| 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 | 44.8 | Very low | 64 | Low | 251 Ų | 251 | 121.6 Ų | 121.6 | 100% | 1.236 | 62% | 0.621 | S | S | * | * | 0 | 121.6 | 0 | -116.1 | 165.4 | 174.9 | 0 | 0 | 108.9 | |||||
| 2 | G | 48.2 | Very low | 65.7 | Low | 64 Ų | 64 | 115.8 Ų | 115.8 | 66% | 0.66 | 59% | 0.588 | S | S | * | * | trans | 138.9 | 0.3 | 154.6 | 0 | 0 | 0 | 0 | 0 | 123.1 | ||||
| 3 | R | 43.4 | Very low | 67.3 | Low | 254 Ų | 254 | 119.1 Ų | 119.1 | 96% | 0.958 | 59% | 0.59 | S | S | * | * | S | Bend | trans | -90.3 | -12.1 | -178.2 | -123.1 | 163.9 | 83.9 | 166.2 | 3.4 | 116.3 | ||
| 4 | F | 50.8 | Low | 68.7 | Low | 196 Ų | 196 | 118.1 Ų | 118.1 | 86% | 0.86 | 59% | 0.588 | S | S | * | * | S | Bend | trans | -89.6 | -0.7 | 177.3 | -91.9 | -88.3 | 0 | 0 | 0 | 115 | ||
| 5 | R | 58.8 | Low | 69.8 | Low | 182 Ų | 182 | 111.1 Ų | 111.1 | 69% | 0.687 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -82.4 | -18.9 | -170 | -137.3 | 169.8 | 178.2 | -167.1 | -0.9 | 113.8 | R9 | R5-R9 WeakPolarHBondContact O-CG 3.38Å; R5-R9 PolarHBondContact O-NE 2.83Å; R5-R9 PolarHBondContact O-NH2 3.38Å |
| 6 | G | 65.9 | Low | 71 | Confident | 44 Ų | 44 | 107.1 Ų | 107.1 | 45% | 0.454 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -78.2 | -53.3 | -178.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | L8 R9 C10 | G6-L8 PolarHBondContact O-N 3.29Å; G6-R9 WeakPolarHBondContact O-CB 3.45Å; G6-R9 PolarHBondContact O-N 3.01Å; G6-C10 PolarHBondContact O-N 2.71Å; G6-C10 VanDerWaalsContact O-N 3.12Å |
| 7 | G | 74.4 | Confident | 72.2 | Confident | 48 Ų | 48 | 103.2 Ų | 103.2 | 50% | 0.495 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -63.2 | -41.6 | -177.2 | 0 | 0 | 0 | 0 | 0 | 113.5 | R9 C10 I11 | G7-R9 VanDerWaalsContact C-N 3.31Å; G7-R9 PolarHBondContact O-N 3.36Å; G7-C10 WeakPolarHBondContact O-CB 3.49Å; G7-C10 PolarHBondContact O-N 2.96Å; G7-C10 VanDerWaalsContact O-N 3.17Å; G7-I11 WeakPolarHBondContact O-CG1 3.43Å; G7-I11 PolarHBondContact O-N 3.49Å |
| 8 | L | 73.9 | Confident | 73.1 | Confident | 57 Ų | 57 | 102.1 Ų | 102.1 | 30% | 0.298 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -65.9 | -33.9 | 177.8 | -162.7 | 75.5 | 0 | 0 | 0 | 112.5 | G6 K12 L210 A213 | G6-L8 PolarHBondContact O-N 3.29Å; L8-K12 WeakPolarHBondContact O-CB 3.48Å; L8-K12 PolarHBondContact O-N 2.88Å; L8-L210 HydrophobicContact CD1-CD1 4.28Å; L8-L210 HydrophobicContact CG-CD1 4.38Å; L8-A213 HydrophobicContact CD1-CB 3.45Å; L8-A213 VanDerWaalsContact CD1-CB 3.45Å; L8-A213 HydrophobicContact CD2-CB 3.6Å; L8-A213 HydrophobicContact CG-CB 4.17Å |
| 9 | R | 78.6 | Confident | 74.1 | Confident | 131 Ų | 131 | 97 Ų | 97 | 49% | 0.494 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -64.5 | -43.6 | 172.1 | -84.6 | -177.2 | -74.4 | -156.7 | 3.2 | 111.2 | R5 G6 G7 K12 Y13 | R5-R9 WeakPolarHBondContact O-CG 3.38Å; R5-R9 PolarHBondContact O-NE 2.83Å; R5-R9 PolarHBondContact O-NH2 3.38Å; G6-R9 WeakPolarHBondContact O-CB 3.45Å; G6-R9 PolarHBondContact O-N 3.01Å; G7-R9 VanDerWaalsContact C-N 3.31Å; G7-R9 PolarHBondContact O-N 3.36Å; R9-K12 PolarHBondContact O-N 3.44Å; R9-Y13 HydrophobicContact CB-CE2 4.45Å; R9-Y13 WeakPolarHBondContact O-CD2 3.42Å; R9-Y13 PolarHBondContact O-N 2.87Å |
| 10 | C | 83.1 | Confident | 75 | Confident | 71 Ų | 71 | 96.2 Ų | 96.2 | 48% | 0.48 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -59.1 | -49.1 | 176.1 | -171 | 0 | 0 | 0 | 0 | 111.6 | G6 G7 K12 Y13 L14 | G6-C10 PolarHBondContact O-N 2.71Å; G6-C10 VanDerWaalsContact O-N 3.12Å; G7-C10 WeakPolarHBondContact O-CB 3.49Å; G7-C10 PolarHBondContact O-N 2.96Å; G7-C10 VanDerWaalsContact O-N 3.17Å; C10-K12 VanDerWaalsContact C-N 3.31Å; C10-K12 PolarHBondContact O-N 2.89Å; C10-Y13 PolarHBondContact O-N 3.11Å; C10-L14 WeakPolarHBondContact O-CB 3.34Å; C10-L14 WeakPolarHBondContact O-CG 3.39Å; C10-L14 PolarHBondContact O-N 2.9Å |
| 11 | I | 82.7 | Confident | 75.9 | Confident | 40 Ų | 40 | 97 Ų | 97 | 21% | 0.205 | 49% | 0.494 | C | S | . | . | H | α-helix | trans | -59.1 | -42.2 | 177.2 | -65.5 | 169 | 0 | 0 | 0 | 111.2 | G7 L14 L15 F206 V209 | G7-I11 WeakPolarHBondContact O-CG1 3.43Å; G7-I11 PolarHBondContact O-N 3.49Å; I11-L14 PolarHBondContact O-N 3.11Å; I11-L15 HydrophobicContact CG2-CD1 4.17Å; I11-L15 WeakPolarHBondContact O-CB 3.3Å; I11-L15 PolarHBondContact O-N 3.42Å; I11-F206 HydrophobicContact CG1-CE1 4.5Å; I11-F206 HydrophobicContact CG2-CB 4.33Å; I11-F206 HydrophobicContact CG2-CD1 3.83Å; I11-F206 HydrophobicContact CG2-CG 4.3Å; I11-V209 HydrophobicContact CD1-CG1 4.46Å |
| 12 | K | 83.6 | Confident | 78.2 | Confident | 52 Ų | 52 | 88.2 Ų | 88.2 | 23% | 0.226 | 45% | 0.449 | C | S | . | . | H | α-helix | trans | -60.5 | -47.4 | 177.3 | -175.4 | -179 | -177.3 | 175.1 | 0 | 112.1 | L8 R9 C10 L16 A80 E83 | L8-K12 WeakPolarHBondContact O-CB 3.48Å; L8-K12 PolarHBondContact O-N 2.88Å; R9-K12 PolarHBondContact O-N 3.44Å; C10-K12 VanDerWaalsContact C-N 3.31Å; C10-K12 PolarHBondContact O-N 2.89Å; K12-L16 WeakPolarHBondContact O-CB 3.27Å; K12-L16 PolarHBondContact O-N 3.49Å; K12-A80 WeakPolarHBondContact CE-O 3.42Å; K12-E83 IonicContact NZ-OE1 2.66Å; K12-E83 PolarHBondContact NZ-OE1 2.74Å |
| 13 | Y | 86.8 | Confident | 80.5 | Confident | 158 Ų | 158 | 89.5 Ų | 89.5 | 62% | 0.62 | 43% | 0.434 | S | S | * | . | H | α-helix | trans | -69.3 | -37 | 178.9 | -74.4 | -67.3 | 0 | 0 | 0 | 112.5 | R9 C10 L16 G17 | R9-Y13 HydrophobicContact CB-CE2 4.45Å; R9-Y13 WeakPolarHBondContact O-CD2 3.42Å; R9-Y13 PolarHBondContact O-N 2.87Å; C10-Y13 PolarHBondContact O-N 3.11Å; Y13-L16 PolarHBondContact O-N 3.41Å; Y13-G17 PolarHBondContact O-N 3.18Å |
| 14 | L | 86.6 | Confident | 83 | Confident | 106 Ų | 106 | 81.9 Ų | 81.9 | 56% | 0.555 | 41% | 0.412 | S | S | * | . | H | α-helix | trans | -63 | -48.1 | 174.1 | -74.4 | 172 | 0 | 0 | 0 | 111.5 | C10 I11 L16 G17 F18 | C10-L14 WeakPolarHBondContact O-CB 3.34Å; C10-L14 WeakPolarHBondContact O-CG 3.39Å; C10-L14 PolarHBondContact O-N 2.9Å; I11-L14 PolarHBondContact O-N 3.11Å; L14-L16 VanDerWaalsContact C-N 3.33Å; L14-L16 PolarHBondContact O-N 2.86Å; L14-G17 PolarHBondContact O-N 3.33Å; L14-F18 VanDerWaalsContact O-CB 3.3Å; L14-F18 WeakPolarHBondContact O-CB 3.28Å; L14-F18 PolarHBondContact O-N 3.21Å |
| 15 | L | 85.8 | Confident | 85.1 | Confident | 13 Ų | 13 | 74.7 Ų | 74.7 | 7% | 0.068 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -59 | -44.8 | 174.3 | -89 | 172.4 | 0 | 0 | 0 | 111.4 | I11 N19 F206 L210 | I11-L15 HydrophobicContact CG2-CD1 4.17Å; I11-L15 WeakPolarHBondContact O-CB 3.3Å; I11-L15 PolarHBondContact O-N 3.42Å; L15-N19 VanDerWaalsContact O-CB 3.29Å; L15-N19 WeakPolarHBondContact O-CB 3.22Å; L15-N19 PolarHBondContact O-N 3.16Å; L15-N19 PolarHBondContact O-ND2 3.01Å; L15-F206 HydrophobicContact CD1-CB 3.8Å; L15-F206 HydrophobicContact CD2-CB 3.85Å; L15-F206 HydrophobicContact CG-CB 3.9Å; L15-L210 HydrophobicContact CD1-CB 4.42Å; L15-L210 HydrophobicContact CD1-CD2 3.86Å |
| 16 | L | 89.1 | Confident | 86.9 | Confident | 46 Ų | 46 | 66 Ų | 66 | 24% | 0.241 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -63.2 | -47.2 | 179.6 | -176.3 | 65.6 | 0 | 0 | 0 | 111.6 | K12 Y13 L14 L20 C77 M81 | K12-L16 WeakPolarHBondContact O-CB 3.27Å; K12-L16 PolarHBondContact O-N 3.49Å; Y13-L16 PolarHBondContact O-N 3.41Å; L14-L16 VanDerWaalsContact C-N 3.33Å; L14-L16 PolarHBondContact O-N 2.86Å; L16-L20 WeakPolarHBondContact O-CB 3.43Å; L16-L20 PolarHBondContact O-N 3.31Å; L16-C77 HydrophobicContact CD1-CB 4.07Å; L16-M81 HydrophobicContact CD1-CG 3.82Å; L16-M81 HydrophobicContact CD1-SD 4.38Å |
| 17 | G | 90.3 | Very high | 88.3 | Confident | 42 Ų | 42 | 65.7 Ų | 65.7 | 43% | 0.433 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -64.8 | -45.1 | -179.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | Y13 L14 L20 L21 | Y13-G17 PolarHBondContact O-N 3.18Å; L14-G17 PolarHBondContact O-N 3.33Å; G17-L20 PolarHBondContact O-N 3.45Å; G17-L21 PolarHBondContact O-N 3.41Å |
| 18 | F | 89.4 | Confident | 89.4 | Confident | 83 Ų | 83 | 66.2 Ų | 66.2 | 36% | 0.364 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -64.2 | -48.4 | 177.7 | -176.3 | -96.9 | 0 | 0 | 0 | 111.7 | L14 L20 L21 F22 L199 | L14-F18 VanDerWaalsContact O-CB 3.3Å; L14-F18 WeakPolarHBondContact O-CB 3.28Å; L14-F18 PolarHBondContact O-N 3.21Å; F18-L20 VanDerWaalsContact C-N 3.28Å; F18-L20 PolarHBondContact O-N 2.81Å; F18-L21 WeakPolarHBondContact O-CB 3.33Å; F18-L21 PolarHBondContact O-N 3.32Å; F18-F22 AromaticContact CD1-CD2 3.93Å; F18-F22 HydrophobicContact CD1-CD2 3.93Å; F18-F22 HydrophobicContact CD1-CE2 4.03Å; F18-F22 HydrophobicContact CD2-CD2 4.34Å; F18-F22 HydrophobicContact CD2-CE2 4.02Å; F18-F22 AromaticContact CE1-CD2 3.65Å; F18-F22 HydrophobicContact CE1-CD2 3.65Å; F18-F22 AromaticContact CE1-CE2 3.36Å; F18-F22 HydrophobicContact CE1-CE2 3.36Å; F18-F22 HydrophobicContact CE1-CG 4.48Å; F18-F22 AromaticContact CE1-CZ 3.96Å; F18-F22 HydrophobicContact CE1-CZ 3.96Å; F18-F22 HydrophobicContact CE2-CD2 4.1Å; F18-F22 AromaticContact CE2-CE2 3.37Å; F18-F22 HydrophobicContact CE2-CE2 3.37Å; F18-F22 HydrophobicContact CE2-CZ 4.2Å; F18-F22 HydrophobicContact CG-CD2 4.28Å; F18-F22 HydrophobicContact CG-CE2 4.34Å; F18-F22 AromaticContact CZ-CD2 3.77Å; F18-F22 HydrophobicContact CZ-CD2 3.77Å; F18-F22 AromaticContact CZ-CE2 3Å; F18-F22 HydrophobicContact CZ-CE2 3Å; F18-F22 AromaticContact CZ-CZ 3.53Å; F18-F22 HydrophobicContact CZ-CZ 3.53Å; F18-F22 WeakPolarHBondContact O-CD2 3.43Å; F18-F22 PolarHBondContact O-N 3.12Å; F18-L199 HydrophobicContact CE2-CD2 4.37Å; F18-L199 HydrophobicContact CZ-CD2 4.23Å |
| 19 | N | 91.3 | Very high | 90.5 | Very high | 5 Ų | 5 | 65.4 Ų | 65.4 | 3% | 0.027 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -66.1 | -31.6 | 178.8 | -76.6 | -76.9 | 0 | 0 | 0 | 112.5 | L15 F22 W23 G73 F91 | L15-N19 VanDerWaalsContact O-CB 3.29Å; L15-N19 WeakPolarHBondContact O-CB 3.22Å; L15-N19 PolarHBondContact O-N 3.16Å; L15-N19 PolarHBondContact O-ND2 3.01Å; N19-F22 PolarHBondContact O-N 3.09Å; N19-W23 WeakPolarHBondContact O-CB 3.45Å; N19-W23 PolarHBondContact O-N 2.98Å; N19-G73 WeakPolarHBondContact O-CA 3.41Å; N19-F91 VanDerWaalsContact OD1-CE2 3.27Å; N19-F91 WeakPolarHBondContact OD1-CE2 3.26Å; N19-F91 WeakPolarHBondContact OD1-CZ 3.41Å |
| 20 | L | 93.6 | Very high | 91.3 | Very high | 81 Ų | 81 | 60.6 Ų | 60.6 | 42% | 0.424 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -68.3 | -41.2 | 175.2 | -176.4 | 66.1 | 0 | 0 | 0 | 111.1 | L16 G17 F18 F22 W23 L24 C77 | L16-L20 WeakPolarHBondContact O-CB 3.43Å; L16-L20 PolarHBondContact O-N 3.31Å; G17-L20 PolarHBondContact O-N 3.45Å; F18-L20 VanDerWaalsContact C-N 3.28Å; F18-L20 PolarHBondContact O-N 2.81Å; L20-F22 VanDerWaalsContact C-N 3.35Å; L20-W23 HydrophobicContact CD1-CE3 4.14Å; L20-W23 PolarHBondContact O-N 3.37Å; L20-L24 HydrophobicContact CG-CD1 4.43Å; L20-L24 WeakPolarHBondContact O-CG 3.31Å; L20-L24 PolarHBondContact O-N 3.08Å; L20-C77 VanDerWaalsContact CA-SG 3.56Å; L20-C77 PolarHBondContact N-SG 3.49Å |
| 21 | L | 93.7 | Very high | 91.8 | Very high | 112 Ų | 112 | 60 Ų | 60 | 59% | 0.586 | 33% | 0.328 | S | S | * | . | H | α-helix | trans | -60 | -45.8 | 173.3 | -173.6 | 105.7 | 0 | 0 | 0 | 110.9 | G17 F18 W23 L24 A25 | G17-L21 PolarHBondContact O-N 3.41Å; F18-L21 WeakPolarHBondContact O-CB 3.33Å; F18-L21 PolarHBondContact O-N 3.32Å; L21-W23 VanDerWaalsContact C-N 3.33Å; L21-W23 PolarHBondContact O-N 3.16Å; L21-L24 PolarHBondContact O-N 3.07Å; L21-A25 VanDerWaalsContact O-CB 3.26Å; L21-A25 WeakPolarHBondContact O-CB 3.42Å; L21-A25 PolarHBondContact O-N 2.87Å |
| 22 | F | 92.3 | Very high | 92.2 | Very high | 68 Ų | 68 | 63.5 Ų | 63.5 | 30% | 0.298 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -62.2 | -39.9 | 176.4 | -91.7 | -102.7 | 0 | 0 | 0 | 112.6 | F18 N19 L20 A25 G26 | F18-F22 AromaticContact CD1-CD2 3.93Å; F18-F22 HydrophobicContact CD1-CD2 3.93Å; F18-F22 HydrophobicContact CD1-CE2 4.03Å; F18-F22 HydrophobicContact CD2-CD2 4.34Å; F18-F22 HydrophobicContact CD2-CE2 4.02Å; F18-F22 AromaticContact CE1-CD2 3.65Å; F18-F22 HydrophobicContact CE1-CD2 3.65Å; F18-F22 AromaticContact CE1-CE2 3.36Å; F18-F22 HydrophobicContact CE1-CE2 3.36Å; F18-F22 HydrophobicContact CE1-CG 4.48Å; F18-F22 AromaticContact CE1-CZ 3.96Å; F18-F22 HydrophobicContact CE1-CZ 3.96Å; F18-F22 HydrophobicContact CE2-CD2 4.1Å; F18-F22 AromaticContact CE2-CE2 3.37Å; F18-F22 HydrophobicContact CE2-CE2 3.37Å; F18-F22 HydrophobicContact CE2-CZ 4.2Å; F18-F22 HydrophobicContact CG-CD2 4.28Å; F18-F22 HydrophobicContact CG-CE2 4.34Å; F18-F22 AromaticContact CZ-CD2 3.77Å; F18-F22 HydrophobicContact CZ-CD2 3.77Å; F18-F22 AromaticContact CZ-CE2 3Å; F18-F22 HydrophobicContact CZ-CE2 3Å; F18-F22 AromaticContact CZ-CZ 3.53Å; F18-F22 HydrophobicContact CZ-CZ 3.53Å; F18-F22 WeakPolarHBondContact O-CD2 3.43Å; F18-F22 PolarHBondContact O-N 3.12Å; N19-F22 PolarHBondContact O-N 3.09Å; L20-F22 VanDerWaalsContact C-N 3.35Å; F22-A25 PolarHBondContact O-N 2.96Å; F22-G26 PolarHBondContact O-N 3.34Å |
| 23 | W | 95.6 | Very high | 92.5 | Very high | 90 Ų | 90 | 61 Ų | 61 | 34% | 0.341 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -62.9 | -46.6 | 176 | -179.5 | 80.4 | 0 | 0 | 0 | 112.1 | N19 L20 L21 S27 M70 | N19-W23 WeakPolarHBondContact O-CB 3.45Å; N19-W23 PolarHBondContact O-N 2.98Å; L20-W23 HydrophobicContact CD1-CE3 4.14Å; L20-W23 PolarHBondContact O-N 3.37Å; L21-W23 VanDerWaalsContact C-N 3.33Å; L21-W23 PolarHBondContact O-N 3.16Å; W23-S27 WeakPolarHBondContact O-CB 3.5Å; W23-S27 PolarHBondContact O-N 2.85Å; W23-S27 PolarHBondContact O-OG 3.34Å; W23-M70 VanDerWaalsContact CD1-CG 3.49Å; W23-M70 VanDerWaalsContact CD1-O 3.32Å; W23-M70 HydrophobicContact CG-CG 4.36Å |
| 24 | L | 96.3 | Very high | 92.7 | Very high | 95 Ų | 95 | 57 Ų | 57 | 50% | 0.497 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -64.6 | -44.6 | 176.2 | -70.3 | 173.9 | 0 | 0 | 0 | 111.9 | L20 L21 S27 A28 | L20-L24 HydrophobicContact CG-CD1 4.43Å; L20-L24 WeakPolarHBondContact O-CG 3.31Å; L20-L24 PolarHBondContact O-N 3.08Å; L21-L24 PolarHBondContact O-N 3.07Å; L24-S27 WeakPolarHBondContact O-CB 3.46Å; L24-S27 PolarHBondContact O-N 2.88Å; L24-A28 PolarHBondContact O-N 3.41Å |
| 25 | A | 95.9 | Very high | 92.8 | Very high | 45 Ų | 45 | 59.7 Ų | 59.7 | 37% | 0.372 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -62 | -45.5 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | L21 F22 S27 A28 V29 | L21-A25 VanDerWaalsContact O-CB 3.26Å; L21-A25 WeakPolarHBondContact O-CB 3.42Å; L21-A25 PolarHBondContact O-N 2.87Å; F22-A25 PolarHBondContact O-N 2.96Å; A25-S27 VanDerWaalsContact C-N 3.33Å; A25-S27 PolarHBondContact O-N 2.88Å; A25-A28 PolarHBondContact O-N 2.89Å; A25-V29 WeakPolarHBondContact O-CG2 3.32Å; A25-V29 PolarHBondContact O-N 3.24Å |
| 26 | G | 96.3 | Very high | 92.7 | Very high | 0 Ų | 0 | 62 Ų | 62 | 0% | 0 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -58.7 | -44.4 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | F22 A28 V29 I30 | F22-G26 PolarHBondContact O-N 3.34Å; G26-A28 VanDerWaalsContact C-N 3.34Å; G26-A28 PolarHBondContact O-N 3.35Å; G26-V29 PolarHBondContact O-N 3.13Å; G26-I30 VanDerWaalsContact O-CG1 3.29Å; G26-I30 WeakPolarHBondContact O-CG1 3.47Å; G26-I30 PolarHBondContact O-N 3.31Å |
