | 67% | 0.673 | S | S | * | * | S | Bend | trans | -82.4 | -15 | 175 | 179.2 | 0 | 0 | 0 | 0 | 111.4 | ||
| 126 | S | 45.9 | Very low | 45.2 | Very low | 89 Ų | 89 | 117.4 Ų | 117.4 | 62% | 0.622 | 68% | 0.677 | S | S | * | * | H | α-helix | trans | -82.5 | -21 | -178.6 | -153.5 | 0 | 0 | 0 | 0 | 114.2 | S124 | S124-S126 VanDerWaalsContact C-N 3.33Å |
| 127 | S | 42 | Very low | 45.4 | Very low | 64 Ų | 64 | 115 Ų | 115 | 45% | 0.448 | 68% | 0.676 | S | S | . | * | H | α-helix | trans | -82.4 | -22.3 | 177.3 | 48.6 | 0 | 0 | 0 | 0 | 113.3 | S124 N131 | S124-S127 PolarHBondContact O-OG 3.32Å; S127-N131 PolarHBondContact O-ND2 3.31Å |
| 128 | E | 47.2 | Very low | 45.6 | Very low | 136 Ų | 136 | 117.6 Ų | 117.6 | 64% | 0.636 | 68% | 0.68 | S | S | * | * | H | α-helix | trans | -86.6 | -17.7 | 176.9 | -76.8 | -76.8 | 99.3 | 0 | 0 | 113.1 | T132 | E128-T132 PolarHBondContact O-OG1 3.47Å |
| 129 | L | 48.8 | Very low | 45.2 | Very low | 139 Ų | 139 | 117.4 Ų | 117.4 | 73% | 0.728 | 68% | 0.681 | S | S | * | * | H | α-helix | trans | -87.8 | -17.5 | 177.4 | -157.3 | 75 | 0 | 0 | 0 | 113.9 | ||
| 130 | N | 45.3 | Very low | 45.4 | Very low | 106 Ų | 106 | 122.3 Ų | 122.3 | 57% | 0.567 | 70% | 0.704 | S | S | * | * | H | α-helix | trans | -79.2 | -40.3 | 176 | -179.9 | 7.8 | 0 | 0 | 0 | 111.6 | T132 | N130-T132 PolarHBondContact O-N 2.93Å |
| 131 | N | 48.5 | Very low | 45.7 | Very low | 108 Ų | 108 | 120.6 Ų | 120.6 | 58% | 0.578 | 70% | 0.698 | S | S | * | * | H | α-helix | trans | -86 | -8.1 | -173 | -63.6 | -66.9 | 0 | 0 | 0 | 114.4 | S127 | S127-N131 PolarHBondContact O-ND2 3.31Å |
| 132 | T | 50.8 | Low | 45.6 | Very low | 81 Ų | 81 | 120.2 Ų | 120.2 | 50% | 0.497 | 69% | 0.693 | S | S | . | * | H | α-helix | trans | -107.1 | -15.4 | 178.4 | -50.6 | 0 | 0 | 0 | 0 | 113.2 | E128 N130 | E128-T132 PolarHBondContact O-OG1 3.47Å; N130-T132 PolarHBondContact O-N 2.93Å |
| 133 | A | 49.1 | Very low | 45.8 | Very low | 66 Ų | 66 | 122.2 Ų | 122.2 | 55% | 0.545 | 70% | 0.699 | S | S | . | * | H | α-helix | trans | -84.8 | -19.6 | 173.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||
| 134 | E | 45.6 | Very low | 45.7 | Very low | 157 Ų | 157 | 123.9 Ų | 123.9 | 73% | 0.734 | 70% | 0.695 | S | S | * | * | S | Bend | trans | -86.5 | -12.9 | 179.7 | -138.4 | -172.9 | 139.3 | 0 | 0 | 113.5 | ||
| 135 | S | 46.3 | Very low | 46.3 | Very low | 90 Ų | 90 | 125.4 Ų | 125.4 | 63% | 0.629 | 70% | 0.695 | S | S | * | * | S | Bend | trans | -100.2 | 5.1 | -175.9 | 48.2 | 0 | 0 | 0 | 0 | 115.2 | ||
| 136 | I | 50.8 | Low | 46.4 | Very low | 137 Ų | 137 | 125.9 Ų | 125.9 | 70% | 0.703 | 69% | 0.694 | S | S | * | * | S | Bend | trans | -119.6 | 1.6 | 179.6 | -56.6 | 178.9 | 0 | 0 | 0 | 113.1 | ||
| 137 | V | 52.3 | Low | 46.4 | Very low | 120 Ų | 120 | 128.6 Ų | 128.6 | 73% | 0.727 | 70% | 0.699 | S | S | * | * | S | Bend | trans | -117.8 | 18.6 | -175.6 | -170.3 | 0 | 0 | 0 | 0 | 114.5 | ||
| 138 | L | 41.1 | Very low | 46.8 | Very low | 168 Ų | 168 | 133.5 Ų | 133.5 | 88% | 0.88 | 72% | 0.718 | S | S | * | * | trans | -127.8 | 40.3 | 169.8 | -84.3 | 165.4 | 0 | 0 | 0 | 112.5 | ||||
| 139 | D | 41.1 | Very low | 46.7 | Very low | 165 Ų | 165 | 133.3 Ų | 133.3 | 88% | 0.882 | 73% | 0.725 | S | S | * | * | trans | -118.8 | 76.5 | 151.9 | -157.9 | -93.9 | 0 | 0 | 0 | 107.5 | ||||
| 140 | E | 41.4 | Very low | 46.6 | Very low | 263 Ų | 263 | 132.8 Ų | 132.8 | 100% | 1.229 | 73% | 0.725 | S | S | * | * | trans | -155.8 | 0 | 148.7 | -155.6 | 171.3 | 99.5 | 0 | 0 | 110.2 |
Retrieved 140 of 140 residues in 295.4 ms
(Link to these results)