| 27 | S | 96.1 | Very high | 92.4 | Very high | 36 Ų | 36 | 63.6 Ų | 63.6 | 25% | 0.252 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -61.1 | -41.7 | 176.6 | -55.7 | 0 | 0 | 0 | 0 | 112 | W23 L24 A25 I30 A31 | W23-S27 WeakPolarHBondContact O-CB 3.5Å; W23-S27 PolarHBondContact O-N 2.85Å; W23-S27 PolarHBondContact O-OG 3.34Å; L24-S27 WeakPolarHBondContact O-CB 3.46Å; L24-S27 PolarHBondContact O-N 2.88Å; A25-S27 VanDerWaalsContact C-N 3.33Å; A25-S27 PolarHBondContact O-N 2.88Å; S27-I30 PolarHBondContact O-N 3.01Å; S27-A31 WeakPolarHBondContact O-CB 3.38Å; S27-A31 PolarHBondContact O-N 3.39Å |
| 28 | A | 96.6 | Very high | 91.8 | Very high | 60 Ų | 60 | 67.7 Ų | 67.7 | 50% | 0.496 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -65.1 | -41.7 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | L24 A25 G26 A31 F32 | L24-A28 PolarHBondContact O-N 3.41Å; A25-A28 PolarHBondContact O-N 2.89Å; G26-A28 VanDerWaalsContact C-N 3.34Å; G26-A28 PolarHBondContact O-N 3.35Å; A28-A31 PolarHBondContact O-N 3.41Å; A28-F32 WeakPolarHBondContact O-CB 3.44Å; A28-F32 PolarHBondContact O-N 3.03Å |
| 29 | V | 95.9 | Very high | 90.8 | Very high | 40 Ų | 40 | 65 Ų | 65 | 24% | 0.242 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -63.5 | -43.1 | 177 | 171.6 | 0 | 0 | 0 | 0 | 111.3 | A25 G26 F32 G33 L62 M69 | A25-V29 WeakPolarHBondContact O-CG2 3.32Å; A25-V29 PolarHBondContact O-N 3.24Å; G26-V29 PolarHBondContact O-N 3.13Å; V29-F32 PolarHBondContact O-N 3.26Å; V29-G33 PolarHBondContact O-N 3.39Å; V29-L62 HydrophobicContact CG1-CD1 3.75Å; V29-L62 HydrophobicContact CG1-CG 3.83Å; V29-L62 WeakPolarHBondContact CG1-O 3.29Å; V29-M69 HydrophobicContact CB-CE 4.33Å; V29-M69 HydrophobicContact CG1-CE 4.37Å; V29-M69 HydrophobicContact CG2-CE 4.11Å |
| 30 | I | 95.5 | Very high | 89.7 | Confident | 29 Ų | 29 | 65 Ų | 65 | 15% | 0.149 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -61 | -48.9 | 174.7 | -64.6 | 164.8 | 0 | 0 | 0 | 110.1 | G26 S27 F32 G33 L34 V63 A67 M70 | G26-I30 VanDerWaalsContact O-CG1 3.29Å; G26-I30 WeakPolarHBondContact O-CG1 3.47Å; G26-I30 PolarHBondContact O-N 3.31Å; S27-I30 PolarHBondContact O-N 3.01Å; I30-F32 VanDerWaalsContact C-N 3.3Å; I30-F32 PolarHBondContact O-N 3.38Å; I30-G33 PolarHBondContact O-N 3.32Å; I30-L34 HydrophobicContact CG2-CD1 3.7Å; I30-L34 HydrophobicContact CG2-CG 4.19Å; I30-L34 WeakPolarHBondContact O-CB 3.45Å; I30-L34 VanDerWaalsContact O-CG 3.32Å; I30-L34 WeakPolarHBondContact O-CG 3.38Å; I30-L34 PolarHBondContact O-N 2.97Å; I30-V63 HydrophobicContact CG2-CG1 4.48Å; I30-A67 HydrophobicContact CD1-CB 4.16Å; I30-M70 HydrophobicContact CD1-CB 4.28Å; I30-M70 HydrophobicContact CD1-CE 4.36Å; I30-M70 HydrophobicContact CD1-SD 4.02Å |
| 31 | A | 94.2 | Very high | 88.1 | Confident | 60 Ų | 60 | 65.8 Ų | 65.8 | 50% | 0.496 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -58.5 | -43.6 | 179.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | S27 A28 W35 | S27-A31 WeakPolarHBondContact O-CB 3.38Å; S27-A31 PolarHBondContact O-N 3.39Å; A28-A31 PolarHBondContact O-N 3.41Å; A31-W35 WeakPolarHBondContact O-CB 3.3Å; A31-W35 PolarHBondContact O-N 3.01Å |
| 32 | F | 91.7 | Very high | 86.5 | Confident | 113 Ų | 113 | 61.8 Ų | 61.8 | 50% | 0.496 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -64.8 | -46 | 176.6 | -175.3 | -93.7 | 0 | 0 | 0 | 112.5 | A28 V29 I30 W35 F36 L62 | A28-F32 WeakPolarHBondContact O-CB 3.44Å; A28-F32 PolarHBondContact O-N 3.03Å; V29-F32 PolarHBondContact O-N 3.26Å; I30-F32 VanDerWaalsContact C-N 3.3Å; I30-F32 PolarHBondContact O-N 3.38Å; F32-W35 PolarHBondContact O-N 3.41Å; F32-F36 HydrophobicContact CD1-CD2 4.09Å; F32-F36 HydrophobicContact CD1-CE2 4.43Å; F32-F36 HydrophobicContact CD2-CD2 4.28Å; F32-F36 HydrophobicContact CD2-CE2 4.19Å; F32-F36 AromaticContact CE1-CD2 3.65Å; F32-F36 HydrophobicContact CE1-CD2 3.65Å; F32-F36 AromaticContact CE1-CE2 3.67Å; F32-F36 HydrophobicContact CE1-CE2 3.67Å; F32-F36 HydrophobicContact CE1-CG 4.45Å; F32-F36 HydrophobicContact CE1-CZ 4.43Å; F32-F36 AromaticContact CE2-CD2 3.89Å; F32-F36 HydrophobicContact CE2-CD2 3.89Å; F32-F36 AromaticContact CE2-CE2 3.39Å; F32-F36 HydrophobicContact CE2-CE2 3.39Å; F32-F36 HydrophobicContact CE2-CZ 4.38Å; F32-F36 HydrophobicContact CG-CD2 4.39Å; F32-F36 AromaticContact CZ-CD2 3.56Å; F32-F36 HydrophobicContact CZ-CD2 3.56Å; F32-F36 AromaticContact CZ-CE2 3.08Å; F32-F36 HydrophobicContact CZ-CE2 3.08Å; F32-F36 AromaticContact CZ-CZ 3.81Å; F32-F36 HydrophobicContact CZ-CZ 3.81Å; F32-F36 PolarHBondContact O-N 3.34Å; F32-L62 HydrophobicContact CD1-CD2 4.21Å |
| 33 | G | 90.4 | Very high | 84.7 | Confident | 0 Ų | 0 | 63.7 Ų | 63.7 | 0% | 0 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -63.3 | -43.3 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | V29 I30 F36 R37 | V29-G33 PolarHBondContact O-N 3.39Å; I30-G33 PolarHBondContact O-N 3.32Å; G33-F36 PolarHBondContact O-N 3Å; G33-R37 WeakPolarHBondContact O-CB 3.28Å; G33-R37 PolarHBondContact O-N 2.98Å |
| 34 | L | 90.1 | Very high | 82.6 | Confident | 73 Ų | 73 | 65.5 Ų | 65.5 | 38% | 0.382 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -67.7 | -38.2 | 174.7 | -67.3 | 177 | 0 | 0 | 0 | 111.9 | I30 R37 F38 V63 | I30-L34 HydrophobicContact CG2-CD1 3.7Å; I30-L34 HydrophobicContact CG2-CG 4.19Å; I30-L34 WeakPolarHBondContact O-CB 3.45Å; I30-L34 VanDerWaalsContact O-CG 3.32Å; I30-L34 WeakPolarHBondContact O-CG 3.38Å; I30-L34 PolarHBondContact O-N 2.97Å; L34-R37 PolarHBondContact O-N 3.1Å; L34-F38 HydrophobicContact CB-CD2 4.39Å; L34-F38 HydrophobicContact CD2-CD2 4.1Å; L34-F38 HydrophobicContact CD2-CE2 3.81Å; L34-F38 WeakPolarHBondContact O-CB 3.34Å; L34-F38 WeakPolarHBondContact O-CD2 3.21Å; L34-F38 PolarHBondContact O-N 2.67Å; L34-V63 HydrophobicContact CD2-CG2 4.39Å; L34-V63 HydrophobicContact CG-CG2 4.42Å |
| 35 | W | 89.3 | Confident | 80.5 | Confident | 163 Ų | 163 | 66.2 Ų | 66.2 | 62% | 0.617 | 36% | 0.356 | S | S | * | . | H | α-helix | trans | -60.7 | -47.2 | 173.9 | 179.2 | -93.2 | 0 | 0 | 0 | 111.1 | A31 F32 R37 F38 G39 G40 | A31-W35 WeakPolarHBondContact O-CB 3.3Å; A31-W35 PolarHBondContact O-N 3.01Å; F32-W35 PolarHBondContact O-N 3.41Å; W35-R37 VanDerWaalsContact C-N 3.26Å; W35-R37 PolarHBondContact O-N 2.92Å; W35-F38 PolarHBondContact O-N 3.2Å; W35-G39 CarbonylContact O-C 3.33Å; W35-G39 WeakPolarHBondContact O-CA 3.35Å; W35-G39 PolarHBondContact O-N 3.13Å; W35-G40 PolarHBondContact O-N 2.98Å |
| 36 | F | 84.2 | Confident | 78.3 | Confident | 62 Ų | 62 | 67.3 Ų | 67.3 | 27% | 0.272 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -62.3 | -34.9 | 176.3 | -97.4 | -101.5 | 0 | 0 | 0 | 112.6 | F32 G33 I42 L59 | F32-F36 HydrophobicContact CD1-CD2 4.09Å; F32-F36 HydrophobicContact CD1-CE2 4.43Å; F32-F36 HydrophobicContact CD2-CD2 4.28Å; F32-F36 HydrophobicContact CD2-CE2 4.19Å; F32-F36 AromaticContact CE1-CD2 3.65Å; F32-F36 HydrophobicContact CE1-CD2 3.65Å; F32-F36 AromaticContact CE1-CE2 3.67Å; F32-F36 HydrophobicContact CE1-CE2 3.67Å; F32-F36 HydrophobicContact CE1-CG 4.45Å; F32-F36 HydrophobicContact CE1-CZ 4.43Å; F32-F36 AromaticContact CE2-CD2 3.89Å; F32-F36 HydrophobicContact CE2-CD2 3.89Å; F32-F36 AromaticContact CE2-CE2 3.39Å; F32-F36 HydrophobicContact CE2-CE2 3.39Å; F32-F36 HydrophobicContact CE2-CZ 4.38Å; F32-F36 HydrophobicContact CG-CD2 4.39Å; F32-F36 AromaticContact CZ-CD2 3.56Å; F32-F36 HydrophobicContact CZ-CD2 3.56Å; F32-F36 AromaticContact CZ-CE2 3.08Å; F32-F36 HydrophobicContact CZ-CE2 3.08Å; F32-F36 AromaticContact CZ-CZ 3.81Å; F32-F36 HydrophobicContact CZ-CZ 3.81Å; F32-F36 PolarHBondContact O-N 3.34Å; G33-F36 PolarHBondContact O-N 3Å; F36-I42 HydrophobicContact CD1-CD1 3.83Å; F36-I42 HydrophobicContact CD1-CG1 4.47Å; F36-I42 HydrophobicContact CE1-CD1 4.12Å; F36-L59 HydrophobicContact CB-CD1 4.48Å; F36-L59 HydrophobicContact CB-CD2 3.58Å; F36-L59 HydrophobicContact CG-CD2 4.45Å |
| 37 | R | 81.3 | Confident | 76 | Confident | 78 Ų | 78 | 72.2 Ų | 72.2 | 29% | 0.294 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -73.9 | -39.4 | 178.9 | -179 | 63.6 | -178.6 | 88 | -3.4 | 113.9 | G33 L34 W35 Y60 | G33-R37 WeakPolarHBondContact O-CB 3.28Å; G33-R37 PolarHBondContact O-N 2.98Å; L34-R37 PolarHBondContact O-N 3.1Å; W35-R37 VanDerWaalsContact C-N 3.26Å; W35-R37 PolarHBondContact O-N 2.92Å; R37-Y60 PolarHBondContact NE-OH 2.79Å; R37-Y60 PolarHBondContact NH2-OH 3.4Å |
| 38 | F | 78.8 | Confident | 73.5 | Confident | 128 Ų | 128 | 78.6 Ų | 78.6 | 56% | 0.561 | 42% | 0.421 | S | S | * | . | H | α-helix | trans | -125.6 | 4 | -166.6 | -64.1 | -71 | 0 | 0 | 0 | 114.7 | L34 W35 K43 | L34-F38 HydrophobicContact CB-CD2 4.39Å; L34-F38 HydrophobicContact CD2-CD2 4.1Å; L34-F38 HydrophobicContact CD2-CE2 3.81Å; L34-F38 WeakPolarHBondContact O-CB 3.34Å; L34-F38 WeakPolarHBondContact O-CD2 3.21Å; L34-F38 PolarHBondContact O-N 2.67Å; W35-F38 PolarHBondContact O-N 3.2Å; F38-K43 WeakPolarHBondContact O-CE 3.29Å; F38-K43 PolarHBondContact O-NZ 2.84Å |
| 39 | G | 67.3 | Low | 71.2 | Confident | 28 Ų | 28 | 82.7 Ų | 82.7 | 29% | 0.289 | 43% | 0.434 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -146.6 | -20.1 | -177 | 0 | 0 | 0 | 0 | 0 | 115.2 | W35 K43 | W35-G39 CarbonylContact O-C 3.33Å; W35-G39 WeakPolarHBondContact O-CA 3.35Å; W35-G39 PolarHBondContact O-N 3.13Å; G39-K43 VanDerWaalsContact N-CE 3.27Å |
| 40 | G | 68.3 | Low | 69 | Low | 5 Ų | 5 | 87.3 Ų | 87.3 | 5% | 0.052 | 45% | 0.451 | C | S | . | . | S | Bend | trans | -81.1 | 171.2 | -172.8 | 0 | 0 | 0 | 0 | 0 | 115.3 | W35 I42 K43 | W35-G40 PolarHBondContact O-N 2.98Å; G40-I42 PolarHBondContact O-N 2.81Å; G40-K43 PolarHBondContact O-N 2.87Å |
| 41 | P | 59.8 | Low | 66.9 | Low | 96 Ų | 96 | 87.5 Ų | 87.5 | 62% | 0.623 | 46% | 0.455 | S | S | * | . | G | 310 helix | trans | -56.4 | -11.8 | 179.3 | -22.6 | 32.4 | 0 | 0 | 0 | 114.9 | K43 D44 | P41-K43 VanDerWaalsContact C-N 3.27Å; P41-K43 PolarHBondContact O-N 3.46Å; P41-D44 PolarHBondContact O-N 3.44Å |
| 42 | I | 60.1 | Low | 65.3 | Low | 28 Ų | 28 | 88.4 Ų | 88.4 | 14% | 0.144 | 46% | 0.456 | C | S | . | . | G | 310 helix | trans | -77.7 | -14.3 | -176.4 | -51.9 | -164.7 | 0 | 0 | 0 | 112 | F36 G40 D44 L45 S46 F55 | F36-I42 HydrophobicContact CD1-CD1 3.83Å; F36-I42 HydrophobicContact CD1-CG1 4.47Å; F36-I42 HydrophobicContact CE1-CD1 4.12Å; G40-I42 PolarHBondContact O-N 2.81Å; I42-D44 VanDerWaalsContact C-N 3.29Å; I42-D44 PolarHBondContact O-N 2.04Å; I42-L45 HydrophobicContact CG1-CD1 4.42Å; I42-L45 PolarHBondContact O-N 3.37Å; I42-S46 PolarHBondContact O-N 3.47Å; I42-S46 VanDerWaalsContact O-N 3.14Å; I42-F55 HydrophobicContact CD1-CD1 4.41Å; I42-F55 HydrophobicContact CD1-CE1 3.29Å; I42-F55 HydrophobicContact CD1-CE2 4.18Å; I42-F55 HydrophobicContact CD1-CZ 3.15Å; I42-F55 HydrophobicContact CG1-CE1 4.5Å; I42-F55 HydrophobicContact CG2-CD1 4.43Å; I42-F55 HydrophobicContact CG2-CE1 3.97Å |
| 43 | K | 54.2 | Low | 64 | Low | 108 Ų | 108 | 90.7 Ų | 90.7 | 47% | 0.47 | 47% | 0.468 | S | S | . | . | G | 310 helix | trans | -60.1 | -41.3 | 167.6 | -66.7 | -175.6 | -177.7 | 179.6 | 0 | 112.3 | F38 G39 G40 P41 S46 | F38-K43 WeakPolarHBondContact O-CE 3.29Å; F38-K43 PolarHBondContact O-NZ 2.84Å; G39-K43 VanDerWaalsContact N-CE 3.27Å; G40-K43 PolarHBondContact O-N 2.87Å; P41-K43 VanDerWaalsContact C-N 3.27Å; P41-K43 PolarHBondContact O-N 3.46Å; K43-S46 WeakPolarHBondContact O-CB 3.05Å; K43-S46 PolarHBondContact O-N 3.49Å |
| 44 | D | 52.8 | Low | 62.9 | Low | 129 Ų | 129 | 98.5 Ų | 98.5 | 69% | 0.69 | 50% | 0.499 | S | S | * | . | G | 310 helix | trans | -74 | -33.3 | -179.3 | -67.2 | -37.5 | 0 | 0 | 0 | 111.1 | P41 I42 S46 S47 | P41-D44 PolarHBondContact O-N 3.44Å; I42-D44 VanDerWaalsContact C-N 3.29Å; I42-D44 PolarHBondContact O-N 2.04Å; D44-S46 PolarHBondContact O-N 3.44Å; D44-S47 WeakPolarHBondContact O-CB 3.24Å; D44-S47 PolarHBondContact O-N 3.42Å |
| 45 | L | 50.9 | Low | 62.1 | Low | 109 Ų | 109 | 98.8 Ų | 98.8 | 57% | 0.571 | 50% | 0.497 | S | S | * | . | G | 310 helix | trans | -69.8 | -10.6 | 170.7 | -70.1 | 166.1 | 0 | 0 | 0 | 114.1 | I42 S47 | I42-L45 HydrophobicContact CG1-CD1 4.42Å; I42-L45 PolarHBondContact O-N 3.37Å; L45-S47 VanDerWaalsContact C-N 3.32Å |
| 46 | S | 49.8 | Very low | 61.6 | Low | 68 Ų | 68 | 93.3 Ų | 93.3 | 48% | 0.476 | 48% | 0.477 | S | S | . | . | G | 310 helix | trans | -82.7 | -13.4 | 173.8 | -170.3 | 0 | 0 | 0 | 0 | 112.7 | I42 K43 D44 | I42-S46 PolarHBondContact O-N 3.47Å; I42-S46 VanDerWaalsContact O-N 3.14Å; K43-S46 WeakPolarHBondContact O-CB 3.05Å; K43-S46 PolarHBondContact O-N 3.49Å; D44-S46 PolarHBondContact O-N 3.44Å |
| 47 | S | 48.2 | Very low | 61.6 | Low | 104 Ų | 104 | 94.4 Ų | 94.4 | 73% | 0.727 | 49% | 0.489 | S | S | * | . | S | Bend | trans | -86 | -17.6 | -179.7 | -49.7 | 0 | 0 | 0 | 0 | 112.6 | D44 L45 | D44-S47 WeakPolarHBondContact O-CB 3.24Å; D44-S47 PolarHBondContact O-N 3.42Å; L45-S47 VanDerWaalsContact C-N 3.32Å |
| 48 | E | 44.6 | Very low | 61.8 | Low | 170 Ų | 170 | 92.6 Ų | 92.6 | 79% | 0.794 | 49% | 0.494 | S | S | * | . | S | Bend | trans | -113.9 | 93.9 | 179.2 | -157.1 | 151.5 | 101.3 | 0 | 0 | 108.4 | ||
| 49 | D | 48.1 | Very low | 62.2 | Low | 145 Ų | 145 | 87.1 Ų | 87.1 | 78% | 0.775 | 47% | 0.471 | S | S | * | . | S | Bend | trans | 14 | 111.8 | 167.6 | -119.5 | -43.4 | 0 | 0 | 0 | 117.9 | ||
| 50 | K | 48.8 | Very low | 63.3 | Low | 137 Ų | 137 | 92.2 Ų | 92.2 | 60% | 0.596 | 48% | 0.482 | S | S | * | . | trans | 74.8 | 67.3 | 166.3 | -49.9 | 172.3 | -170.1 | 151.5 | 0 | 116.7 | ||||
| 51 | S | 52.8 | Low | 64.4 | Low | 34 Ų | 34 | 96.6 Ų | 96.6 | 24% | 0.238 | 51% | 0.508 | C | S | . | . | trans | -63.1 | 128.4 | 148.6 | 42.5 | 0 | 0 | 0 | 0 | 108.5 | E53 Y56 | S51-E53 PolarHBondContact O-N 3.28Å; S51-Y56 WeakPolarHBondContact OG-CE2 3.03Å | ||
| 52 | P | 59.1 | Low | 66 | Low | 79 Ų | 79 | 95.2 Ų | 95.2 | 51% | 0.513 | 49% | 0.494 | S | S | . | . | trans | -63.4 | 126 | -176.2 | 21.8 | -29.5 | 0 | 0 | 0 | 108.9 | Y54 F55 | P52-Y54 HydrophobicContact CB-CD2 4.2Å; P52-Y54 PolarHBondContact O-N 3.17Å; P52-F55 HydrophobicContact CG-CB 4.2Å; P52-F55 VanDerWaalsContact O-CB 3.31Å; P52-F55 WeakPolarHBondContact O-CB 3.01Å; P52-F55 PolarHBondContact O-N 2.02Å | ||
| 53 | E | 65.9 | Low | 67.6 | Low | 161 Ų | 161 | 95.4 Ų | 95.4 | 75% | 0.752 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -49 | -32.8 | 179.6 | -63.5 | -172.2 | 154.1 | 0 | 0 | 112.2 | S51 F55 Y56 V57 | S51-E53 PolarHBondContact O-N 3.28Å; E53-F55 VanDerWaalsContact C-N 3.25Å; E53-F55 PolarHBondContact O-N 3.03Å; E53-Y56 PolarHBondContact O-N 2.93Å; E53-Y56 VanDerWaalsContact O-N 3.13Å; E53-V57 WeakPolarHBondContact O-CG2 3.37Å; E53-V57 PolarHBondContact O-N 3.23Å |
| 54 | Y | 67.4 | Low | 69.6 | Low | 164 Ų | 164 | 92.2 Ų | 92.2 | 64% | 0.643 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -54 | -33.7 | 173.3 | -54.8 | -73 | 0 | 0 | 0 | 114.5 | P52 V57 G58 | P52-Y54 HydrophobicContact CB-CD2 4.2Å; P52-Y54 PolarHBondContact O-N 3.17Å; Y54-V57 PolarHBondContact O-N 3.37Å; Y54-G58 PolarHBondContact O-N 3.45Å |
| 55 | F | 73 | Confident | 71.5 | Confident | 78 Ų | 78 | 88.2 Ų | 88.2 | 34% | 0.342 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -68.1 | -42.1 | 177.6 | -175.8 | -96.8 | 0 | 0 | 0 | 111.7 | I42 P52 E53 G58 L59 | I42-F55 HydrophobicContact CD1-CD1 4.41Å; I42-F55 HydrophobicContact CD1-CE1 3.29Å; I42-F55 HydrophobicContact CD1-CE2 4.18Å; I42-F55 HydrophobicContact CD1-CZ 3.15Å; I42-F55 HydrophobicContact CG1-CE1 4.5Å; I42-F55 HydrophobicContact CG2-CD1 4.43Å; I42-F55 HydrophobicContact CG2-CE1 3.97Å; P52-F55 HydrophobicContact CG-CB 4.2Å; P52-F55 VanDerWaalsContact O-CB 3.31Å; P52-F55 WeakPolarHBondContact O-CB 3.01Å; P52-F55 PolarHBondContact O-N 2.02Å; E53-F55 VanDerWaalsContact C-N 3.25Å; E53-F55 PolarHBondContact O-N 3.03Å; F55-G58 PolarHBondContact O-N 3.39Å; F55-L59 HydrophobicContact CD1-CD1 3.94Å; F55-L59 HydrophobicContact CE1-CD1 3.44Å; F55-L59 VanDerWaalsContact CE1-CD1 3.44Å; F55-L59 HydrophobicContact CE1-CG 4.16Å; F55-L59 HydrophobicContact CZ-CD1 4.13Å; F55-L59 HydrophobicContact CZ-CG 4.45Å; F55-L59 PolarHBondContact O-N 3.08Å |
| 56 | Y | 78.1 | Confident | 73.7 | Confident | 48 Ų | 48 | 83 Ų | 83 | 19% | 0.188 | 45% | 0.453 | C | S | . | . | H | α-helix | trans | -68.3 | -39.6 | 174.7 | -72.2 | -69.2 | 0 | 0 | 0 | 112 | S51 E53 G58 L59 Y60 | S51-Y56 WeakPolarHBondContact OG-CE2 3.03Å; E53-Y56 PolarHBondContact O-N 2.93Å; E53-Y56 VanDerWaalsContact O-N 3.13Å; Y56-G58 VanDerWaalsContact C-N 3.28Å; Y56-G58 PolarHBondContact O-N 2.97Å; Y56-L59 HydrophobicContact CD1-CD1 4.42Å; Y56-L59 PolarHBondContact O-N 3.08Å; Y56-Y60 WeakPolarHBondContact O-CD2 3.32Å; Y56-Y60 PolarHBondContact O-N 3.07Å |
| 57 | V | 83.6 | Confident | 75.9 | Confident | 86 Ų | 86 | 81.8 Ų | 81.8 | 52% | 0.521 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -56.7 | -46.1 | 172.9 | 175.2 | 0 | 0 | 0 | 0 | 110.1 | E53 Y54 L59 Y60 V61 | E53-V57 WeakPolarHBondContact O-CG2 3.37Å; E53-V57 PolarHBondContact O-N 3.23Å; Y54-V57 PolarHBondContact O-N 3.37Å; V57-L59 PolarHBondContact O-N 2.86Å; V57-Y60 PolarHBondContact O-N 2.95Å; V57-V61 HydrophobicContact CG1-CG2 4.43Å; V57-V61 VanDerWaalsContact O-CG2 3.31Å; V57-V61 WeakPolarHBondContact O-CG2 3.31Å; V57-V61 PolarHBondContact O-N 2.88Å |
| 58 | G | 85.9 | Confident | 78 | Confident | 40 Ų | 40 | 81.3 Ų | 81.3 | 41% | 0.412 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -58.2 | -43.5 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113.6 | Y54 F55 Y56 V61 L62 | Y54-G58 PolarHBondContact O-N 3.45Å; F55-G58 PolarHBondContact O-N 3.39Å; Y56-G58 VanDerWaalsContact C-N 3.28Å; Y56-G58 PolarHBondContact O-N 2.97Å; G58-V61 PolarHBondContact O-N 2.73Å; G58-L62 WeakPolarHBondContact O-CB 3.1Å; G58-L62 PolarHBondContact O-N 2.8Å |
| 59 | L | 88.2 | Confident | 80.4 | Confident | 13 Ų | 13 | 76.2 Ų | 76.2 | 7% | 0.068 | 41% | 0.412 | C | S | . | . | H | α-helix | trans | -63.1 | -42.5 | 176 | -78.5 | 167.4 | 0 | 0 | 0 | 112.7 | F36 F55 Y56 V57 L62 V63 | F36-L59 HydrophobicContact CB-CD1 4.48Å; F36-L59 HydrophobicContact CB-CD2 3.58Å; F36-L59 HydrophobicContact CG-CD2 4.45Å; F55-L59 HydrophobicContact CD1-CD1 3.94Å; F55-L59 HydrophobicContact CE1-CD1 3.44Å; F55-L59 VanDerWaalsContact CE1-CD1 3.44Å; F55-L59 HydrophobicContact CE1-CG 4.16Å; F55-L59 HydrophobicContact CZ-CD1 4.13Å; F55-L59 HydrophobicContact CZ-CG 4.45Å; F55-L59 PolarHBondContact O-N 3.08Å; Y56-L59 HydrophobicContact CD1-CD1 4.42Å; Y56-L59 PolarHBondContact O-N 3.08Å; V57-L59 PolarHBondContact O-N 2.86Å; L59-L62 WeakPolarHBondContact O-CB 3.48Å; L59-L62 PolarHBondContact O-N 2.93Å; L59-V63 WeakPolarHBondContact O-CG2 3.47Å; L59-V63 PolarHBondContact O-N 3.23Å |
| 60 | Y | 90 | Very high | 82.6 | Confident | 135 Ų | 135 | 72.6 Ų | 72.6 | 53% | 0.529 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -66.9 | -39 | 176.9 | -70.2 | -59.5 | 0 | 0 | 0 | 112.1 | R37 Y56 V57 L62 V63 G64 | R37-Y60 PolarHBondContact NE-OH 2.79Å; R37-Y60 PolarHBondContact NH2-OH 3.4Å; Y56-Y60 WeakPolarHBondContact O-CD2 3.32Å; Y56-Y60 PolarHBondContact O-N 3.07Å; V57-Y60 PolarHBondContact O-N 2.95Å; Y60-L62 VanDerWaalsContact C-N 3.32Å; Y60-L62 PolarHBondContact O-N 3.44Å; Y60-V63 PolarHBondContact O-N 3.47Å; Y60-G64 PolarHBondContact O-N 2.86Å |
| 61 | V | 92.1 | Very high | 84.7 | Confident | 97 Ų | 97 | 67.9 Ų | 67.9 | 59% | 0.588 | 38% | 0.378 | S | S | * | . | H | α-helix | trans | -61.1 | -42.8 | 172.9 | 171.9 | 0 | 0 | 0 | 0 | 110.5 | V57 G58 G64 A65 | V57-V61 HydrophobicContact CG1-CG2 4.43Å; V57-V61 VanDerWaalsContact O-CG2 3.31Å; V57-V61 WeakPolarHBondContact O-CG2 3.31Å; V57-V61 PolarHBondContact O-N 2.88Å; G58-V61 PolarHBondContact O-N 2.73Å; V61-G64 PolarHBondContact O-N 3.46Å; V61-A65 WeakPolarHBondContact O-CB 3.28Å; V61-A65 PolarHBondContact O-N 3.47Å |
| 62 | L | 91.9 | Very high | 86.6 | Confident | 66 Ų | 66 | 67.1 Ų | 67.1 | 35% | 0.346 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -62 | -45.9 | 177.4 | -173.7 | 67.5 | 0 | 0 | 0 | 112.1 | V29 F32 G58 L59 Y60 A65 G66 | V29-L62 HydrophobicContact CG1-CD1 3.75Å; V29-L62 HydrophobicContact CG1-CG 3.83Å; V29-L62 WeakPolarHBondContact CG1-O 3.29Å; F32-L62 HydrophobicContact CD1-CD2 4.21Å; G58-L62 WeakPolarHBondContact O-CB 3.1Å; G58-L62 PolarHBondContact O-N 2.8Å; L59-L62 WeakPolarHBondContact O-CB 3.48Å; L59-L62 PolarHBondContact O-N 2.93Å; Y60-L62 VanDerWaalsContact C-N 3.32Å; Y60-L62 PolarHBondContact O-N 3.44Å; L62-A65 PolarHBondContact O-N 2.74Å; L62-G66 PolarHBondContact O-N 3Å |
| 63 | V | 94.6 | Very high | 88.2 | Confident | 32 Ų | 32 | 63.3 Ų | 63.3 | 19% | 0.194 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -64.3 | -43.6 | 176.4 | 172.1 | 0 | 0 | 0 | 0 | 111 | I30 L34 L59 Y60 G66 A67 | I30-V63 HydrophobicContact CG2-CG1 4.48Å; L34-V63 HydrophobicContact CD2-CG2 4.39Å; L34-V63 HydrophobicContact CG-CG2 4.42Å; L59-V63 WeakPolarHBondContact O-CG2 3.47Å; L59-V63 PolarHBondContact O-N 3.23Å; Y60-V63 PolarHBondContact O-N 3.47Å; V63-G66 PolarHBondContact O-N 3.04Å; V63-A67 WeakPolarHBondContact O-CB 3.48Å; V63-A67 PolarHBondContact O-N 2.98Å |
| 64 | G | 94.9 | Very high | 89.4 | Confident | 42 Ų | 42 | 60.8 Ų | 60.8 | 43% | 0.433 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -61 | -45 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | Y60 V61 A67 L68 | Y60-G64 PolarHBondContact O-N 2.86Å; V61-G64 PolarHBondContact O-N 3.46Å; G64-A67 PolarHBondContact O-N 3.45Å; G64-L68 PolarHBondContact O-N 3.45Å |
| 65 | A | 93.9 | Very high | 90.4 | Very high | 45 Ų | 45 | 56.7 Ų | 56.7 | 37% | 0.372 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -62 | -43 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | V61 L62 A67 L68 M69 | V61-A65 WeakPolarHBondContact O-CB 3.28Å; V61-A65 PolarHBondContact O-N 3.47Å; L62-A65 PolarHBondContact O-N 2.74Å; A65-A67 PolarHBondContact O-N 2.97Å; A65-L68 PolarHBondContact O-N 2.86Å; A65-M69 WeakPolarHBondContact O-CG 3.41Å; A65-M69 PolarHBondContact O-N 2.86Å |
| 66 | G | 96.2 | Very high | 91.1 | Very high | 0 Ų | 0 | 53.1 Ų | 53.1 | 0% | 0 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -59.4 | -44.1 | 174.3 | 0 | 0 | 0 | 0 | 0 | 113 | L62 V63 M69 M70 | L62-G66 PolarHBondContact O-N 3Å; V63-G66 PolarHBondContact O-N 3.04Å; G66-M69 PolarHBondContact O-N 3.48Å; G66-M70 WeakPolarHBondContact O-CB 3.42Å; G66-M70 PolarHBondContact O-N 3.27Å |
| 67 | A | 95.8 | Very high | 91.6 | Very high | 41 Ų | 41 | 51.2 Ų | 51.2 | 34% | 0.339 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -63.3 | -41.9 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | I30 V63 G64 A65 M70 A71 | I30-A67 HydrophobicContact CD1-CB 4.16Å; V63-A67 WeakPolarHBondContact O-CB 3.48Å; V63-A67 PolarHBondContact O-N 2.98Å; G64-A67 PolarHBondContact O-N 3.45Å; A65-A67 PolarHBondContact O-N 2.97Å; A67-M70 PolarHBondContact O-N 3.43Å; A67-A71 WeakPolarHBondContact O-CB 3.25Å; A67-A71 PolarHBondContact O-N 3.18Å |
| 68 | L | 93.7 | Very high | 91.8 | Very high | 95 Ų | 95 | 47.9 Ų | 47.9 | 50% | 0.497 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -62.5 | -47.2 | 175 | -177 | 65.7 | 0 | 0 | 0 | 111.3 | G64 A65 M70 A71 V72 I98 | G64-L68 PolarHBondContact O-N 3.45Å; A65-L68 PolarHBondContact O-N 2.86Å; L68-M70 VanDerWaalsContact C-N 3.32Å; L68-M70 PolarHBondContact O-N 3.38Å; L68-A71 PolarHBondContact O-N 2.94Å; L68-V72 HydrophobicContact CD1-CG2 4.33Å; L68-V72 VanDerWaalsContact O-CG2 3.28Å; L68-V72 WeakPolarHBondContact O-CG2 3.32Å; L68-V72 PolarHBondContact O-N 2.93Å; L68-I98 HydrophobicContact CD2-CD1 4.4Å; L68-I98 HydrophobicContact CD2-CG1 4.39Å; L68-I98 HydrophobicContact CG-CD1 4.45Å |
| 69 | M | 94.3 | Very high | 91.7 | Very high | 63 Ų | 63 | 46 Ų | 46 | 31% | 0.31 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -58.6 | -43.5 | 175.9 | -73.1 | -172.6 | -68.8 | 0 | 0 | 111.9 | V29 A65 G66 G73 | V29-M69 HydrophobicContact CB-CE 4.33Å; V29-M69 HydrophobicContact CG1-CE 4.37Å; V29-M69 HydrophobicContact CG2-CE 4.11Å; A65-M69 WeakPolarHBondContact O-CG 3.41Å; A65-M69 PolarHBondContact O-N 2.86Å; G66-M69 PolarHBondContact O-N 3.48Å; M69-G73 PolarHBondContact O-N 3.44Å |
| 70 | M | 94.9 | Very high | 91.5 | Very high | 68 Ų | 68 | 45.4 Ų | 45.4 | 34% | 0.335 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -63.2 | -47.5 | 177.1 | -170.4 | -175.9 | 76.3 | 0 | 0 | 111.5 | W23 I30 G66 A67 L68 V72 G73 F74 | W23-M70 VanDerWaalsContact CD1-CG 3.49Å; W23-M70 VanDerWaalsContact CD1-O 3.32Å; W23-M70 HydrophobicContact CG-CG 4.36Å; I30-M70 HydrophobicContact CD1-CB 4.28Å; I30-M70 HydrophobicContact CD1-CE 4.36Å; I30-M70 HydrophobicContact CD1-SD 4.02Å; G66-M70 WeakPolarHBondContact O-CB 3.42Å; G66-M70 PolarHBondContact O-N 3.27Å; A67-M70 PolarHBondContact O-N 3.43Å; L68-M70 VanDerWaalsContact C-N 3.32Å; L68-M70 PolarHBondContact O-N 3.38Å; M70-V72 PolarHBondContact O-N 2.84Å; M70-G73 PolarHBondContact O-N 3.45Å; M70-F74 WeakPolarHBondContact O-CB 3.31Å; M70-F74 PolarHBondContact O-N 2.98Å |
| 71 | A | 92.6 | Very high | 91.2 | Very high | 39 Ų | 39 | 44.3 Ų | 44.3 | 32% | 0.322 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -61.3 | -45.7 | 179 | 0 | 0 | 0 | 0 | 0 | 112.4 | A67 L68 F74 F75 | A67-A71 WeakPolarHBondContact O-CB 3.25Å; A67-A71 PolarHBondContact O-N 3.18Å; L68-A71 PolarHBondContact O-N 2.94Å; A71-F74 PolarHBondContact O-N 2.97Å; A71-F75 VanDerWaalsContact O-CD2 3.3Å; A71-F75 WeakPolarHBondContact O-CD2 3.1Å; A71-F75 PolarHBondContact O-N 3.36Å |
| 72 | V | 92.7 | Very high | 90.7 | Very high | 17 Ų | 17 | 49 Ų | 49 | 10% | 0.103 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -63.6 | -45.6 | 178 | 173.9 | 0 | 0 | 0 | 0 | 110.9 | L68 M70 F74 F75 G76 F91 C94 L95 I98 | L68-V72 HydrophobicContact CD1-CG2 4.33Å; L68-V72 VanDerWaalsContact O-CG2 3.28Å; L68-V72 WeakPolarHBondContact O-CG2 3.32Å; L68-V72 PolarHBondContact O-N 2.93Å; M70-V72 PolarHBondContact O-N 2.84Å; V72-F74 VanDerWaalsContact C-N 3.32Å; V72-F74 PolarHBondContact O-N 3.18Å; V72-F75 PolarHBondContact O-N 3.05Å; V72-G76 PolarHBondContact O-N 3.43Å; V72-F91 HydrophobicContact CG1-CD2 4.14Å; V72-F91 HydrophobicContact CG1-CE2 3.68Å; V72-C94 HydrophobicContact CG2-CB 4.4Å; V72-L95 HydrophobicContact CG1-CD2 4.06Å; V72-I98 HydrophobicContact CG2-CD1 3.64Å |
| 73 | G | 92.9 | Very high | 90.2 | Very high | 0 Ų | 0 | 50.4 Ų | 50.4 | 0% | 0 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -59.8 | -41 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | N19 M69 M70 G76 C77 | N19-G73 WeakPolarHBondContact O-CA 3.41Å; M69-G73 PolarHBondContact O-N 3.44Å; M70-G73 PolarHBondContact O-N 3.45Å; G73-G76 PolarHBondContact O-N 3.28Å; G73-C77 WeakPolarHBondContact O-CB 3.2Å; G73-C77 PolarHBondContact O-N 3.24Å; G73-C77 PolarHBondContact O-SG 2.96Å; G73-C77 VanDerWaalsContact O-SG 3.34Å |
| 74 | F | 90.5 | Very high | 89.7 | Confident | 108 Ų | 108 | 50.6 Ų | 50.6 | 47% | 0.474 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -62.8 | -48.4 | 176.3 | 179.8 | -100.9 | 0 | 0 | 0 | 112.2 | M70 A71 V72 G76 C77 C78 | M70-F74 WeakPolarHBondContact O-CB 3.31Å; M70-F74 PolarHBondContact O-N 2.98Å; A71-F74 PolarHBondContact O-N 2.97Å; V72-F74 VanDerWaalsContact C-N 3.32Å; V72-F74 PolarHBondContact O-N 3.18Å; F74-G76 VanDerWaalsContact C-N 3.31Å; F74-G76 PolarHBondContact O-N 2.73Å; F74-C77 PolarHBondContact O-N 3.36Å; F74-C78 VanDerWaalsContact CE2-SG 3.53Å; F74-C78 WeakPolarHBondContact CZ-SG 3.32Å; F74-C78 WeakPolarHBondContact O-CB 3.11Å; F74-C78 PolarHBondContact O-N 2.96Å |
| 75 | F | 88.9 | Confident | 89.1 | Confident | 78 Ų | 78 | 51 Ų | 51 | 34% | 0.342 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -63.2 | -37.6 | 176.8 | -67 | -42.1 | 0 | 0 | 0 | 112.3 | A71 V72 G79 F91 | A71-F75 VanDerWaalsContact O-CD2 3.3Å; A71-F75 WeakPolarHBondContact O-CD2 3.1Å; A71-F75 PolarHBondContact O-N 3.36Å; V72-F75 PolarHBondContact O-N 3.05Å; F75-G79 WeakPolarHBondContact O-CA 3.22Å; F75-G79 PolarHBondContact O-N 3.13Å; F75-F91 HydrophobicContact CB-CB 4.3Å; F75-F91 HydrophobicContact CB-CD2 4.45Å |
| 76 | G | 88.1 | Confident | 88.8 | Confident | 2 Ų | 2 | 53.7 Ų | 53.7 | 2% | 0.021 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -63.1 | -48.6 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | V72 G73 F74 A80 | V72-G76 PolarHBondContact O-N 3.43Å; G73-G76 PolarHBondContact O-N 3.28Å; F74-G76 VanDerWaalsContact C-N 3.31Å; F74-G76 PolarHBondContact O-N 2.73Å; G76-A80 WeakPolarHBondContact O-CB 3.27Å; G76-A80 PolarHBondContact O-N 2.95Å |
| 77 | C | 87.9 | Confident | 88.4 | Confident | 9 Ų | 9 | 55.3 Ų | 55.3 | 6% | 0.061 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -63.6 | -49.5 | 177 | -71.3 | 0 | 0 | 0 | 0 | 112.2 | L16 L20 G73 F74 G79 A80 M81 | L16-C77 HydrophobicContact CD1-CB 4.07Å; L20-C77 VanDerWaalsContact CA-SG 3.56Å; L20-C77 PolarHBondContact N-SG 3.49Å; G73-C77 WeakPolarHBondContact O-CB 3.2Å; G73-C77 PolarHBondContact O-N 3.24Å; G73-C77 PolarHBondContact O-SG 2.96Å; G73-C77 VanDerWaalsContact O-SG 3.34Å; F74-C77 PolarHBondContact O-N 3.36Å; C77-G79 VanDerWaalsContact C-N 3.35Å; C77-G79 PolarHBondContact O-N 3.24Å; C77-A80 PolarHBondContact O-N 3.36Å; C77-M81 HydrophobicContact CB-CE 4.42Å; C77-M81 WeakPolarHBondContact O-CB 3.22Å; C77-M81 WeakPolarHBondContact O-CG 3.24Å; C77-M81 PolarHBondContact O-N 2.8Å |
| 78 | C | 87.6 | Confident | 88 | Confident | 15 Ų | 15 | 53.5 Ų | 53.5 | 10% | 0.101 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -65.4 | -37.6 | 179.3 | -74.1 | 0 | 0 | 0 | 0 | 112.3 | F74 M81 R82 V87 | F74-C78 VanDerWaalsContact CE2-SG 3.53Å; F74-C78 WeakPolarHBondContact CZ-SG 3.32Å; F74-C78 WeakPolarHBondContact O-CB 3.11Å; F74-C78 PolarHBondContact O-N 2.96Å; C78-M81 PolarHBondContact O-N 3.05Å; C78-R82 VanDerWaalsContact O-CB 3.28Å; C78-R82 WeakPolarHBondContact O-CB 3.26Å; C78-R82 WeakPolarHBondContact O-CG 3.27Å; C78-R82 PolarHBondContact O-N 3.33Å; C78-V87 HydrophobicContact CB-CG1 4.2Å |
| 79 | G | 84.1 | Confident | 87.7 | Confident | 0 Ų | 0 | 50.3 Ų | 50.3 | 0% | 0 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -62.5 | -44.2 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | F75 C77 E83 | F75-G79 WeakPolarHBondContact O-CA 3.22Å; F75-G79 PolarHBondContact O-N 3.13Å; C77-G79 VanDerWaalsContact C-N 3.35Å; C77-G79 PolarHBondContact O-N 3.24Å; G79-E83 PolarHBondContact O-N 2.98Å |
| 80 | A | 83.6 | Confident | 87.6 | Confident | 2 Ų | 2 | 50.1 Ų | 50.1 | 2% | 0.017 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -66.7 | -42.9 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | K12 G76 C77 | K12-A80 WeakPolarHBondContact CE-O 3.42Å; G76-A80 WeakPolarHBondContact O-CB 3.27Å; G76-A80 PolarHBondContact O-N 2.95Å; C77-A80 PolarHBondContact O-N 3.36Å |
| 81 | M | 83.4 | Confident | 87.4 | Confident | 112 Ų | 112 | 47.1 Ų | 47.1 | 55% | 0.552 | 25% | 0.252 | S | S | * | . | H | α-helix | trans | -72.1 | -46.2 | -178 | -72.9 | -170.4 | -66.3 | 0 | 0 | 113.4 | L16 C77 C78 E83 | L16-M81 HydrophobicContact CD1-CG 3.82Å; L16-M81 HydrophobicContact CD1-SD 4.38Å; C77-M81 HydrophobicContact CB-CE 4.42Å; C77-M81 WeakPolarHBondContact O-CB 3.22Å; C77-M81 WeakPolarHBondContact O-CG 3.24Å; C77-M81 PolarHBondContact O-N 2.8Å; C78-M81 PolarHBondContact O-N 3.05Å; M81-E83 VanDerWaalsContact C-N 3.28Å; M81-E83 PolarHBondContact O-N 2.85Å |
| 82 | R | 82.4 | Confident | 87.4 | Confident | 194 Ų | 194 | 48.4 Ų | 48.4 | 73% | 0.732 | 25% | 0.251 | S | S | * | . | H | α-helix | trans | -81.6 | -6 | -174.2 | -65.8 | -171 | 175.5 | -168.1 | -0.6 | 113.7 | C78 S84 | C78-R82 VanDerWaalsContact O-CB 3.28Å; C78-R82 WeakPolarHBondContact O-CB 3.26Å; C78-R82 WeakPolarHBondContact O-CG 3.27Å; C78-R82 PolarHBondContact O-N 3.33Å; R82-S84 PolarHBondContact O-N 3.44Å |
| 83 | E | 82.1 | Confident | 87.5 | Confident | 97 Ų | 97 | 51.5 Ų | 51.5 | 45% | 0.453 | 27% | 0.27 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 47.3 | 34.5 | -176 | -60.9 | -174.2 | 164.7 | 0 | 0 | 112.4 | K12 G79 M81 I214 | K12-E83 IonicContact NZ-OE1 2.66Å; K12-E83 PolarHBondContact NZ-OE1 2.74Å; G79-E83 PolarHBondContact O-N 2.98Å; M81-E83 VanDerWaalsContact C-N 3.28Å; M81-E83 PolarHBondContact O-N 2.85Å; E83-I214 HydrophobicContact CB-CD1 4.04Å; E83-I214 HydrophobicContact CB-CG1 4.35Å; E83-I214 HydrophobicContact CG-CD1 4.47Å; E83-I214 WeakPolarHBondContact O-CG2 3.18Å |
| 84 | S | 82.9 | Confident | 87.5 | Confident | 36 Ų | 36 | 53.4 Ų | 53.4 | 25% | 0.252 | 28% | 0.282 | S | S | . | . | trans | -98.2 | 121 | -175.7 | 178.1 | 0 | 0 | 0 | 0 | 110.2 | R82 C86 V87 L88 | R82-S84 PolarHBondContact O-N 3.44Å; S84-C86 VanDerWaalsContact C-N 3.26Å; S84-C86 PolarHBondContact O-N 3.45Å; S84-V87 PolarHBondContact O-N 3.5Å; S84-L88 WeakPolarHBondContact O-CB 3.05Å; S84-L88 PolarHBondContact O-N 3.26Å | ||
| 85 | Q | 83.2 | Confident | 87.7 | Confident | 51 Ų | 51 | 48.9 Ų | 48.9 | 24% | 0.238 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -59.9 | -36.8 | 179.1 | -63.3 | 176.7 | -65.4 | 0 | 0 | 112.2 | L88 G89 I214 | Q85-L88 PolarHBondContact O-N 2.83Å; Q85-G89 PolarHBondContact O-N 3.25Å; Q85-I214 HydrophobicContact CG-CG2 3.99Å |
| 86 | C | 86.9 | Confident | 88 | Confident | 100 Ų | 100 | 49 Ų | 49 | 68% | 0.676 | 27% | 0.267 | S | S | * | . | H | α-helix | trans | -65 | -45.6 | 178.8 | -62 | 0 | 0 | 0 | 0 | 111.5 | S84 L88 G89 S90 | S84-C86 VanDerWaalsContact C-N 3.26Å; S84-C86 PolarHBondContact O-N 3.45Å; C86-L88 VanDerWaalsContact C-N 3.35Å; C86-L88 PolarHBondContact O-N 2.95Å; C86-G89 PolarHBondContact O-N 2.8Å; C86-S90 PolarHBondContact O-N 2.85Å; C86-S90 PolarHBondContact O-OG 3.18Å; C86-S90 VanDerWaalsContact O-OG 3.13Å |
| 87 | V | 88.2 | Confident | 88.3 | Confident | 34 Ų | 34 | 53.6 Ų | 53.6 | 21% | 0.206 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -67.6 | -39.3 | -179.6 | -176.4 | 0 | 0 | 0 | 0 | 110.8 | C78 S84 S90 F91 | C78-V87 HydrophobicContact CB-CG1 4.2Å; S84-V87 PolarHBondContact O-N 3.5Å; V87-S90 PolarHBondContact O-N 3.41Å; V87-F91 PolarHBondContact O-N 2.95Å |
| 88 | L | 86.4 | Confident | 88.7 | Confident | 3 Ų | 3 | 54.7 Ų | 54.7 | 2% | 0.016 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -69.1 | -34.8 | 177 | -165.5 | 58.9 | 0 | 0 | 0 | 112.2 | S84 Q85 C86 F91 F92 S207 L210 C211 I214 | S84-L88 WeakPolarHBondContact O-CB 3.05Å; S84-L88 PolarHBondContact O-N 3.26Å; Q85-L88 PolarHBondContact O-N 2.83Å; C86-L88 VanDerWaalsContact C-N 3.35Å; C86-L88 PolarHBondContact O-N 2.95Å; L88-F91 HydrophobicContact CD1-CD1 4.4Å; L88-F91 PolarHBondContact O-N 3.26Å; L88-F92 PolarHBondContact O-N 3.32Å; L88-S207 WeakPolarHBondContact CD1-OG 3.38Å; L88-S207 WeakPolarHBondContact CD2-O 3.33Å; L88-S207 PolarHBondContact O-OG 2.98Å; L88-L210 HydrophobicContact CD1-CD2 4.46Å; L88-L210 HydrophobicContact CD2-CB 3.95Å; L88-L210 HydrophobicContact CD2-CD2 4.14Å; L88-L210 HydrophobicContact CD2-CG 3.98Å; L88-C211 VanDerWaalsContact CD2-CA 3.5Å; L88-C211 HydrophobicContact CD2-CB 3.59Å; L88-C211 VanDerWaalsContact CD2-N 3.29Å; L88-C211 HydrophobicContact CG-CB 4.18Å; L88-I214 HydrophobicContact CD2-CD1 4.17Å |
| 89 | G | 88.7 | Confident | 89.1 | Confident | 29 Ų | 29 | 56.9 Ų | 56.9 | 30% | 0.299 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -66.1 | -39.9 | 171.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | Q85 C86 F92 T93 | Q85-G89 PolarHBondContact O-N 3.25Å; C86-G89 PolarHBondContact O-N 2.8Å; G89-F92 PolarHBondContact O-N 3.25Å; G89-T93 WeakPolarHBondContact O-CB 3.45Å; G89-T93 PolarHBondContact O-N 3.22Å; G89-T93 PolarHBondContact O-OG1 2.97Å |
| 90 | S | 90.6 | Very high | 89.7 | Confident | 59 Ų | 59 | 59.3 Ų | 59.3 | 41% | 0.413 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -61.1 | -45.3 | 171.5 | -60.1 | 0 | 0 | 0 | 0 | 111.2 | C86 V87 F92 T93 C94 | C86-S90 PolarHBondContact O-N 2.85Å; C86-S90 PolarHBondContact O-OG 3.18Å; C86-S90 VanDerWaalsContact O-OG 3.13Å; V87-S90 PolarHBondContact O-N 3.41Å; S90-F92 PolarHBondContact O-N 3.42Å; S90-T93 PolarHBondContact O-N 2.79Å; S90-C94 PolarHBondContact O-N 3.44Å; S90-C94 PolarHBondContact O-SG 3.36Å |
| 91 | F | 91.8 | Very high | 90.3 | Very high | 5 Ų | 5 | 61.6 Ų | 61.6 | 2% | 0.022 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -58.5 | -47.2 | 175.5 | 175.7 | -106.9 | 0 | 0 | 0 | 112.1 | N19 V72 F75 V87 L88 T93 C94 L95 | N19-F91 VanDerWaalsContact OD1-CE2 3.27Å; N19-F91 WeakPolarHBondContact OD1-CE2 3.26Å; N19-F91 WeakPolarHBondContact OD1-CZ 3.41Å; V72-F91 HydrophobicContact CG1-CD2 4.14Å; V72-F91 HydrophobicContact CG1-CE2 3.68Å; F75-F91 HydrophobicContact CB-CB 4.3Å; F75-F91 HydrophobicContact CB-CD2 4.45Å; V87-F91 PolarHBondContact O-N 2.95Å; L88-F91 HydrophobicContact CD1-CD1 4.4Å; L88-F91 PolarHBondContact O-N 3.26Å; F91-T93 VanDerWaalsContact C-N 3.34Å; F91-T93 PolarHBondContact O-N 3.29Å; F91-C94 PolarHBondContact O-N 3.09Å; F91-L95 HydrophobicContact CD1-CD1 4.11Å; F91-L95 HydrophobicContact CE1-CD1 3.47Å; F91-L95 VanDerWaalsContact CE1-CD1 3.47Å; F91-L95 HydrophobicContact CE1-CG 4.25Å; F91-L95 HydrophobicContact CE2-CD1 4.25Å; F91-L95 HydrophobicContact CE2-CD2 4.38Å; F91-L95 HydrophobicContact CE2-CG 4.25Å; F91-L95 HydrophobicContact CZ-CD1 3.57Å; F91-L95 HydrophobicContact CZ-CD2 4.32Å; F91-L95 HydrophobicContact CZ-CG 4.07Å; F91-L95 WeakPolarHBondContact O-CG 3.5Å; F91-L95 PolarHBondContact O-N 3.39Å |
| 92 | F | 93.2 | Very high | 90.8 | Very high | 66 Ų | 66 | 58.5 Ų | 58.5 | 29% | 0.289 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -58.2 | -45.5 | 175.3 | 179.1 | -96.2 | 0 | 0 | 0 | 112 | L88 G89 S90 C94 L95 L96 M204 | L88-F92 PolarHBondContact O-N 3.32Å; G89-F92 PolarHBondContact O-N 3.25Å; S90-F92 PolarHBondContact O-N 3.42Å; F92-C94 PolarHBondContact O-N 3.4Å; F92-L95 PolarHBondContact O-N 2.93Å; F92-L96 HydrophobicContact CD1-CD1 4.35Å; F92-L96 HydrophobicContact CE1-CD1 3.63Å; F92-L96 HydrophobicContact CE1-CG 4.44Å; F92-L96 HydrophobicContact CZ-CD1 4.15Å; F92-L96 PolarHBondContact O-N 3.01Å; F92-M204 HydrophobicContact CD2-CB 4.1Å; F92-M204 HydrophobicContact CD2-CG 4.2Å; F92-M204 HydrophobicContact CE2-CB 3.86Å; F92-M204 HydrophobicContact CE2-CG 4.12Å; F92-M204 HydrophobicContact CE2-SD 4.46Å |
| 93 | T | 93.3 | Very high | 91.5 | Very high | 81 Ų | 81 | 52.7 Ų | 52.7 | 50% | 0.497 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -62.6 | -42.8 | 179.1 | -54.2 | 0 | 0 | 0 | 0 | 111.3 | G89 S90 F91 L95 L96 V97 | G89-T93 WeakPolarHBondContact O-CB 3.45Å; G89-T93 PolarHBondContact O-N 3.22Å; G89-T93 PolarHBondContact O-OG1 2.97Å; S90-T93 PolarHBondContact O-N 2.79Å; F91-T93 VanDerWaalsContact C-N 3.34Å; F91-T93 PolarHBondContact O-N 3.29Å; T93-L95 PolarHBondContact O-N 3.24Å; T93-L96 WeakPolarHBondContact O-CB 3.48Å; T93-L96 PolarHBondContact O-N 2.91Å; T93-V97 WeakPolarHBondContact O-CG2 3.23Å; T93-V97 PolarHBondContact O-N 2.95Å |
| 94 | C | 93.5 | Very high | 92.1 | Very high | 40 Ų | 40 | 51.6 Ų | 51.6 | 27% | 0.27 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -59.2 | -46.6 | 174.2 | -68.9 | 0 | 0 | 0 | 0 | 111.8 | V72 S90 F91 F92 L96 V97 I98 | V72-C94 HydrophobicContact CG2-CB 4.4Å; S90-C94 PolarHBondContact O-N 3.44Å; S90-C94 PolarHBondContact O-SG 3.36Å; F91-C94 PolarHBondContact O-N 3.09Å; F92-C94 PolarHBondContact O-N 3.4Å; C94-L96 VanDerWaalsContact C-N 3.29Å; C94-L96 PolarHBondContact O-N 3.38Å; C94-V97 PolarHBondContact O-N 3.26Å; C94-I98 VanDerWaalsContact O-CG1 3.28Å; C94-I98 WeakPolarHBondContact O-CG1 3.38Å; C94-I98 PolarHBondContact O-N 3.2Å |
| 95 | L | 93.9 | Very high | 92.6 | Very high | 13 Ų | 13 | 54.5 Ų | 54.5 | 7% | 0.068 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -62.1 | -37.4 | 177 | -69.7 | -176.5 | 0 | 0 | 0 | 112.4 | V72 F91 F92 T93 I98 F99 G203 M204 | V72-L95 HydrophobicContact CG1-CD2 4.06Å; F91-L95 HydrophobicContact CD1-CD1 4.11Å; F91-L95 HydrophobicContact CE1-CD1 3.47Å; F91-L95 VanDerWaalsContact CE1-CD1 3.47Å; F91-L95 HydrophobicContact CE1-CG 4.25Å; F91-L95 HydrophobicContact CE2-CD1 4.25Å; F91-L95 HydrophobicContact CE2-CD2 4.38Å; F91-L95 HydrophobicContact CE2-CG 4.25Å; F91-L95 HydrophobicContact CZ-CD1 3.57Å; F91-L95 HydrophobicContact CZ-CD2 4.32Å; F91-L95 HydrophobicContact CZ-CG 4.07Å; F91-L95 WeakPolarHBondContact O-CG 3.5Å; F91-L95 PolarHBondContact O-N 3.39Å; F92-L95 PolarHBondContact O-N 2.93Å; T93-L95 PolarHBondContact O-N 3.24Å; L95-I98 PolarHBondContact O-N 3.07Å; L95-F99 WeakPolarHBondContact O-CB 3.44Å; L95-F99 PolarHBondContact O-N 2.99Å; L95-G203 VanDerWaalsContact CD1-C 3.48Å; L95-M204 HydrophobicContact CB-CG 3.64Å; L95-M204 HydrophobicContact CB-SD 4.37Å; L95-M204 HydrophobicContact CD1-CG 3.98Å |
| 96 | L | 95.6 | Very high | 93 | Very high | 82 Ų | 82 | 54.1 Ų | 54.1 | 43% | 0.429 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -63.8 | -44.6 | 177.6 | -132.3 | 176.6 | 0 | 0 | 0 | 111.7 | F92 T93 C94 F99 A100 M204 | F92-L96 HydrophobicContact CD1-CD1 4.35Å; F92-L96 HydrophobicContact CE1-CD1 3.63Å; F92-L96 HydrophobicContact CE1-CG 4.44Å; F92-L96 HydrophobicContact CZ-CD1 4.15Å; F92-L96 PolarHBondContact O-N 3.01Å; T93-L96 WeakPolarHBondContact O-CB 3.48Å; T93-L96 PolarHBondContact O-N 2.91Å; C94-L96 VanDerWaalsContact C-N 3.29Å; C94-L96 PolarHBondContact O-N 3.38Å; L96-F99 PolarHBondContact O-N 3.42Å; L96-A100 PolarHBondContact O-N 3.34Å; L96-M204 HydrophobicContact CB-SD 4.47Å; L96-M204 HydrophobicContact CG-SD 4.21Å |
| 97 | V | 95.8 | Very high | 93.3 | Very high | 97 Ų | 97 | 52.9 Ų | 52.9 | 59% | 0.588 | 33% | 0.331 | S | S | * | . | H | α-helix | trans | -64.3 | -42 | 176.1 | 173.8 | 0 | 0 | 0 | 0 | 110.8 | T93 C94 A100 A101 | T93-V97 WeakPolarHBondContact O-CG2 3.23Å; T93-V97 PolarHBondContact O-N 2.95Å; C94-V97 PolarHBondContact O-N 3.26Å; V97-A100 PolarHBondContact O-N 3.43Å; V97-A101 WeakPolarHBondContact O-CB 3.5Å; V97-A101 PolarHBondContact O-N 3.27Å |
| 98 | I | 94.9 | Very high | 93.5 | Very high | 33 Ų | 33 | 58.4 Ų | 58.4 | 17% | 0.169 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -62 | -46.1 | 176.4 | -70.4 | 166.8 | 0 | 0 | 0 | 110.6 | L68 V72 C94 L95 A100 A101 E102 T200 | L68-I98 HydrophobicContact CD2-CD1 4.4Å; L68-I98 HydrophobicContact CD2-CG1 4.39Å; L68-I98 HydrophobicContact CG-CD1 4.45Å; V72-I98 HydrophobicContact CG2-CD1 3.64Å; C94-I98 VanDerWaalsContact O-CG1 3.28Å; C94-I98 WeakPolarHBondContact O-CG1 3.38Å; C94-I98 PolarHBondContact O-N 3.2Å; L95-I98 PolarHBondContact O-N 3.07Å; I98-A100 VanDerWaalsContact C-N 3.34Å; I98-A100 PolarHBondContact O-N 3.3Å; I98-A101 CarbonylContact O-C 3.54Å; I98-A101 WeakPolarHBondContact O-CA 3.31Å; I98-A101 WeakPolarHBondContact O-CB 3.38Å; I98-A101 PolarHBondContact O-N 2.79Å; I98-A101 VanDerWaalsContact O-N 3.09Å; I98-E102 HydrophobicContact CG2-CG 4.29Å; I98-E102 WeakPolarHBondContact O-CG 3.25Å; I98-E102 PolarHBondContact O-N 3.32Å; I98-T200 HydrophobicContact CG2-CG2 4.21Å |
| 99 | F | 96.8 | Very high | 93.6 | Very high | 60 Ų | 60 | 60.5 Ų | 60.5 | 26% | 0.263 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -60.9 | -42 | 177.8 | -179 | -105.2 | 0 | 0 | 0 | 112.2 | L95 L96 A101 E102 V103 A197 I201 M204 | L95-F99 WeakPolarHBondContact O-CB 3.44Å; L95-F99 PolarHBondContact O-N 2.99Å; L96-F99 PolarHBondContact O-N 3.42Å; F99-A101 VanDerWaalsContact C-N 3.31Å; F99-A101 PolarHBondContact O-N 2.92Å; F99-E102 WeakPolarHBondContact O-CB 3.35Å; F99-E102 PolarHBondContact O-N 3.14Å; F99-V103 HydrophobicContact CD1-CG2 4.49Å; F99-V103 HydrophobicContact CE1-CG2 4.08Å; F99-V103 HydrophobicContact CE2-CG2 4.29Å; F99-V103 HydrophobicContact CZ-CG2 3.97Å; F99-V103 WeakPolarHBondContact O-CG2 3.27Å; F99-V103 PolarHBondContact O-N 3.11Å; F99-A197 HydrophobicContact CE2-CB 4.27Å; F99-I201 HydrophobicContact CD2-CG1 4.24Å; F99-I201 HydrophobicContact CE2-CD1 3.78Å; F99-I201 HydrophobicContact CE2-CG1 3.87Å; F99-I201 HydrophobicContact CZ-CD1 4.15Å; F99-I201 HydrophobicContact CZ-CG1 4.39Å; F99-M204 HydrophobicContact CB-CE 4.13Å; F99-M204 HydrophobicContact CD1-CE 4.44Å; F99-M204 HydrophobicContact CD2-CE 4.38Å; F99-M204 HydrophobicContact CG-CE 4.06Å |
| 100 | A | 97 | Very high | 93.6 | Very high | 51 Ų | 51 | 66.4 Ų | 66.4 | 42% | 0.421 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -62.2 | -39.8 | 174 | 0 | 0 | 0 | 0 | 0 | 112 | L96 V97 I98 T104 | L96-A100 PolarHBondContact O-N 3.34Å; V97-A100 PolarHBondContact O-N 3.43Å; I98-A100 VanDerWaalsContact C-N 3.34Å; I98-A100 PolarHBondContact O-N 3.3Å; A100-T104 WeakPolarHBondContact O-CB 3.45Å; A100-T104 PolarHBondContact O-N 3.41Å; A100-T104 PolarHBondContact O-OG1 3.37Å |
| 101 | A | 95.6 | Very high | 93.6 | Very high | 50 Ų | 50 | 69.6 Ų | 69.6 | 41% | 0.413 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -67.2 | -37.8 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | V97 I98 F99 T104 T105 | V97-A101 WeakPolarHBondContact O-CB 3.5Å; V97-A101 PolarHBondContact O-N 3.27Å; I98-A101 CarbonylContact O-C 3.54Å; I98-A101 WeakPolarHBondContact O-CA 3.31Å; I98-A101 WeakPolarHBondContact O-CB 3.38Å; I98-A101 PolarHBondContact O-N 2.79Å; I98-A101 VanDerWaalsContact O-N 3.09Å; F99-A101 VanDerWaalsContact C-N 3.31Å; F99-A101 PolarHBondContact O-N 2.92Å; A101-T104 PolarHBondContact O-N 3.13Å; A101-T105 VanDerWaalsContact O-CB 3.25Å; A101-T105 WeakPolarHBondContact O-CB 3.06Å; A101-T105 PolarHBondContact O-N 3.45Å; A101-T105 PolarHBondContact O-OG1 2.82Å |
| 102 | E | 94.3 | Very high | 93.5 | Very high | 48 Ų | 48 | 70.6 Ų | 70.6 | 22% | 0.224 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -61.8 | -49.1 | 174.7 | -75.7 | 171.4 | 173.7 | 0 | 0 | 111.1 | I98 F99 T105 G106 I196 A197 T200 | I98-E102 HydrophobicContact CG2-CG 4.29Å; I98-E102 WeakPolarHBondContact O-CG 3.25Å; I98-E102 PolarHBondContact O-N 3.32Å; F99-E102 WeakPolarHBondContact O-CB 3.35Å; F99-E102 PolarHBondContact O-N 3.14Å; E102-T105 PolarHBondContact O-N 3.47Å; E102-G106 PolarHBondContact O-N 2.94Å; E102-I196 WeakPolarHBondContact OE1-CG2 3.24Å; E102-A197 WeakPolarHBondContact OE2-CA 3.34Å; E102-T200 WeakPolarHBondContact OE1-CG2 3.05Å; E102-T200 PolarHBondContact OE2-OG1 3.47Å; E102-T200 VanDerWaalsContact OE2-OG1 3.11Å |
| 103 | V | 95.9 | Very high | 93.3 | Very high | 72 Ų | 72 | 70.9 Ų | 70.9 | 44% | 0.436 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -62 | -46.3 | 177.2 | 173.7 | 0 | 0 | 0 | 0 | 110.5 | F99 G106 V107 | F99-V103 HydrophobicContact CD1-CG2 4.49Å; F99-V103 HydrophobicContact CE1-CG2 4.08Å; F99-V103 HydrophobicContact CE2-CG2 4.29Å; F99-V103 HydrophobicContact CZ-CG2 3.97Å; F99-V103 WeakPolarHBondContact O-CG2 3.27Å; F99-V103 PolarHBondContact O-N 3.11Å; V103-G106 PolarHBondContact O-N 3.42Å; V103-V107 HydrophobicContact CG1-CG2 4.44Å; V103-V107 VanDerWaalsContact O-CG2 3.29Å; V103-V107 WeakPolarHBondContact O-CG2 3.42Å; V103-V107 PolarHBondContact O-N 3.09Å |
| 104 | T | 95.4 | Very high | 93.1 | Very high | 73 Ų | 73 | 70.9 Ų | 70.9 | 45% | 0.448 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -60.1 | -51.8 | 178.8 | -56.5 | 0 | 0 | 0 | 0 | 110.5 | A100 A101 G106 V107 F108 | A100-T104 WeakPolarHBondContact O-CB 3.45Å; A100-T104 PolarHBondContact O-N 3.41Å; A100-T104 PolarHBondContact O-OG1 3.37Å; A101-T104 PolarHBondContact O-N 3.13Å; T104-G106 VanDerWaalsContact C-N 3.31Å; T104-G106 PolarHBondContact O-N 3.03Å; T104-V107 PolarHBondContact O-N 2.93Å; T104-F108 HydrophobicContact CG2-CD2 3.7Å; T104-F108 HydrophobicContact CG2-CE2 3.77Å; T104-F108 VanDerWaalsContact O-CD2 3.31Å; T104-F108 WeakPolarHBondContact O-CD2 3.48Å; T104-F108 PolarHBondContact O-N 3.36Å |
| 105 | T | 92.8 | Very high | 92.9 | Very high | 97 Ų | 97 | 74 Ų | 74 | 60% | 0.595 | 43% | 0.427 | S | S | * | . | H | α-helix | trans | -59.5 | -42.2 | 179 | -56.4 | 0 | 0 | 0 | 0 | 111.3 | A101 E102 F108 A109 | A101-T105 VanDerWaalsContact O-CB 3.25Å; A101-T105 WeakPolarHBondContact O-CB 3.06Å; A101-T105 PolarHBondContact O-N 3.45Å; A101-T105 PolarHBondContact O-OG1 2.82Å; E102-T105 PolarHBondContact O-N 3.47Å; T105-F108 PolarHBondContact O-N 3.33Å; T105-A109 VanDerWaalsContact O-CB 3.24Å; T105-A109 WeakPolarHBondContact O-CB 3.35Å; T105-A109 PolarHBondContact O-N 3.41Å |
| 106 | G | 93.4 | Very high | 92.6 | Very high | 43 Ų | 43 | 75.6 Ų | 75.6 | 44% | 0.443 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -62.1 | -44.6 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | E102 V103 T104 A109 F110 | E102-G106 PolarHBondContact O-N 2.94Å; V103-G106 PolarHBondContact O-N 3.42Å; T104-G106 VanDerWaalsContact C-N 3.31Å; T104-G106 PolarHBondContact O-N 3.03Å; G106-A109 PolarHBondContact O-N 3.25Å; G106-F110 WeakPolarHBondContact O-CB 3.31Å; G106-F110 PolarHBondContact O-N 3.23Å |
| 107 | V | 93 | Very high | 92.3 | Very high | 74 Ų | 74 | 72.3 Ų | 72.3 | 45% | 0.448 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -64.9 | -46.6 | 177 | 172.9 | 0 | 0 | 0 | 0 | 110.9 | V103 T104 A109 F110 I111 | V103-V107 HydrophobicContact CG1-CG2 4.44Å; V103-V107 VanDerWaalsContact O-CG2 3.29Å; V103-V107 WeakPolarHBondContact O-CG2 3.42Å; V103-V107 PolarHBondContact O-N 3.09Å; T104-V107 PolarHBondContact O-N 2.93Å; V107-A109 PolarHBondContact O-N 3.49Å; V107-F110 PolarHBondContact O-N 3.24Å; V107-I111 HydrophobicContact CG1-CD1 3.66Å; V107-I111 HydrophobicContact CG1-CG1 4.41Å; V107-I111 WeakPolarHBondContact O-CG1 3.48Å; V107-I111 PolarHBondContact O-N 2.98Å |
| 108 | F | 91.4 | Very high | 92 | Very high | 150 Ų | 150 | 76.2 Ų | 76.2 | 66% | 0.658 | 43% | 0.429 | S | S | * | . | H | α-helix | trans | -61.9 | -41.7 | 177.4 | -91.2 | -90.8 | 0 | 0 | 0 | 112.2 | T104 T105 F110 G112 | T104-F108 HydrophobicContact CG2-CD2 3.7Å; T104-F108 HydrophobicContact CG2-CE2 3.77Å; T104-F108 VanDerWaalsContact O-CD2 3.31Å; T104-F108 WeakPolarHBondContact O-CD2 3.48Å; T104-F108 PolarHBondContact O-N 3.36Å; T105-F108 PolarHBondContact O-N 3.33Å; F108-F110 VanDerWaalsContact C-N 3.31Å; F108-F110 PolarHBondContact O-N 3.05Å; F108-G112 WeakPolarHBondContact O-CA 3.42Å; F108-G112 PolarHBondContact O-N 2.93Å |
| 109 | A | 89.2 | Confident | 91.8 | Very high | 48 Ų | 48 | 80 Ų | 80 | 40% | 0.397 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -63.2 | -37.5 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | T105 G106 V107 K113 | T105-A109 VanDerWaalsContact O-CB 3.24Å; T105-A109 WeakPolarHBondContact O-CB 3.35Å; T105-A109 PolarHBondContact O-N 3.41Å; G106-A109 PolarHBondContact O-N 3.25Å; V107-A109 PolarHBondContact O-N 3.49Å; A109-K113 PolarHBondContact O-N 2.86Å |
| 110 | F | 88.4 | Confident | 91.4 | Very high | 153 Ų | 153 | 78.8 Ų | 78.8 | 67% | 0.671 | 44% | 0.443 | S | S | * | . | H | α-helix | trans | -71.4 | -47.9 | 179.5 | -173.1 | -97.6 | 0 | 0 | 0 | 112.6 | G106 V107 F108 K113 | G106-F110 WeakPolarHBondContact O-CB 3.31Å; G106-F110 PolarHBondContact O-N 3.23Å; V107-F110 PolarHBondContact O-N 3.24Å; F108-F110 VanDerWaalsContact C-N 3.31Å; F108-F110 PolarHBondContact O-N 3.05Å; F110-K113 WeakPolarHBondContact O-CG 3.37Å |
| 111 | I | 90.9 | Very high | 91 | Very high | 125 Ų | 125 | 77.9 Ų | 77.9 | 64% | 0.641 | 43% | 0.43 | S | S | * | . | H | α-helix | trans | -70.6 | -36.9 | -179.6 | -60.5 | 171.3 | 0 | 0 | 0 | 110.7 | V107 K113 | V107-I111 HydrophobicContact CG1-CD1 3.66Å; V107-I111 HydrophobicContact CG1-CG1 4.41Å; V107-I111 WeakPolarHBondContact O-CG1 3.48Å; V107-I111 PolarHBondContact O-N 2.98Å; I111-K113 VanDerWaalsContact C-N 3.31Å; I111-K113 PolarHBondContact O-N 3.31Å |
| 112 | G | 88.9 | Confident | 90.7 | Very high | 26 Ų | 26 | 78.6 Ų | 78.6 | 27% | 0.268 | 43% | 0.43 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -81.6 | 1.4 | -178.1 | 0 | 0 | 0 | 0 | 0 | 115.2 | F108 D114 V115 A116 | F108-G112 WeakPolarHBondContact O-CA 3.42Å; F108-G112 PolarHBondContact O-N 2.93Å; G112-D114 PolarHBondContact O-N 3.5Å; G112-V115 PolarHBondContact O-N 3.47Å; G112-A116 WeakPolarHBondContact O-CB 3.49Å; G112-A116 PolarHBondContact O-N 2.96Å |
| 113 | K | 88.3 | Confident | 90.4 | Very high | 73 Ų | 73 | 79 Ų | 79 | 32% | 0.317 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -57.8 | -45.5 | -172.6 | 72.8 | -176.1 | 179.2 | 63.8 | 0 | 113 | A109 F110 I111 V115 A116 I117 L186 | A109-K113 PolarHBondContact O-N 2.86Å; F110-K113 WeakPolarHBondContact O-CG 3.37Å; I111-K113 VanDerWaalsContact C-N 3.31Å; I111-K113 PolarHBondContact O-N 3.31Å; K113-V115 VanDerWaalsContact C-N 3.35Å; K113-A116 PolarHBondContact O-N 3.4Å; K113-I117 VanDerWaalsContact O-CG1 3.3Å; K113-I117 WeakPolarHBondContact O-CG1 3.4Å; K113-I117 PolarHBondContact O-N 2.96Å; K113-L186 HydrophobicContact CB-CD1 3.87Å |
| 114 | D | 89.4 | Confident | 90 | Very high | 80 Ų | 80 | 75.7 Ų | 75.7 | 43% | 0.428 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -73.4 | -33.2 | -175.4 | -57.8 | -63.3 | 0 | 0 | 0 | 110.8 | G112 R118 | G112-D114 PolarHBondContact O-N 3.5Å; D114-R118 WeakPolarHBondContact O-CG 3.36Å; D114-R118 PolarHBondContact O-N 2.99Å; D114-R118 VanDerWaalsContact O-N 3.09Å |
| 115 | V | 90.1 | Very high | 89.6 | Confident | 105 Ų | 105 | 76.1 Ų | 76.1 | 64% | 0.636 | 41% | 0.409 | S | S | * | . | H | α-helix | trans | -67.4 | -42.9 | 173.7 | -179.1 | 0 | 0 | 0 | 0 | 110.6 | G112 K113 R118 H119 | G112-V115 PolarHBondContact O-N 3.47Å; K113-V115 VanDerWaalsContact C-N 3.35Å; V115-R118 PolarHBondContact O-N 3.36Å; V115-H119 WeakPolarHBondContact O-CB 3.45Å; V115-H119 PolarHBondContact O-N 2.86Å |
| 116 | A | 86.9 | Confident | 89.3 | Confident | 47 Ų | 47 | 77.7 Ų | 77.7 | 39% | 0.388 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -63.3 | -44 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | G112 K113 H119 V120 | G112-A116 WeakPolarHBondContact O-CB 3.49Å; G112-A116 PolarHBondContact O-N 2.96Å; K113-A116 PolarHBondContact O-N 3.4Å; A116-H119 PolarHBondContact O-N 3.18Å; A116-V120 WeakPolarHBondContact O-CG2 3.43Å; A116-V120 PolarHBondContact O-N 2.88Å |
| 117 | I | 89.2 | Confident | 88.8 | Confident | 13 Ų | 13 | 76.7 Ų | 76.7 | 7% | 0.067 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -58.4 | -51.2 | 175.9 | -68.7 | 163.9 | 0 | 0 | 0 | 110.1 | K113 H119 V120 Q121 E179 I182 | K113-I117 VanDerWaalsContact O-CG1 3.3Å; K113-I117 WeakPolarHBondContact O-CG1 3.4Å; K113-I117 PolarHBondContact O-N 2.96Å; I117-H119 VanDerWaalsContact C-N 3.32Å; I117-H119 PolarHBondContact O-N 3.41Å; I117-V120 PolarHBondContact O-N 2.85Å; I117-Q121 HydrophobicContact CG2-CG 4.41Å; I117-Q121 WeakPolarHBondContact O-CB 3.43Å; I117-Q121 WeakPolarHBondContact O-CG 3.46Å; I117-Q121 PolarHBondContact O-N 3.5Å; I117-E179 HydrophobicContact CD1-CG 4.46Å; I117-E179 HydrophobicContact CG2-CB 4.05Å; I117-E179 HydrophobicContact CG2-CG 4.19Å; I117-I182 HydrophobicContact CD1-CG2 4.23Å; I117-I182 HydrophobicContact CG1-CB 3.98Å; I117-I182 HydrophobicContact CG1-CD1 4.23Å; I117-I182 HydrophobicContact CG1-CG2 3.55Å |
| 118 | R | 90.6 | Very high | 88.5 | Confident | 180 Ų | 180 | 74.1 Ų | 74.1 | 68% | 0.679 | 38% | 0.379 | S | S | * | . | H | α-helix | trans | -60.1 | -42.1 | 178.5 | -74.4 | -177 | -178.7 | -178.1 | 1.5 | 112.4 | D114 V115 V120 Q121 T122 | D114-R118 WeakPolarHBondContact O-CG 3.36Å; D114-R118 PolarHBondContact O-N 2.99Å; D114-R118 VanDerWaalsContact O-N 3.09Å; V115-R118 PolarHBondContact O-N 3.36Å; R118-V120 PolarHBondContact O-N 3.3Å; R118-Q121 PolarHBondContact O-N 3.49Å; R118-T122 PolarHBondContact O-N 3.34Å; R118-T122 PolarHBondContact O-OG1 3.45Å |
| 119 | H | 89.4 | Confident | 88.2 | Confident | 111 Ų | 111 | 69.3 Ų | 69.3 | 51% | 0.514 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -63.7 | -43 | -179.6 | -168.5 | 65.4 | 0 | 0 | 0 | 112.1 | V115 A116 I117 T122 M123 | V115-H119 WeakPolarHBondContact O-CB 3.45Å; V115-H119 PolarHBondContact O-N 2.86Å; A116-H119 PolarHBondContact O-N 3.18Å; I117-H119 VanDerWaalsContact C-N 3.32Å; I117-H119 PolarHBondContact O-N 3.41Å; H119-T122 PolarHBondContact O-N 3.29Å; H119-M123 WeakPolarHBondContact O-CG 3.28Å; H119-M123 PolarHBondContact O-N 2.9Å |
| 120 | V | 88.2 | Confident | 87.9 | Confident | 36 Ų | 36 | 70.6 Ų | 70.6 | 22% | 0.218 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -66.7 | -40.5 | 175.5 | 177.9 | 0 | 0 | 0 | 0 | 111 | A116 I117 R118 M123 Y124 F145 F149 I178 I182 | A116-V120 WeakPolarHBondContact O-CG2 3.43Å; A116-V120 PolarHBondContact O-N 2.88Å; I117-V120 PolarHBondContact O-N 2.85Å; R118-V120 PolarHBondContact O-N 3.3Å; V120-M123 PolarHBondContact O-N 3.4Å; V120-Y124 PolarHBondContact O-N 3.28Å; V120-F145 HydrophobicContact CG1-CE1 4.25Å; V120-F149 HydrophobicContact CG1-CZ 4.45Å; V120-I178 HydrophobicContact CB-CG2 4.19Å; V120-I178 HydrophobicContact CG1-CD1 4.44Å; V120-I178 HydrophobicContact CG1-CG2 3.74Å; V120-I182 HydrophobicContact CB-CD1 4.01Å; V120-I182 HydrophobicContact CG1-CD1 4.18Å; V120-I182 HydrophobicContact CG2-CD1 4.05Å |
| 121 | Q | 90.1 | Very high | 87.6 | Confident | 31 Ų | 31 | 64 Ų | 64 | 15% | 0.145 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -59.5 | -49.6 | 174.1 | -74.5 | 173.2 | -31.3 | 0 | 0 | 110.8 | I117 R118 M123 Y124 E125 I175 I178 | I117-Q121 HydrophobicContact CG2-CG 4.41Å; I117-Q121 WeakPolarHBondContact O-CB 3.43Å; I117-Q121 WeakPolarHBondContact O-CG 3.46Å; I117-Q121 PolarHBondContact O-N 3.5Å; R118-Q121 PolarHBondContact O-N 3.49Å; Q121-M123 PolarHBondContact O-N 3Å; Q121-Y124 WeakPolarHBondContact O-CB 3.36Å; Q121-Y124 PolarHBondContact O-N 3.05Å; Q121-Y124 VanDerWaalsContact O-N 3.1Å; Q121-E125 VanDerWaalsContact O-CG 3.3Å; Q121-E125 WeakPolarHBondContact O-CG 3.48Å; Q121-E125 PolarHBondContact O-N 3.28Å; Q121-I175 HydrophobicContact CG-CG2 4.22Å; Q121-I175 PolarHBondContact NE2-O 3.11Å; Q121-I178 HydrophobicContact CG-CB 4.5Å; Q121-I178 HydrophobicContact CG-CG2 4.01Å |
| 122 | T | 89.6 | Confident | 87.2 | Confident | 65 Ų | 65 | 60.8 Ų | 60.8 | 40% | 0.399 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -59.3 | -43.6 | 177.2 | -57.5 | 0 | 0 | 0 | 0 | 112.2 | R118 H119 Y124 E125 E126 | R118-T122 PolarHBondContact O-N 3.34Å; R118-T122 PolarHBondContact O-OG1 3.45Å; H119-T122 PolarHBondContact O-N 3.29Å; T122-Y124 VanDerWaalsContact C-N 3.29Å; T122-Y124 PolarHBondContact O-N 2.86Å; T122-E125 PolarHBondContact O-N 3.48Å; T122-E125 VanDerWaalsContact O-N 3.11Å; T122-E126 WeakPolarHBondContact O-CG 3.36Å; T122-E126 PolarHBondContact O-N 3.45Å |
| 123 | M | 86.3 | Confident | 86.9 | Confident | 58 Ų | 58 | 67.7 Ų | 67.7 | 29% | 0.286 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -61.2 | -38.4 | 175.4 | -76.5 | -146 | -90.9 | 0 | 0 | 112.4 | H119 V120 Q121 A127 | H119-M123 WeakPolarHBondContact O-CG 3.28Å; H119-M123 PolarHBondContact O-N 2.9Å; V120-M123 PolarHBondContact O-N 3.4Å; Q121-M123 PolarHBondContact O-N 3Å; M123-A127 WeakPolarHBondContact O-CB 3.39Å; M123-A127 PolarHBondContact O-N 2.62Å |
| 124 | Y | 87.3 | Confident | 86.4 | Confident | 1 Ų | 1 | 67.6 Ų | 67.6 | 0% | 0.004 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -64.9 | -42.1 | 173.2 | 176.4 | -98.5 | 0 | 0 | 0 | 111.6 | V120 Q121 T122 A127 Y128 L142 F145 H146 G153 K154 C174 I175 I178 | V120-Y124 PolarHBondContact O-N 3.28Å; Q121-Y124 WeakPolarHBondContact O-CB 3.36Å; Q121-Y124 PolarHBondContact O-N 3.05Å; Q121-Y124 VanDerWaalsContact O-N 3.1Å; T122-Y124 VanDerWaalsContact C-N 3.29Å; T122-Y124 PolarHBondContact O-N 2.86Å; Y124-A127 PolarHBondContact O-N 2.92Å; Y124-Y128 VanDerWaalsContact O-CB 3.27Å; Y124-Y128 WeakPolarHBondContact O-CB 3.14Å; Y124-Y128 PolarHBondContact O-N 3.44Å; Y124-L142 HydrophobicContact CD2-CD1 4.29Å; Y124-L142 HydrophobicContact CE2-CD1 3.67Å; Y124-F145 HydrophobicContact CD2-CB 3.86Å; Y124-F145 AromaticContact CD2-CD1 3.92Å; Y124-F145 HydrophobicContact CD2-CD1 3.92Å; Y124-F145 AromaticContact CD2-CG 3.87Å; Y124-F145 HydrophobicContact CD2-CG 3.87Å; Y124-F145 HydrophobicContact CE2-CB 4.07Å; Y124-H146 AromaticContact CE2-CD2 3.97Å; Y124-H146 AromaticContact CE2-NE2 3.83Å; Y124-H146 AromaticContact CZ-NE2 3.83Å; Y124-H146 PolarHBondContact OH-NE2 3.28Å; Y124-G153 WeakPolarHBondContact OH-CA 3.38Å; Y124-G153 PolarHBondContact OH-N 2.81Å; Y124-G153 PolarHBondContact OH-O 3.35Å; Y124-K154 HydrophobicContact CE1-CG 4.13Å; Y124-C174 HydrophobicContact CD1-CB 4.23Å; Y124-C174 HydrophobicContact CE1-CB 3.61Å; Y124-C174 HydrophobicContact CE2-CB 3.94Å; Y124-C174 VanDerWaalsContact CZ-CB 3.45Å; Y124-C174 PolarHBondContact OH-SG 3.33Å; Y124-I175 HydrophobicContact CD1-CD1 3.69Å; Y124-I175 HydrophobicContact CE1-CD1 4.2Å; Y124-I178 HydrophobicContact CG-CD1 4.09Å |
| 125 | E | 88.3 | Confident | 85.5 | Confident | 83 Ų | 83 | 71.4 Ų | 71.4 | 39% | 0.388 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -64.1 | -40.4 | 178.2 | -61.9 | -154.5 | 123.8 | 0 | 0 | 113 | Q121 T122 Y128 S129 K154 I175 | Q121-E125 VanDerWaalsContact O-CG 3.3Å; Q121-E125 WeakPolarHBondContact O-CG 3.48Å; Q121-E125 PolarHBondContact O-N 3.28Å; T122-E125 PolarHBondContact O-N 3.48Å; T122-E125 VanDerWaalsContact O-N 3.11Å; E125-Y128 PolarHBondContact O-N 3.41Å; E125-S129 WeakPolarHBondContact O-CB 3.48Å; E125-S129 PolarHBondContact O-N 2.82Å; E125-K154 VanDerWaalsContact CG-NZ 3.32Å; E125-K154 IonicContact OE1-NZ 2.71Å; E125-K154 PolarHBondContact OE1-NZ 3.48Å; E125-I175 HydrophobicContact CG-CD1 4.07Å |
| 126 | E | 85.9 | Confident | 84 | Confident | 130 Ų | 130 | 69.7 Ų | 69.7 | 61% | 0.607 | 36% | 0.357 | S | S | * | . | H | α-helix | trans | -64.1 | -47.4 | 175.1 | -74.5 | 179.7 | -177.9 | 0 | 0 | 111 | T122 Y128 S129 D130 | T122-E126 WeakPolarHBondContact O-CG 3.36Å; T122-E126 PolarHBondContact O-N 3.45Å; E126-Y128 VanDerWaalsContact C-N 3.31Å; E126-Y128 PolarHBondContact O-N 3.24Å; E126-S129 PolarHBondContact O-N 3.38Å; E126-D130 WeakPolarHBondContact O-CB 3.34Å; E126-D130 PolarHBondContact O-N 3Å |
| 127 | A | 83.3 | Confident | 82.5 | Confident | 21 Ų | 21 | 74.8 Ų | 74.8 | 17% | 0.174 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -61.3 | -40 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | M123 Y124 Y131 T141 | M123-A127 WeakPolarHBondContact O-CB 3.39Å; M123-A127 PolarHBondContact O-N 2.62Å; Y124-A127 PolarHBondContact O-N 2.92Å; A127-Y131 WeakPolarHBondContact O-CB 3.47Å; A127-Y131 PolarHBondContact O-N 3.3Å; A127-Y131 VanDerWaalsContact O-N 3.12Å; A127-T141 HydrophobicContact CB-CG2 4.32Å |
| 128 | Y | 85.8 | Confident | 80.9 | Confident | 21 Ų | 21 | 75 Ų | 75 | 8% | 0.082 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -64.1 | -44.7 | 174.8 | -178 | -87 | 0 | 0 | 0 | 111.6 | Y124 E125 E126 Y131 L132 L142 K154 V160 | Y124-Y128 VanDerWaalsContact O-CB 3.27Å; Y124-Y128 WeakPolarHBondContact O-CB 3.14Å; Y124-Y128 PolarHBondContact O-N 3.44Å; E125-Y128 PolarHBondContact O-N 3.41Å; E126-Y128 VanDerWaalsContact C-N 3.31Å; E126-Y128 PolarHBondContact O-N 3.24Å; Y128-Y131 PolarHBondContact O-N 3.24Å; Y128-L132 HydrophobicContact CD1-CD1 3.94Å; Y128-L132 HydrophobicContact CD1-CG 4.43Å; Y128-L132 HydrophobicContact CE1-CD1 3.35Å; Y128-L132 HydrophobicContact CE1-CG 4.1Å; Y128-L132 PolarHBondContact O-N 3.47Å; Y128-L132 VanDerWaalsContact O-N 3.16Å; Y128-L142 HydrophobicContact CD2-CD1 4.49Å; Y128-K154 HydrophobicContact CD1-CD 4.49Å; Y128-V160 HydrophobicContact CD2-CG1 3.91Å; Y128-V160 HydrophobicContact CE2-CB 4.29Å; Y128-V160 HydrophobicContact CE2-CG1 3.39Å; Y128-V160 HydrophobicContact CE2-CG2 3.95Å |
| 129 | S | 85.9 | Confident | 79.7 | Confident | 48 Ų | 48 | 70.9 Ų | 70.9 | 34% | 0.336 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -67.8 | -39.1 | 179.2 | -176.5 | 0 | 0 | 0 | 0 | 112.7 | E125 E126 L132 K133 | E125-S129 WeakPolarHBondContact O-CB 3.48Å; E125-S129 PolarHBondContact O-N 2.82Å; E126-S129 PolarHBondContact O-N 3.38Å; S129-L132 PolarHBondContact O-N 2.96Å; S129-K133 WeakPolarHBondContact O-CG 3.49Å; S129-K133 PolarHBondContact O-N 3.48Å; S129-K133 VanDerWaalsContact O-N 3.11Å |
| 130 | D | 83.6 | Confident | 78.7 | Confident | 75 Ų | 75 | 67.4 Ų | 67.4 | 40% | 0.401 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -64.2 | -42.2 | 177.5 | -164.3 | 54.4 | 0 | 0 | 0 | 110.9 | E126 L132 K133 D134 | E126-D130 WeakPolarHBondContact O-CB 3.34Å; E126-D130 PolarHBondContact O-N 3Å; D130-L132 VanDerWaalsContact C-N 3.35Å; D130-L132 PolarHBondContact O-N 2.95Å; D130-K133 PolarHBondContact O-N 3.36Å; D130-D134 PolarHBondContact O-N 3.3Å |
| 131 | Y | 81 | Confident | 78.1 | Confident | 14 Ų | 14 | 69.7 Ų | 69.7 | 6% | 0.055 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -61.5 | -39.1 | 174.7 | 178.7 | -95.4 | 0 | 0 | 0 | 113.2 | A127 Y128 K133 D134 R135 N139 L142 V160 T163 | A127-Y131 WeakPolarHBondContact O-CB 3.47Å; A127-Y131 PolarHBondContact O-N 3.3Å; A127-Y131 VanDerWaalsContact O-N 3.12Å; Y128-Y131 PolarHBondContact O-N 3.24Å; Y131-K133 VanDerWaalsContact C-N 3.34Å; Y131-D134 CarbonylContact O-C 3.37Å; Y131-R135 PolarHBondContact O-N 2.9Å; Y131-N139 HydrophobicContact CE2-CB 4.31Å; Y131-L142 HydrophobicContact CD1-CD2 3.83Å; Y131-L142 HydrophobicContact CD2-CD2 4.33Å; Y131-L142 HydrophobicContact CE1-CD2 4.49Å; Y131-L142 HydrophobicContact CG-CD2 3.74Å; Y131-V160 HydrophobicContact CD1-CG1 3.89Å; Y131-V160 HydrophobicContact CE1-CG1 3.96Å; Y131-T163 HydrophobicContact CD2-CG2 4.46Å; Y131-T163 HydrophobicContact CE1-CG2 4.37Å; Y131-T163 HydrophobicContact CE2-CG2 3.76Å |
| 132 | L | 82.4 | Confident | 77.5 | Confident | 58 Ų | 58 | 68.2 Ų | 68.2 | 30% | 0.304 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -68.7 | -32.5 | 176.3 | -72.2 | -178 | 0 | 0 | 0 | 112.8 | Y128 S129 D130 Q159 | Y128-L132 HydrophobicContact CD1-CD1 3.94Å; Y128-L132 HydrophobicContact CD1-CG 4.43Å; Y128-L132 HydrophobicContact CE1-CD1 3.35Å; Y128-L132 HydrophobicContact CE1-CG 4.1Å; Y128-L132 PolarHBondContact O-N 3.47Å; Y128-L132 VanDerWaalsContact O-N 3.16Å; S129-L132 PolarHBondContact O-N 2.96Å; D130-L132 VanDerWaalsContact C-N 3.35Å; D130-L132 PolarHBondContact O-N 2.95Å; L132-Q159 HydrophobicContact CD2-CB 3.71Å |
| 133 | K | 83.9 | Confident | 77.1 | Confident | 171 Ų | 171 | 68.4 Ų | 68.4 | 74% | 0.743 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -74.3 | -38 | 177.5 | -75.3 | 174.8 | -179.7 | 171.9 | 0 | 112.3 | S129 D130 Y131 | S129-K133 WeakPolarHBondContact O-CG 3.49Å; S129-K133 PolarHBondContact O-N 3.48Å; S129-K133 VanDerWaalsContact O-N 3.11Å; D130-K133 PolarHBondContact O-N 3.36Å; Y131-K133 VanDerWaalsContact C-N 3.34Å |
| 134 | D | 78.1 | Confident | 76.7 | Confident | 71 Ų | 71 | 70 Ų | 70 | 38% | 0.38 | 38% | 0.375 | S | S | . | . | trans | -140.3 | 91 | -179.9 | -167.9 | -13.4 | 0 | 0 | 0 | 111.2 | D130 Y131 G136 R137 | D130-D134 PolarHBondContact O-N 3.3Å; Y131-D134 CarbonylContact O-C 3.37Å; D134-G136 PolarHBondContact O-N 3.42Å; D134-G136 PolarHBondContact OD1-N 2.97Å; D134-G136 VanDerWaalsContact OD1-N 3.13Å; D134-R137 HydrophobicContact CB-CB 4.23Å; D134-R137 PolarHBondContact O-N 3.33Å; D134-R137 WeakPolarHBondContact OD2-CB 3.26Å; D134-R137 WeakPolarHBondContact OD2-CD 3.36Å | ||
| 135 | R | 69.1 | Low | 76.5 | Confident | 160 Ų | 160 | 71.8 Ų | 71.8 | 60% | 0.604 | 38% | 0.383 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.7 | -13.3 | 179.8 | -74.2 | -166.8 | 175.3 | 179.6 | -0.9 | 113.8 | Y131 | Y131-R135 PolarHBondContact O-N 2.9Š|
| 136 | G | 58.9 | Low | 76.3 | Confident | 70 Ų | 70 | 67.8 Ų | 67.8 | 72% | 0.722 | 36% | 0.364 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91.7 | -18.6 | -179.3 | 0 | 0 | 0 | 0 | 0 | 115.2 | D134 | D134-G136 PolarHBondContact O-N 3.42Å; D134-G136 PolarHBondContact OD1-N 2.97Å; D134-G136 VanDerWaalsContact OD1-N 3.13Å |
| 137 | R | 56 | Low | 76.2 | Confident | 154 Ų | 154 | 64.7 Ų | 64.7 | 58% | 0.581 | 36% | 0.357 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -108.5 | -8.9 | -161.3 | -134.1 | 174.7 | 75.5 | 101.9 | -0.7 | 116.6 | D134 | D134-R137 HydrophobicContact CB-CB 4.23Å; D134-R137 PolarHBondContact O-N 3.33Å; D134-R137 WeakPolarHBondContact OD2-CB 3.26Å; D134-R137 WeakPolarHBondContact OD2-CD 3.36Å |
| 138 | G | 56 | Low | 76.1 | Confident | 17 Ų | 17 | 67.1 Ų | 67.1 | 18% | 0.175 | 38% | 0.377 | C | S | . | . | trans | -151.9 | 34 | -162.2 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 139 | N | 64 | Low | 76.1 | Confident | 94 Ų | 94 | 68 Ų | 68 | 50% | 0.503 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -70.5 | -35.7 | 177.7 | 62.5 | -2.1 | 0 | 0 | 0 | 113 | Y131 T141 L142 I143 | Y131-N139 HydrophobicContact CE2-CB 4.31Å; N139-T141 PolarHBondContact O-N 3.49Å; N139-L142 PolarHBondContact O-N 2.89Å; N139-I143 HydrophobicContact CB-CD1 3.91Å; N139-I143 VanDerWaalsContact O-CB 3.32Å; N139-I143 WeakPolarHBondContact O-CB 3.33Å; N139-I143 WeakPolarHBondContact O-CD1 3.48Å; N139-I143 WeakPolarHBondContact O-CG1 3.46Å; N139-I143 PolarHBondContact O-N 3.27Å |
| 140 | G | 69.3 | Low | 76.1 | Confident | 37 Ų | 37 | 70.5 Ų | 70.5 | 38% | 0.381 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -62.3 | -46 | -171.1 | 0 | 0 | 0 | 0 | 0 | 114.9 | T144 | G140-T144 WeakPolarHBondContact O-CB 3.42Å; G140-T144 PolarHBondContact O-N 2.91Å; G140-T144 PolarHBondContact O-OG1 3.37Å |
| 141 | T | 74.5 | Confident | 76.3 | Confident | 85 Ų | 85 | 67 Ų | 67 | 52% | 0.521 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -64.9 | -47.1 | 179.8 | -50.5 | 0 | 0 | 0 | 0 | 111.1 | A127 N139 T144 F145 | A127-T141 HydrophobicContact CB-CG2 4.32Å; N139-T141 PolarHBondContact O-N 3.49Å; T141-T144 WeakPolarHBondContact O-CB 3.48Å; T141-T144 PolarHBondContact O-N 3.28Å; T141-F145 HydrophobicContact CG2-CD2 4.03Å; T141-F145 HydrophobicContact CG2-CE2 3.91Å; T141-F145 VanDerWaalsContact O-CD2 3.31Å; T141-F145 WeakPolarHBondContact O-CD2 3.32Å; T141-F145 PolarHBondContact O-N 2.91Å |
| 142 | L | 79.1 | Confident | 76.6 | Confident | 0 Ų | 0 | 66.5 Ų | 66.5 | 0% | 0 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -67.4 | -40.2 | -178.7 | -165.8 | 66.2 | 0 | 0 | 0 | 112.1 | Y124 Y128 Y131 N139 T144 F145 H146 V160 T163 | Y124-L142 HydrophobicContact CD2-CD1 4.29Å; Y124-L142 HydrophobicContact CE2-CD1 3.67Å; Y128-L142 HydrophobicContact CD2-CD1 4.49Å; Y131-L142 HydrophobicContact CD1-CD2 3.83Å; Y131-L142 HydrophobicContact CD2-CD2 4.33Å; Y131-L142 HydrophobicContact CE1-CD2 4.49Å; Y131-L142 HydrophobicContact CG-CD2 3.74Å; N139-L142 PolarHBondContact O-N 2.89Å; L142-T144 VanDerWaalsContact C-N 3.29Å; L142-T144 PolarHBondContact O-N 3.48Å; L142-F145 PolarHBondContact O-N 2.84Å; L142-H146 VanDerWaalsContact O-CG 3.3Å; L142-H146 PolarHBondContact O-N 2.91Å; L142-V160 HydrophobicContact CD2-CB 4.39Å; L142-V160 HydrophobicContact CD2-CG1 3.98Å; L142-T163 HydrophobicContact CD2-CG2 4.4Å |
| 143 | I | 79.6 | Confident | 76.8 | Confident | 68 Ų | 68 | 63.7 Ų | 63.7 | 35% | 0.349 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -59.3 | -41.9 | 171.8 | -69.8 | 165.6 | 0 | 0 | 0 | 110.7 | N139 H146 S147 T163 | N139-I143 HydrophobicContact CB-CD1 3.91Å; N139-I143 VanDerWaalsContact O-CB 3.32Å; N139-I143 WeakPolarHBondContact O-CB 3.33Å; N139-I143 WeakPolarHBondContact O-CD1 3.48Å; N139-I143 WeakPolarHBondContact O-CG1 3.46Å; N139-I143 PolarHBondContact O-N 3.27Å; I143-H146 PolarHBondContact O-N 3.38Å; I143-S147 VanDerWaalsContact O-CB 3.25Å; I143-S147 WeakPolarHBondContact O-CB 3.16Å; I143-S147 PolarHBondContact O-N 2.88Å; I143-T163 HydrophobicContact CD1-CG2 4.43Å; I143-T163 HydrophobicContact CG1-CG2 3.92Å |
| 144 | T | 78.9 | Confident | 76.8 | Confident | 92 Ų | 92 | 58.1 Ų | 58.1 | 56% | 0.564 | 33% | 0.329 | S | S | * | . | H | α-helix | trans | -63.8 | -43.3 | 178.1 | -57.2 | 0 | 0 | 0 | 0 | 111 | G140 T141 L142 S147 A148 | G140-T144 WeakPolarHBondContact O-CB 3.42Å; G140-T144 PolarHBondContact O-N 2.91Å; G140-T144 PolarHBondContact O-OG1 3.37Å; T141-T144 WeakPolarHBondContact O-CB 3.48Å; T141-T144 PolarHBondContact O-N 3.28Å; L142-T144 VanDerWaalsContact C-N 3.29Å; L142-T144 PolarHBondContact O-N 3.48Å; T144-S147 PolarHBondContact O-N 2.98Å; T144-A148 WeakPolarHBondContact O-CB 3.4Å; T144-A148 PolarHBondContact O-N 3.44Å |
| 145 | F | 82.7 | Confident | 76.7 | Confident | 38 Ų | 38 | 63.9 Ų | 63.9 | 17% | 0.167 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -60.7 | -50.8 | 173.9 | -88.7 | -82.3 | 0 | 0 | 0 | 111.7 | V120 Y124 T141 L142 S147 A148 F149 | V120-F145 HydrophobicContact CG1-CE1 4.25Å; Y124-F145 HydrophobicContact CD2-CB 3.86Å; Y124-F145 AromaticContact CD2-CD1 3.92Å; Y124-F145 HydrophobicContact CD2-CD1 3.92Å; Y124-F145 AromaticContact CD2-CG 3.87Å; Y124-F145 HydrophobicContact CD2-CG 3.87Å; Y124-F145 HydrophobicContact CE2-CB 4.07Å; T141-F145 HydrophobicContact CG2-CD2 4.03Å; T141-F145 HydrophobicContact CG2-CE2 3.91Å; T141-F145 VanDerWaalsContact O-CD2 3.31Å; T141-F145 WeakPolarHBondContact O-CD2 3.32Å; T141-F145 PolarHBondContact O-N 2.91Å; L142-F145 PolarHBondContact O-N 2.84Å; F145-S147 VanDerWaalsContact C-N 3.31Å; F145-S147 PolarHBondContact O-N 3.29Å; F145-A148 PolarHBondContact O-N 3.24Å; F145-F149 AromaticContact CD1-CD2 3.84Å; F145-F149 HydrophobicContact CD1-CD2 3.84Å; F145-F149 AromaticContact CD1-CE2 3.62Å; F145-F149 HydrophobicContact CD1-CE2 3.62Å; F145-F149 AromaticContact CE1-CE2 3.92Å; F145-F149 HydrophobicContact CE1-CE2 3.92Å; F145-F149 WeakPolarHBondContact O-CD2 3.39Å; F145-F149 PolarHBondContact O-N 3.32Å |
| 146 | H | 85.3 | Confident | 76.8 | Confident | 0 Ų | 0 | 58.6 Ų | 58.6 | 0% | 0 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -60.6 | -40.1 | -179.6 | -68.9 | 163.9 | 0 | 0 | 0 | 112.6 | Y124 L142 I143 Q150 C151 G153 T163 P165 C174 | Y124-H146 AromaticContact CE2-CD2 3.97Å; Y124-H146 AromaticContact CE2-NE2 3.83Å; Y124-H146 AromaticContact CZ-NE2 3.83Å; Y124-H146 PolarHBondContact OH-NE2 3.28Å; L142-H146 VanDerWaalsContact O-CG 3.3Å; L142-H146 PolarHBondContact O-N 2.91Å; I143-H146 PolarHBondContact O-N 3.38Å; H146-Q150 VanDerWaalsContact O-CA 3.22Å; H146-Q150 WeakPolarHBondContact O-CA 3.44Å; H146-Q150 PolarHBondContact O-N 3.4Å; H146-C151 VanDerWaalsContact CA-O 3.27Å; H146-C151 WeakPolarHBondContact CA-O 3.47Å; H146-C151 VanDerWaalsContact CB-O 3.26Å; H146-C151 WeakPolarHBondContact CB-O 3.28Å; H146-C151 PolarHBondContact CD2-O 2.88Å; H146-C151 PolarHBondContact O-N 3.05Å; H146-G153 PolarHBondContact NE2-N 3.38Å; H146-T163 PolarHBondContact CE1-OG1 3.32Å; H146-T163 PolarHBondContact ND1-O 2.78Å; H146-T163 PolarHBondContact ND1-OG1 3.36Å; H146-T163 VanDerWaalsContact ND1-OG1 3.13Å; H146-P165 HydrophobicContact CB-CG 4.47Å; H146-C174 VanDerWaalsContact CD2-SG 3.55Å |
| 147 | S | 81.9 | Confident | 77.5 | Confident | 65 Ų | 65 | 56 Ų | 56 | 46% | 0.455 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -74.7 | -41.5 | 177.9 | -169.6 | 0 | 0 | 0 | 0 | 112.7 | I143 T144 F145 Q150 | I143-S147 VanDerWaalsContact O-CB 3.25Å; I143-S147 WeakPolarHBondContact O-CB 3.16Å; I143-S147 PolarHBondContact O-N 2.88Å; T144-S147 PolarHBondContact O-N 2.98Å; F145-S147 VanDerWaalsContact C-N 3.31Å; F145-S147 PolarHBondContact O-N 3.29Å; S147-Q150 PolarHBondContact O-NE2 2.7Å |
| 148 | A | 82.9 | Confident | 78.4 | Confident | 72 Ų | 72 | 55.8 Ų | 55.8 | 60% | 0.595 | 32% | 0.317 | S | S | * | . | H | α-helix | trans | -68.5 | -40.1 | -178.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | T144 F145 | T144-A148 WeakPolarHBondContact O-CB 3.4Å; T144-A148 PolarHBondContact O-N 3.44Å; F145-A148 PolarHBondContact O-N 3.24Å |
| 149 | F | 84.8 | Confident | 79.3 | Confident | 40 Ų | 40 | 59.4 Ų | 59.4 | 18% | 0.175 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -97 | -3.8 | -179.1 | -66.9 | -80.2 | 0 | 0 | 0 | 113.6 | V120 F145 C151 T177 I178 I181 | V120-F149 HydrophobicContact CG1-CZ 4.45Å; F145-F149 AromaticContact CD1-CD2 3.84Å; F145-F149 HydrophobicContact CD1-CD2 3.84Å; F145-F149 AromaticContact CD1-CE2 3.62Å; F145-F149 HydrophobicContact CD1-CE2 3.62Å; F145-F149 AromaticContact CE1-CE2 3.92Å; F145-F149 HydrophobicContact CE1-CE2 3.92Å; F145-F149 WeakPolarHBondContact O-CD2 3.39Å; F145-F149 PolarHBondContact O-N 3.32Å; F149-C151 VanDerWaalsContact C-N 3.33Å; F149-C151 PolarHBondContact O-N 2.96Å; F149-T177 WeakPolarHBondContact O-CG2 3.42Å; F149-I178 HydrophobicContact CD1-CG1 4.1Å; F149-I178 HydrophobicContact CD2-CG1 4.35Å; F149-I178 HydrophobicContact CE1-CG1 4.26Å; F149-I178 HydrophobicContact CE2-CG1 4.5Å; F149-I178 HydrophobicContact CG-CG1 4.15Å; F149-I178 HydrophobicContact CZ-CG1 4.46Å; F149-I181 HydrophobicContact CB-CD1 4.29Å; F149-I181 HydrophobicContact CD1-CB 4.23Å; F149-I181 HydrophobicContact CD1-CD1 3.94Å; F149-I181 HydrophobicContact CD1-CG2 3.99Å; F149-I181 HydrophobicContact CE1-CG2 4.04Å; F149-I181 WeakPolarHBondContact O-CD1 3.46Å |
| 150 | Q | 85.9 | Confident | 80.1 | Confident | 100 Ų | 100 | 54.9 Ų | 54.9 | 47% | 0.467 | 31% | 0.305 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 51.3 | 52.9 | -178 | -62.5 | -72.1 | -54.4 | 0 | 0 | 111.4 | H146 S147 L168 | H146-Q150 VanDerWaalsContact O-CA 3.22Å; H146-Q150 WeakPolarHBondContact O-CA 3.44Å; H146-Q150 PolarHBondContact O-N 3.4Å; S147-Q150 PolarHBondContact O-NE2 2.7Å; Q150-L168 HydrophobicContact CB-CD1 4.39Å; Q150-L168 WeakPolarHBondContact O-CD1 2.78Å |
| 151 | C | 87.8 | Confident | 80.4 | Confident | 0 Ų | 0 | 58.6 Ų | 58.6 | 0% | 0 | 31% | 0.313 | C | S | . | . | trans | -141.2 | 165.7 | -177.4 | 68 | 0 | 0 | 0 | 0 | 110 | H146 F149 C174 T177 | H146-C151 VanDerWaalsContact CA-O 3.27Å; H146-C151 WeakPolarHBondContact CA-O 3.47Å; H146-C151 VanDerWaalsContact CB-O 3.26Å; H146-C151 WeakPolarHBondContact CB-O 3.28Å; H146-C151 PolarHBondContact CD2-O 2.88Å; H146-C151 PolarHBondContact O-N 3.05Å; F149-C151 VanDerWaalsContact C-N 3.33Å; F149-C151 PolarHBondContact O-N 2.96Å; C151-C174 HydrophobicContact CB-CB 3.92Å; C151-C174 WeakPolarHBondContact CB-SG 3.48Å; C151-C174 WeakPolarHBondContact SG-CA 3.36Å; C151-C174 WeakPolarHBondContact SG-CB 3.19Å; C151-C174 CovalentContact SG-SG 2.04Å; C151-C174 PolarHBondContact SG-SG 3.01Å; C151-T177 HydrophobicContact CB-CG2 4.12Å | ||
| 152 | C | 88.6 | Confident | 80.6 | Confident | 4 Ų | 4 | 59.4 Ų | 59.4 | 3% | 0.027 | 32% | 0.32 | C | S | . | . | trans | -146.2 | 113.2 | -178 | 174.5 | 0 | 0 | 0 | 0 | 111.6 | S157 C164 L168 K172 C174 | C152-S157 WeakPolarHBondContact SG-CB 3.29Å; C152-C164 HydrophobicContact CB-CB 3.77Å; C152-C164 WeakPolarHBondContact CB-SG 3.43Å; C152-C164 WeakPolarHBondContact SG-CB 3.49Å; C152-C164 CovalentContact SG-SG 2.02Å; C152-C164 PolarHBondContact SG-SG 2.83Å; C152-L168 HydrophobicContact CB-CD2 3.93Å; C152-K172 PolarHBondContact N-O 3Å; C152-K172 VanDerWaalsContact N-O 3.08Å; C152-C174 PolarHBondContact N-SG 3.42Å; C152-C174 VanDerWaalsContact N-SG 3.44Å | ||
| 153 | G | 85.8 | Confident | 80.6 | Confident | 0 Ų | 0 | 59.7 Ų | 59.7 | 0% | 0 | 32% | 0.321 | C | S | . | . | trans | 70.6 | -169.1 | 176.9 | 0 | 0 | 0 | 0 | 0 | 114.8 | Y124 H146 C174 | Y124-G153 WeakPolarHBondContact OH-CA 3.38Å; Y124-G153 PolarHBondContact OH-N 2.81Å; Y124-G153 PolarHBondContact OH-O 3.35Å; H146-G153 PolarHBondContact NE2-N 3.38Å; G153-C174 WeakPolarHBondContact O-CB 3.43Å; G153-C174 PolarHBondContact O-N 2.95Å | ||
| 154 | K | 83.4 | Confident | 80.7 | Confident | 54 Ų | 54 | 57.7 Ų | 57.7 | 24% | 0.235 | 31% | 0.313 | C | S | . | . | S | Bend | trans | -95.6 | -106.7 | 174.1 | -59.2 | -173.3 | -175.7 | -169.2 | 0 | 109 | Y124 E125 Y128 N173 I175 | Y124-K154 HydrophobicContact CE1-CG 4.13Å; E125-K154 VanDerWaalsContact CG-NZ 3.32Å; E125-K154 IonicContact OE1-NZ 2.71Å; E125-K154 PolarHBondContact OE1-NZ 3.48Å; Y128-K154 HydrophobicContact CD1-CD 4.49Å; K154-N173 VanDerWaalsContact C-ND2 3.32Å; K154-N173 WeakPolarHBondContact O-CB 3.38Å; K154-N173 PolarHBondContact O-ND2 3.43Å; K154-N173 VanDerWaalsContact O-ND2 3.08Å; K154-I175 HydrophobicContact CG-CG1 4.32Å |
| 155 | E | 75.8 | Confident | 80.8 | Confident | 191 Ų | 191 | 54.8 Ų | 54.8 | 89% | 0.893 | 30% | 0.296 | S | S | * | . | S | Bend | trans | -83.8 | -28.9 | 176.4 | -62 | -160.7 | 147.6 | 0 | 0 | 113.8 | ||
| 156 | S | 71.4 | Confident | 80.2 | Confident | 49 Ų | 49 | 63 Ų | 63 | 34% | 0.343 | 33% | 0.331 | S | S | . | . | trans | -130 | 137.9 | 174.1 | 172.1 | 0 | 0 | 0 | 0 | 110.7 | E158 | S156-E158 PolarHBondContact OG-N 3.16Š| ||
| 157 | S | 74 | Confident | 79.4 | Confident | 16 Ų | 16 | 71.3 Ų | 71.3 | 11% | 0.112 | 37% | 0.37 | C | S | . | . | trans | -93.8 | -11.1 | 179.2 | 50.9 | 0 | 0 | 0 | 0 | 113.7 | C152 Q159 V160 Q161 H171 | C152-S157 WeakPolarHBondContact SG-CB 3.29Å; S157-Q159 VanDerWaalsContact C-N 3.26Å; S157-Q159 PolarHBondContact O-N 3.36Å; S157-Q159 VanDerWaalsContact O-N 3.16Å; S157-V160 CarbonylContact O-C 3.47Å; S157-V160 PolarHBondContact O-N 3.38Å; S157-Q161 WeakPolarHBondContact O-CG 3.18Å; S157-Q161 PolarHBondContact O-N 2.95Å; S157-H171 WeakPolarHBondContact CB-CD2 3.4Å; S157-H171 PolarHBondContact OG-CD2 2.98Å; S157-H171 PolarHBondContact OG-NE2 2.97Å | ||
| 158 | E | 73.9 | Confident | 78.8 | Confident | 150 Ų | 150 | 69.8 Ų | 69.8 | 70% | 0.701 | 36% | 0.357 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.9 | -38.2 | -169.7 | -66.7 | -175.7 | 138.3 | 0 | 0 | 112.9 | S156 V160 | S156-E158 PolarHBondContact OG-N 3.16Å; E158-V160 VanDerWaalsContact C-N 3.27Å; E158-V160 PolarHBondContact O-N 3.24Å |
| 159 | Q | 75.4 | Confident | 77.6 | Confident | 92 Ų | 92 | 72.6 Ų | 72.6 | 43% | 0.43 | 37% | 0.369 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -75.8 | -16.2 | -177.7 | -58.8 | -178.4 | 70.7 | 0 | 0 | 113.4 | L132 S157 | L132-Q159 HydrophobicContact CD2-CB 3.71Å; S157-Q159 VanDerWaalsContact C-N 3.26Å; S157-Q159 PolarHBondContact O-N 3.36Å; S157-Q159 VanDerWaalsContact O-N 3.16Å |
| 160 | V | 80.3 | Confident | 76.5 | Confident | 0 Ų | 0 | 76.1 Ų | 76.1 | 0% | 0 | 39% | 0.389 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -126.5 | 5.5 | -173.3 | -63.4 | 0 | 0 | 0 | 0 | 113.9 | Y128 Y131 L142 S157 E158 P162 T163 C164 | Y128-V160 HydrophobicContact CD2-CG1 3.91Å; Y128-V160 HydrophobicContact CE2-CB 4.29Å; Y128-V160 HydrophobicContact CE2-CG1 3.39Å; Y128-V160 HydrophobicContact CE2-CG2 3.95Å; Y131-V160 HydrophobicContact CD1-CG1 3.89Å; Y131-V160 HydrophobicContact CE1-CG1 3.96Å; L142-V160 HydrophobicContact CD2-CB 4.39Å; L142-V160 HydrophobicContact CD2-CG1 3.98Å; S157-V160 CarbonylContact O-C 3.47Å; S157-V160 PolarHBondContact O-N 3.38Å; E158-V160 VanDerWaalsContact C-N 3.27Å; E158-V160 PolarHBondContact O-N 3.24Å; V160-P162 VanDerWaalsContact C-N 3.31Å; V160-P162 VanDerWaalsContact O-N 3.11Å; V160-T163 PolarHBondContact O-N 2.93Å; V160-T163 PolarHBondContact O-OG1 3.5Å; V160-C164 PolarHBondContact O-SG 3.49Å |
| 161 | Q | 77.1 | Confident | 75.6 | Confident | 115 Ų | 115 | 76.6 Ų | 76.6 | 54% | 0.537 | 39% | 0.391 | S | S | . | . | G | 310 helix | trans | -41.4 | -45 | 175.7 | -84.2 | -163.6 | 5.4 | 0 | 0 | 115.7 | S157 T163 C164 | S157-Q161 WeakPolarHBondContact O-CG 3.18Å; S157-Q161 PolarHBondContact O-N 2.95Å; Q161-T163 PolarHBondContact O-N 3.13Å; Q161-T163 VanDerWaalsContact O-N 3.07Å; Q161-C164 PolarHBondContact O-N 2.91Å |
| 162 | P | 79 | Confident | 75.4 | Confident | 102 Ų | 102 | 82.1 Ų | 82.1 | 66% | 0.662 | 42% | 0.415 | S | S | * | . | G | 310 helix | trans | -63.5 | -15.9 | -179.8 | 24.2 | -35.8 | 0 | 0 | 0 | 114.2 | V160 | V160-P162 VanDerWaalsContact C-N 3.31Å; V160-P162 VanDerWaalsContact O-N 3.11Å |
| 163 | T | 78.4 | Confident | 75.3 | Confident | 5 Ų | 5 | 83.7 Ų | 83.7 | 3% | 0.031 | 42% | 0.424 | C | S | . | . | G | 310 helix | trans | -98 | -1.6 | 177.3 | 65.7 | 0 | 0 | 0 | 0 | 113.5 | Y131 L142 I143 H146 V160 Q161 | Y131-T163 HydrophobicContact CD2-CG2 4.46Å; Y131-T163 HydrophobicContact CE1-CG2 4.37Å; Y131-T163 HydrophobicContact CE2-CG2 3.76Å; L142-T163 HydrophobicContact CD2-CG2 4.4Å; I143-T163 HydrophobicContact CD1-CG2 4.43Å; I143-T163 HydrophobicContact CG1-CG2 3.92Å; H146-T163 PolarHBondContact CE1-OG1 3.32Å; H146-T163 PolarHBondContact ND1-O 2.78Å; H146-T163 PolarHBondContact ND1-OG1 3.36Å; H146-T163 VanDerWaalsContact ND1-OG1 3.13Å; V160-T163 PolarHBondContact O-N 2.93Å; V160-T163 PolarHBondContact O-OG1 3.5Å; Q161-T163 PolarHBondContact O-N 3.13Å; Q161-T163 VanDerWaalsContact O-N 3.07Å |
| 164 | C | 82.3 | Confident | 75.4 | Confident | 26 Ų | 26 | 83.7 Ų | 83.7 | 18% | 0.176 | 42% | 0.424 | C | S | . | . | S | Bend | trans | -91 | 152.5 | -174.1 | -64.6 | 0 | 0 | 0 | 0 | 112.6 | C152 V160 Q161 | C152-C164 HydrophobicContact CB-CB 3.77Å; C152-C164 WeakPolarHBondContact CB-SG 3.43Å; C152-C164 WeakPolarHBondContact SG-CB 3.49Å; C152-C164 CovalentContact SG-SG 2.02Å; C152-C164 PolarHBondContact SG-SG 2.83Å; V160-C164 PolarHBondContact O-SG 3.49Å; Q161-C164 PolarHBondContact O-N 2.91Å |
| 165 | P | 79.9 | Confident | 75.7 | Confident | 31 Ų | 31 | 82.6 Ų | 82.6 | 20% | 0.201 | 42% | 0.42 | C | S | . | . | trans | -67.4 | 137.8 | 177.7 | -13.4 | 29.9 | 0 | 0 | 0 | 109.9 | H146 E167 | H146-P165 HydrophobicContact CB-CG 4.47Å; P165-E167 PolarHBondContact O-N 3.29Å | ||
| 166 | K | 71.4 | Confident | 76.4 | Confident | 212 Ų | 212 | 77.8 Ų | 77.8 | 92% | 0.922 | 40% | 0.401 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.7 | -18.4 | -175.6 | -63.3 | -176.8 | -179.6 | 179.1 | 0 | 114.3 | ||
| 167 | E | 67.7 | Low | 77.2 | Confident | 173 Ų | 173 | 76.4 Ų | 76.4 | 81% | 0.808 | 39% | 0.39 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -105.3 | 27 | -172.8 | -64.8 | -85.8 | 140.2 | 0 | 0 | 112.2 | P165 P169 | P165-E167 PolarHBondContact O-N 3.29Å; E167-P169 VanDerWaalsContact O-CD 3.23Å; E167-P169 WeakPolarHBondContact O-CD 3.34Å |
| 168 | L | 69.6 | Low | 77.9 | Confident | 33 Ų | 33 | 75.6 Ų | 75.6 | 17% | 0.173 | 39% | 0.385 | C | S | . | . | trans | -87 | 111.5 | -175.6 | -148.9 | 76.3 | 0 | 0 | 0 | 111.2 | Q150 C152 D170 | Q150-L168 HydrophobicContact CB-CD1 4.39Å; Q150-L168 WeakPolarHBondContact O-CD1 2.78Å; C152-L168 HydrophobicContact CB-CD2 3.93Å; L168-D170 VanDerWaalsContact C-N 3.31Å; L168-D170 WeakPolarHBondContact CD2-O 3.48Å; L168-D170 PolarHBondContact O-N 3.4Å | ||
| 169 | P | 57.9 | Low | 78.7 | Confident | 131 Ų | 131 | 73.2 Ų | 73.2 | 85% | 0.851 | 37% | 0.373 | S | S | * | . | S | Bend | trans | -78.7 | -14.2 | -171.2 | -12 | 29.3 | 0 | 0 | 0 | 114 | E167 | E167-P169 VanDerWaalsContact O-CD 3.23Å; E167-P169 WeakPolarHBondContact O-CD 3.34Å |
| 170 | D | 61.5 | Low | 79.4 | Confident | 114 Ų | 114 | 72.8 Ų | 72.8 | 61% | 0.61 | 38% | 0.377 | S | S | * | . | S | Bend | trans | -153.2 | 132.8 | 179.8 | -165.8 | 25.9 | 0 | 0 | 0 | 107.7 | L168 K172 | L168-D170 VanDerWaalsContact C-N 3.31Å; L168-D170 WeakPolarHBondContact CD2-O 3.48Å; L168-D170 PolarHBondContact O-N 3.4Å; D170-K172 PolarHBondContact O-N 3.05Å |
| 171 | H | 67.2 | Low | 79.7 | Confident | 110 Ų | 110 | 75.3 Ų | 75.3 | 51% | 0.509 | 39% | 0.39 | S | S | . | . | trans | -73.1 | 79.2 | -174.7 | -86.5 | 76.9 | 0 | 0 | 0 | 110.4 | S157 | S157-H171 WeakPolarHBondContact CB-CD2 3.4Å; S157-H171 PolarHBondContact OG-CD2 2.98Å; S157-H171 PolarHBondContact OG-NE2 2.97Å | ||
| 172 | K | 82.6 | Confident | 80.2 | Confident | 116 Ų | 116 | 71.2 Ų | 71.2 | 50% | 0.504 | 37% | 0.372 | S | S | . | . | trans | -73.1 | 128.8 | 179.3 | -73.6 | -175 | 177.6 | -178.6 | 0 | 111.6 | C152 D170 C174 | C152-K172 PolarHBondContact N-O 3Å; C152-K172 VanDerWaalsContact N-O 3.08Å; D170-K172 PolarHBondContact O-N 3.05Å; K172-C174 PolarHBondContact O-N 3.36Å | ||
| 173 | N | 86.8 | Confident | 80.6 | Confident | 37 Ų | 37 | 68.9 Ų | 68.9 | 20% | 0.198 | 36% | 0.357 | C | S | . | . | trans | -62.6 | 126.3 | 171.6 | -174.1 | -38.2 | 0 | 0 | 0 | 109.8 | K154 I175 T177 | K154-N173 VanDerWaalsContact C-ND2 3.32Å; K154-N173 WeakPolarHBondContact O-CB 3.38Å; K154-N173 PolarHBondContact O-ND2 3.43Å; K154-N173 VanDerWaalsContact O-ND2 3.08Å; N173-I175 VanDerWaalsContact C-N 3.32Å; N173-I175 PolarHBondContact O-N 3.31Å; N173-I175 VanDerWaalsContact OD1-CB 3.28Å; N173-I175 WeakPolarHBondContact OD1-CB 3.3Å; N173-I175 PolarHBondContact OD1-N 2.9Å; N173-T177 VanDerWaalsContact O-CB 3.28Å; N173-T177 WeakPolarHBondContact O-CB 3.44Å; N173-T177 PolarHBondContact O-N 3.4Å; N173-T177 VanDerWaalsContact O-N 3.08Å; N173-T177 PolarHBondContact O-OG1 3.32Å | ||
| 174 | C | 88.4 | Confident | 81 | Confident | 0 Ų | 0 | 72 Ų | 72 | 0% | 0 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -66.2 | -31.5 | -179.9 | -77.5 | 0 | 0 | 0 | 0 | 113.3 | Y124 H146 C151 C152 G153 K172 T177 I178 | Y124-C174 HydrophobicContact CD1-CB 4.23Å; Y124-C174 HydrophobicContact CE1-CB 3.61Å; Y124-C174 HydrophobicContact CE2-CB 3.94Å; Y124-C174 VanDerWaalsContact CZ-CB 3.45Å; Y124-C174 PolarHBondContact OH-SG 3.33Å; H146-C174 VanDerWaalsContact CD2-SG 3.55Å; C151-C174 HydrophobicContact CB-CB 3.92Å; C151-C174 WeakPolarHBondContact CB-SG 3.48Å; C151-C174 WeakPolarHBondContact SG-CA 3.36Å; C151-C174 WeakPolarHBondContact SG-CB 3.19Å; C151-C174 CovalentContact SG-SG 2.04Å; C151-C174 PolarHBondContact SG-SG 3.01Å; C152-C174 PolarHBondContact N-SG 3.42Å; C152-C174 VanDerWaalsContact N-SG 3.44Å; G153-C174 WeakPolarHBondContact O-CB 3.43Å; G153-C174 PolarHBondContact O-N 2.95Å; K172-C174 PolarHBondContact O-N 3.36Å; C174-T177 PolarHBondContact O-N 2.92Å; C174-I178 HydrophobicContact CB-CD1 4.48Å; C174-I178 VanDerWaalsContact O-CB 3.24Å; C174-I178 WeakPolarHBondContact O-CB 3.42Å; C174-I178 VanDerWaalsContact O-CD1 3.28Å; C174-I178 WeakPolarHBondContact O-CD1 3.43Å; C174-I178 WeakPolarHBondContact O-CG1 3.3Å; C174-I178 PolarHBondContact O-N 3.33Å |
| 175 | I | 89.6 | Confident | 81.3 | Confident | 31 Ų | 31 | 76.3 Ų | 76.3 | 16% | 0.159 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -63.7 | -48.3 | -179.1 | -56.6 | -60.3 | 0 | 0 | 0 | 110.7 | Q121 Y124 E125 K154 N173 E179 | Q121-I175 HydrophobicContact CG-CG2 4.22Å; Q121-I175 PolarHBondContact NE2-O 3.11Å; Y124-I175 HydrophobicContact CD1-CD1 3.69Å; Y124-I175 HydrophobicContact CE1-CD1 4.2Å; E125-I175 HydrophobicContact CG-CD1 4.07Å; K154-I175 HydrophobicContact CG-CG1 4.32Å; N173-I175 VanDerWaalsContact C-N 3.32Å; N173-I175 PolarHBondContact O-N 3.31Å; N173-I175 VanDerWaalsContact OD1-CB 3.28Å; N173-I175 WeakPolarHBondContact OD1-CB 3.3Å; N173-I175 PolarHBondContact OD1-N 2.9Å; I175-E179 PolarHBondContact O-N 3.49Å |
| 176 | D | 89.4 | Confident | 81.6 | Confident | 91 Ų | 91 | 77.4 Ų | 77.4 | 49% | 0.487 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -71 | -37.7 | 178.6 | -59.3 | -31.4 | 0 | 0 | 0 | 111.6 | E179 T180 | D176-E179 PolarHBondContact O-N 2.88Å; D176-T180 WeakPolarHBondContact O-CB 3.25Å; D176-T180 PolarHBondContact O-N 2.96Å; D176-T180 PolarHBondContact O-OG1 2.93Å |
| 177 | T | 88.9 | Confident | 82.4 | Confident | 19 Ų | 19 | 73.9 Ų | 73.9 | 12% | 0.117 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -67.2 | -39.3 | 179.1 | -58.5 | 0 | 0 | 0 | 0 | 111.3 | F149 C151 N173 C174 T180 I181 | F149-T177 WeakPolarHBondContact O-CG2 3.42Å; C151-T177 HydrophobicContact CB-CG2 4.12Å; N173-T177 VanDerWaalsContact O-CB 3.28Å; N173-T177 WeakPolarHBondContact O-CB 3.44Å; N173-T177 PolarHBondContact O-N 3.4Å; N173-T177 VanDerWaalsContact O-N 3.08Å; N173-T177 PolarHBondContact O-OG1 3.32Å; C174-T177 PolarHBondContact O-N 2.92Å; T177-T180 PolarHBondContact O-N 3.25Å; T177-I181 HydrophobicContact CG2-CD1 3.63Å; T177-I181 HydrophobicContact CG2-CG1 4.1Å; T177-I181 VanDerWaalsContact O-CB 3.27Å; T177-I181 WeakPolarHBondContact O-CB 3.41Å; T177-I181 WeakPolarHBondContact O-CG1 3.48Å; T177-I181 PolarHBondContact O-N 2.99Å |
| 178 | I | 89.6 | Confident | 83.5 | Confident | 0 Ų | 0 | 70.1 Ų | 70.1 | 0% | 0 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -60.3 | -47.1 | 174.5 | -75.1 | 163.9 | 0 | 0 | 0 | 110.1 | V120 Q121 Y124 F149 C174 T180 I181 I182 | V120-I178 HydrophobicContact CB-CG2 4.19Å; V120-I178 HydrophobicContact CG1-CD1 4.44Å; V120-I178 HydrophobicContact CG1-CG2 3.74Å; Q121-I178 HydrophobicContact CG-CB 4.5Å; Q121-I178 HydrophobicContact CG-CG2 4.01Å; Y124-I178 HydrophobicContact CG-CD1 4.09Å; F149-I178 HydrophobicContact CD1-CG1 4.1Å; F149-I178 HydrophobicContact CD2-CG1 4.35Å; F149-I178 HydrophobicContact CE1-CG1 4.26Å; F149-I178 HydrophobicContact CE2-CG1 4.5Å; F149-I178 HydrophobicContact CG-CG1 4.15Å; F149-I178 HydrophobicContact CZ-CG1 4.46Å; C174-I178 HydrophobicContact CB-CD1 4.48Å; C174-I178 VanDerWaalsContact O-CB 3.24Å; C174-I178 WeakPolarHBondContact O-CB 3.42Å; C174-I178 VanDerWaalsContact O-CD1 3.28Å; C174-I178 WeakPolarHBondContact O-CD1 3.43Å; C174-I178 WeakPolarHBondContact O-CG1 3.3Å; C174-I178 PolarHBondContact O-N 3.33Å; I178-T180 PolarHBondContact O-N 3.49Å; I178-I181 PolarHBondContact O-N 2.88Å; I178-I182 HydrophobicContact CG2-CD1 3.53Å; I178-I182 HydrophobicContact CG2-CG1 4.35Å; I178-I182 VanDerWaalsContact O-CB 3.29Å; I178-I182 WeakPolarHBondContact O-CB 3.2Å; I178-I182 WeakPolarHBondContact O-CG1 3.47Å; I178-I182 PolarHBondContact O-N 3.2Å |
| 179 | E | 90 | Very high | 84.4 | Confident | 99 Ų | 99 | 73.9 Ų | 73.9 | 46% | 0.463 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -60.8 | -46.1 | 177.5 | -179.7 | 171.5 | 177.1 | 0 | 0 | 112 | I117 I175 D176 S183 | I117-E179 HydrophobicContact CD1-CG 4.46Å; I117-E179 HydrophobicContact CG2-CB 4.05Å; I117-E179 HydrophobicContact CG2-CG 4.19Å; I175-E179 PolarHBondContact O-N 3.49Å; D176-E179 PolarHBondContact O-N 2.88Å; E179-S183 WeakPolarHBondContact O-CB 3.44Å; E179-S183 PolarHBondContact O-N 3.41Å; E179-S183 PolarHBondContact O-OG 3.39Å |
| 180 | T | 89.2 | Confident | 86 | Confident | 84 Ų | 84 | 69.3 Ų | 69.3 | 52% | 0.515 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -66.2 | -44.4 | 179.6 | -54.3 | 0 | 0 | 0 | 0 | 111.7 | D176 T177 I178 S183 V184 | D176-T180 WeakPolarHBondContact O-CB 3.25Å; D176-T180 PolarHBondContact O-N 2.96Å; D176-T180 PolarHBondContact O-OG1 2.93Å; T177-T180 PolarHBondContact O-N 3.25Å; I178-T180 PolarHBondContact O-N 3.49Å; T180-S183 WeakPolarHBondContact CA-OG 3.5Å; T180-S183 PolarHBondContact O-OG 3.3Å; T180-V184 WeakPolarHBondContact O-CB 3.31Å; T180-V184 VanDerWaalsContact O-CG2 3.26Å; T180-V184 WeakPolarHBondContact O-CG2 3.34Å; T180-V184 PolarHBondContact O-N 3.46Å |
| 181 | I | 87.4 | Confident | 87.5 | Confident | 53 Ų | 53 | 69.5 Ų | 69.5 | 27% | 0.272 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -67.2 | -46.5 | 179.5 | -74.6 | -178.9 | 0 | 0 | 0 | 110.3 | F149 T177 I178 S183 V184 K185 | F149-I181 HydrophobicContact CB-CD1 4.29Å; F149-I181 HydrophobicContact CD1-CB 4.23Å; F149-I181 HydrophobicContact CD1-CD1 3.94Å; F149-I181 HydrophobicContact CD1-CG2 3.99Å; F149-I181 HydrophobicContact CE1-CG2 4.04Å; F149-I181 WeakPolarHBondContact O-CD1 3.46Å; T177-I181 HydrophobicContact CG2-CD1 3.63Å; T177-I181 HydrophobicContact CG2-CG1 4.1Å; T177-I181 VanDerWaalsContact O-CB 3.27Å; T177-I181 WeakPolarHBondContact O-CB 3.41Å; T177-I181 WeakPolarHBondContact O-CG1 3.48Å; T177-I181 PolarHBondContact O-N 2.99Å; I178-I181 PolarHBondContact O-N 2.88Å; I181-S183 PolarHBondContact O-N 3Å; I181-V184 PolarHBondContact O-N 3.43Å; I181-K185 HydrophobicContact CG2-CG 3.91Å; I181-K185 WeakPolarHBondContact O-CB 3.27Å; I181-K185 WeakPolarHBondContact O-CG 3.48Å; I181-K185 PolarHBondContact O-N 2.77Å |
| 182 | I | 86.6 | Confident | 88.8 | Confident | 29 Ų | 29 | 68.6 Ų | 68.6 | 15% | 0.149 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -63 | -44.5 | -179.5 | -69.1 | 172.9 | 0 | 0 | 0 | 110.3 | I117 V120 I178 K185 L186 | I117-I182 HydrophobicContact CD1-CG2 4.23Å; I117-I182 HydrophobicContact CG1-CB 3.98Å; I117-I182 HydrophobicContact CG1-CD1 4.23Å; I117-I182 HydrophobicContact CG1-CG2 3.55Å; V120-I182 HydrophobicContact CB-CD1 4.01Å; V120-I182 HydrophobicContact CG1-CD1 4.18Å; V120-I182 HydrophobicContact CG2-CD1 4.05Å; I178-I182 HydrophobicContact CG2-CD1 3.53Å; I178-I182 HydrophobicContact CG2-CG1 4.35Å; I178-I182 VanDerWaalsContact O-CB 3.29Å; I178-I182 WeakPolarHBondContact O-CB 3.2Å; I178-I182 WeakPolarHBondContact O-CG1 3.47Å; I178-I182 PolarHBondContact O-N 3.2Å; I182-K185 PolarHBondContact O-N 2.94Å; I182-L186 HydrophobicContact CG2-CD1 3.68Å; I182-L186 HydrophobicContact CG2-CG 4.14Å; I182-L186 VanDerWaalsContact O-CB 3.24Å; I182-L186 WeakPolarHBondContact O-CB 3.43Å; I182-L186 WeakPolarHBondContact O-CG 3.3Å; I182-L186 PolarHBondContact O-N 2.84Å |
| 183 | S | 87.5 | Confident | 89.4 | Confident | 52 Ų | 52 | 64.7 Ų | 64.7 | 36% | 0.364 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -62.6 | -45.4 | 178.6 | 55.8 | 0 | 0 | 0 | 0 | 112.8 | E179 T180 I181 Q187 | E179-S183 WeakPolarHBondContact O-CB 3.44Å; E179-S183 PolarHBondContact O-N 3.41Å; E179-S183 PolarHBondContact O-OG 3.39Å; T180-S183 WeakPolarHBondContact CA-OG 3.5Å; T180-S183 PolarHBondContact O-OG 3.3Å; I181-S183 PolarHBondContact O-N 3Å; S183-Q187 PolarHBondContact O-N 3.43Å |
| 184 | V | 87.4 | Confident | 89.8 | Confident | 71 Ų | 71 | 69.1 Ų | 69.1 | 43% | 0.43 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -67.4 | -42.3 | 177.6 | 172.1 | 0 | 0 | 0 | 0 | 111.8 | T180 I181 Q187 L188 | T180-V184 WeakPolarHBondContact O-CB 3.31Å; T180-V184 VanDerWaalsContact O-CG2 3.26Å; T180-V184 WeakPolarHBondContact O-CG2 3.34Å; T180-V184 PolarHBondContact O-N 3.46Å; I181-V184 PolarHBondContact O-N 3.43Å; V184-Q187 WeakPolarHBondContact O-CB 3.26Å; V184-Q187 PolarHBondContact O-N 3.22Å; V184-L188 PolarHBondContact O-N 3.44Å |
| 185 | K | 87.9 | Confident | 90.1 | Very high | 117 Ų | 117 | 71 Ų | 71 | 51% | 0.509 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -68.8 | -36.5 | 179.1 | -67.1 | -68 | -176.7 | -173.3 | 0 | 111.6 | I181 I182 Q187 L188 I189 | I181-K185 HydrophobicContact CG2-CG 3.91Å; I181-K185 WeakPolarHBondContact O-CB 3.27Å; I181-K185 WeakPolarHBondContact O-CG 3.48Å; I181-K185 PolarHBondContact O-N 2.77Å; I182-K185 PolarHBondContact O-N 2.94Å; K185-Q187 VanDerWaalsContact C-N 3.29Å; K185-Q187 PolarHBondContact O-N 2.93Å; K185-L188 HydrophobicContact CD-CD1 4.41Å; K185-L188 PolarHBondContact O-N 2.9Å; K185-I189 VanDerWaalsContact O-CG1 3.27Å; K185-I189 WeakPolarHBondContact O-CG1 3.46Å; K185-I189 PolarHBondContact O-N 3.29Å |
| 186 | L | 87.2 | Confident | 90.3 | Very high | 53 Ų | 53 | 73.3 Ų | 73.3 | 28% | 0.277 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -60.6 | -38 | 173.5 | -80.6 | 171.7 | 0 | 0 | 0 | 112 | K113 I182 I189 G190 | K113-L186 HydrophobicContact CB-CD1 3.87Å; I182-L186 HydrophobicContact CG2-CD1 3.68Å; I182-L186 HydrophobicContact CG2-CG 4.14Å; I182-L186 VanDerWaalsContact O-CB 3.24Å; I182-L186 WeakPolarHBondContact O-CB 3.43Å; I182-L186 WeakPolarHBondContact O-CG 3.3Å; I182-L186 PolarHBondContact O-N 2.84Å; L186-I189 PolarHBondContact O-N 3.48Å; L186-G190 PolarHBondContact O-N 3.25Å |
| 187 | Q | 88.4 | Confident | 90.6 | Very high | 138 Ų | 138 | 70 Ų | 70 | 65% | 0.645 | 40% | 0.397 | S | S | * | . | H | α-helix | trans | -62 | -45.6 | 174 | -72.5 | -178.1 | -32.3 | 0 | 0 | 112 | S183 V184 K185 G190 I191 | S183-Q187 PolarHBondContact O-N 3.43Å; V184-Q187 WeakPolarHBondContact O-CB 3.26Å; V184-Q187 PolarHBondContact O-N 3.22Å; K185-Q187 VanDerWaalsContact C-N 3.29Å; K185-Q187 PolarHBondContact O-N 2.93Å; Q187-G190 PolarHBondContact O-N 2.93Å; Q187-I191 WeakPolarHBondContact O-CG1 3.44Å; Q187-I191 PolarHBondContact O-N 3.23Å |
| 188 | L | 90.4 | Very high | 91 | Very high | 95 Ų | 95 | 70.3 Ų | 70.3 | 50% | 0.497 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -61.8 | -44 | 176.3 | -69.7 | 174.8 | 0 | 0 | 0 | 111.9 | V184 K185 G190 I191 V192 | V184-L188 PolarHBondContact O-N 3.44Å; K185-L188 HydrophobicContact CD-CD1 4.41Å; K185-L188 PolarHBondContact O-N 2.9Å; L188-G190 VanDerWaalsContact C-N 3.26Å; L188-G190 PolarHBondContact O-N 2.83Å; L188-I191 PolarHBondContact O-N 3Å; L188-V192 WeakPolarHBondContact O-CG2 3.49Å; L188-V192 PolarHBondContact O-N 3.27Å |
| 189 | I | 89.4 | Confident | 91.1 | Very high | 112 Ų | 112 | 74.3 Ų | 74.3 | 57% | 0.574 | 43% | 0.425 | S | S | * | . | H | α-helix | trans | -60.3 | -40 | 175.1 | -66.2 | 163.1 | 0 | 0 | 0 | 110.2 | K185 L186 V192 G193 | K185-I189 VanDerWaalsContact O-CG1 3.27Å; K185-I189 WeakPolarHBondContact O-CG1 3.46Å; K185-I189 PolarHBondContact O-N 3.29Å; L186-I189 PolarHBondContact O-N 3.48Å; I189-V192 PolarHBondContact O-N 2.95Å; I189-G193 PolarHBondContact O-N 3.03Å |
| 190 | G | 91.8 | Very high | 91.3 | Very high | 35 Ų | 35 | 70.2 Ų | 70.2 | 36% | 0.361 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -60.4 | -46.5 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113 | L186 Q187 L188 G193 I194 | L186-G190 PolarHBondContact O-N 3.25Å; Q187-G190 PolarHBondContact O-N 2.93Å; L188-G190 VanDerWaalsContact C-N 3.26Å; L188-G190 PolarHBondContact O-N 2.83Å; G190-G193 PolarHBondContact O-N 2.88Å; G190-I194 WeakPolarHBondContact O-CG1 3.36Å; G190-I194 PolarHBondContact O-N 2.92Å |
| 191 | I | 92.3 | Very high | 91.6 | Very high | 118 Ų | 118 | 69.6 Ų | 69.6 | 61% | 0.605 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -61.1 | -47.1 | 177.2 | -65.8 | 167 | 0 | 0 | 0 | 110.7 | Q187 L188 G193 I194 G195 | Q187-I191 WeakPolarHBondContact O-CG1 3.44Å; Q187-I191 PolarHBondContact O-N 3.23Å; L188-I191 PolarHBondContact O-N 3Å; I191-G193 VanDerWaalsContact C-N 3.32Å; I191-G193 PolarHBondContact O-N 3.34Å; I191-I194 PolarHBondContact O-N 2.83Å; I191-G195 PolarHBondContact O-N 3.36Å; I191-G195 VanDerWaalsContact O-N 3.09Å |
| 192 | V | 94.1 | Very high | 91.9 | Very high | 90 Ų | 90 | 72.9 Ų | 72.9 | 55% | 0.545 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -61 | -44 | 177 | 174.1 | 0 | 0 | 0 | 0 | 110.4 | L188 I189 I194 G195 I196 | L188-V192 WeakPolarHBondContact O-CG2 3.49Å; L188-V192 PolarHBondContact O-N 3.27Å; I189-V192 PolarHBondContact O-N 2.95Å; V192-I194 PolarHBondContact O-N 3.48Å; V192-G195 PolarHBondContact O-N 2.78Å; V192-G195 VanDerWaalsContact O-N 3.13Å; V192-I196 HydrophobicContact CG1-CD1 3.85Å; V192-I196 HydrophobicContact CG1-CG1 4.36Å; V192-I196 WeakPolarHBondContact O-CG1 3.34Å; V192-I196 PolarHBondContact O-N 3.2Å |
| 193 | G | 94.4 | Very high | 92.1 | Very high | 34 Ų | 34 | 72 Ų | 72 | 35% | 0.351 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -59.8 | -42.7 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | I189 G190 I191 G195 I196 A197 | I189-G193 PolarHBondContact O-N 3.03Å; G190-G193 PolarHBondContact O-N 2.88Å; I191-G193 VanDerWaalsContact C-N 3.32Å; I191-G193 PolarHBondContact O-N 3.34Å; G193-G195 VanDerWaalsContact C-N 3.32Å; G193-G195 PolarHBondContact O-N 3.31Å; G193-I196 PolarHBondContact O-N 2.94Å; G193-A197 WeakPolarHBondContact O-CB 3.44Å; G193-A197 PolarHBondContact O-N 3.33Å |
| 194 | I | 95.1 | Very high | 92.5 | Very high | 130 Ų | 130 | 70.6 Ų | 70.6 | 67% | 0.667 | 40% | 0.398 | S | S | * | . | H | α-helix | trans | -63.1 | -40.6 | 174.7 | -66.9 | 165 | 0 | 0 | 0 | 110.9 | G190 I191 V192 A197 G198 | G190-I194 WeakPolarHBondContact O-CG1 3.36Å; G190-I194 PolarHBondContact O-N 2.92Å; I191-I194 PolarHBondContact O-N 2.83Å; V192-I194 PolarHBondContact O-N 3.48Å; I194-A197 PolarHBondContact O-N 2.94Å; I194-G198 PolarHBondContact O-N 2.86Å |
| 195 | G | 95.9 | Very high | 92.7 | Very high | 40 Ų | 40 | 71.2 Ų | 71.2 | 41% | 0.412 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -61.6 | -44 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | I191 V192 G193 G198 L199 | I191-G195 PolarHBondContact O-N 3.36Å; I191-G195 VanDerWaalsContact O-N 3.09Å; V192-G195 PolarHBondContact O-N 2.78Å; V192-G195 VanDerWaalsContact O-N 3.13Å; G193-G195 VanDerWaalsContact C-N 3.32Å; G193-G195 PolarHBondContact O-N 3.31Å; G195-G198 PolarHBondContact O-N 2.75Å; G195-L199 PolarHBondContact O-N 3.06Å |
| 196 | I | 94.3 | Very high | 92.8 | Very high | 80 Ų | 80 | 69.1 Ų | 69.1 | 41% | 0.41 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -64.1 | -45.9 | 176.5 | -61.3 | 166.9 | 0 | 0 | 0 | 110.2 | E102 V192 G193 G198 L199 T200 | E102-I196 WeakPolarHBondContact OE1-CG2 3.24Å; V192-I196 HydrophobicContact CG1-CD1 3.85Å; V192-I196 HydrophobicContact CG1-CG1 4.36Å; V192-I196 WeakPolarHBondContact O-CG1 3.34Å; V192-I196 PolarHBondContact O-N 3.2Å; G193-I196 PolarHBondContact O-N 2.94Å; I196-G198 PolarHBondContact O-N 2.96Å; I196-L199 WeakPolarHBondContact O-CA 3.48Å; I196-L199 WeakPolarHBondContact O-CB 3.46Å; I196-L199 PolarHBondContact O-N 3.4Å; I196-T200 HydrophobicContact CG2-CG2 4.47Å; I196-T200 PolarHBondContact O-N 2.96Å; I196-T200 PolarHBondContact O-OG1 3.35Å |
| 197 | A | 96 | Very high | 92.9 | Very high | 21 Ų | 21 | 66.6 Ų | 66.6 | 17% | 0.174 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -58.9 | -36.1 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | F99 E102 G193 I194 T200 I201 | F99-A197 HydrophobicContact CE2-CB 4.27Å; E102-A197 WeakPolarHBondContact OE2-CA 3.34Å; G193-A197 WeakPolarHBondContact O-CB 3.44Å; G193-A197 PolarHBondContact O-N 3.33Å; I194-A197 PolarHBondContact O-N 2.94Å; A197-T200 WeakPolarHBondContact CA-OG1 3.46Å; A197-T200 PolarHBondContact O-OG1 3.02Å; A197-I201 WeakPolarHBondContact O-CD1 3.28Å; A197-I201 VanDerWaalsContact O-CG1 3.26Å; A197-I201 WeakPolarHBondContact O-CG1 3.23Å; A197-I201 PolarHBondContact O-N 2.89Å; A197-I201 VanDerWaalsContact O-N 3.11Å |
| 198 | G | 96.1 | Very high | 93 | Very high | 26 Ų | 26 | 65.5 Ų | 65.5 | 27% | 0.268 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -61.6 | -48.1 | 171.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | I194 G195 I196 T200 I201 F202 | I194-G198 PolarHBondContact O-N 2.86Å; G195-G198 PolarHBondContact O-N 2.75Å; I196-G198 PolarHBondContact O-N 2.96Å; G198-T200 VanDerWaalsContact C-N 3.34Å; G198-T200 PolarHBondContact O-N 3.36Å; G198-I201 PolarHBondContact O-N 2.89Å; G198-F202 WeakPolarHBondContact O-CD2 3.45Å; G198-F202 PolarHBondContact O-N 3.24Å |
| 199 | L | 92.9 | Very high | 93 | Very high | 84 Ų | 84 | 64.1 Ų | 64.1 | 44% | 0.44 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -62 | -39.1 | 178 | -71.4 | 171.7 | 0 | 0 | 0 | 112.5 | F18 G195 I196 F202 G203 | F18-L199 HydrophobicContact CE2-CD2 4.37Å; F18-L199 HydrophobicContact CZ-CD2 4.23Å; G195-L199 PolarHBondContact O-N 3.06Å; I196-L199 WeakPolarHBondContact O-CA 3.48Å; I196-L199 WeakPolarHBondContact O-CB 3.46Å; I196-L199 PolarHBondContact O-N 3.4Å; L199-F202 PolarHBondContact O-N 3.4Å; L199-G203 PolarHBondContact O-N 3.36Å |
| 200 | T | 94.3 | Very high | 92.8 | Very high | 13 Ų | 13 | 59.1 Ų | 59.1 | 8% | 0.08 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -65 | -42.1 | 176.7 | 56.7 | 0 | 0 | 0 | 0 | 111.3 | I98 E102 I196 A197 G198 G203 M204 | I98-T200 HydrophobicContact CG2-CG2 4.21Å; E102-T200 WeakPolarHBondContact OE1-CG2 3.05Å; E102-T200 PolarHBondContact OE2-OG1 3.47Å; E102-T200 VanDerWaalsContact OE2-OG1 3.11Å; I196-T200 HydrophobicContact CG2-CG2 4.47Å; I196-T200 PolarHBondContact O-N 2.96Å; I196-T200 PolarHBondContact O-OG1 3.35Å; A197-T200 WeakPolarHBondContact CA-OG1 3.46Å; A197-T200 PolarHBondContact O-OG1 3.02Å; G198-T200 VanDerWaalsContact C-N 3.34Å; G198-T200 PolarHBondContact O-N 3.36Å; T200-G203 PolarHBondContact O-N 3.4Å; T200-M204 WeakPolarHBondContact O-CG 3.39Å; T200-M204 PolarHBondContact O-N 2.95Å |
| 201 | I | 95.4 | Very high | 92.6 | Very high | 71 Ų | 71 | 59 Ų | 59 | 36% | 0.364 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -60.7 | -46.7 | 173.4 | -68 | 166.6 | 0 | 0 | 0 | 111.5 | F99 A197 G198 G203 M204 I205 | F99-I201 HydrophobicContact CD2-CG1 4.24Å; F99-I201 HydrophobicContact CE2-CD1 3.78Å; F99-I201 HydrophobicContact CE2-CG1 3.87Å; F99-I201 HydrophobicContact CZ-CD1 4.15Å; F99-I201 HydrophobicContact CZ-CG1 4.39Å; A197-I201 WeakPolarHBondContact O-CD1 3.28Å; A197-I201 VanDerWaalsContact O-CG1 3.26Å; A197-I201 WeakPolarHBondContact O-CG1 3.23Å; A197-I201 PolarHBondContact O-N 2.89Å; A197-I201 VanDerWaalsContact O-N 3.11Å; G198-I201 PolarHBondContact O-N 2.89Å; I201-G203 VanDerWaalsContact C-N 3.29Å; I201-G203 PolarHBondContact O-N 3.34Å; I201-M204 HydrophobicContact CB-CE 4.36Å; I201-M204 HydrophobicContact CG1-CE 3.89Å; I201-M204 WeakPolarHBondContact O-CB 3.46Å; I201-M204 PolarHBondContact O-N 3.34Å; I201-M204 VanDerWaalsContact O-N 3.16Å; I201-I205 HydrophobicContact CG2-CD1 3.85Å; I201-I205 HydrophobicContact CG2-CG1 4.42Å; I201-I205 WeakPolarHBondContact O-CG1 3.29Å; I201-I205 PolarHBondContact O-N 3.42Å |
| 202 | F | 92.7 | Very high | 92.3 | Very high | 122 Ų | 122 | 56 Ų | 56 | 54% | 0.535 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -59.2 | -41.7 | 175.8 | -83.9 | -69.3 | 0 | 0 | 0 | 112 | G198 L199 M204 I205 F206 | G198-F202 WeakPolarHBondContact O-CD2 3.45Å; G198-F202 PolarHBondContact O-N 3.24Å; L199-F202 PolarHBondContact O-N 3.4Å; F202-M204 PolarHBondContact O-N 2.98Å; F202-I205 PolarHBondContact O-N 2.89Å; F202-F206 HydrophobicContact CB-CE2 4.4Å; F202-F206 HydrophobicContact CD1-CE2 4.39Å; F202-F206 WeakPolarHBondContact O-CD2 3.35Å; F202-F206 WeakPolarHBondContact O-CG 3.41Å; F202-F206 PolarHBondContact O-N 2.93Å |
| 203 | G | 91.6 | Very high | 91.8 | Very high | 10 Ų | 10 | 52.9 Ų | 52.9 | 10% | 0.103 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -59.1 | -43.7 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | L95 L199 T200 I201 S207 | L95-G203 VanDerWaalsContact CD1-C 3.48Å; L199-G203 PolarHBondContact O-N 3.36Å; T200-G203 PolarHBondContact O-N 3.4Å; I201-G203 VanDerWaalsContact C-N 3.29Å; I201-G203 PolarHBondContact O-N 3.34Å; G203-S207 VanDerWaalsContact O-CB 3.25Å; G203-S207 WeakPolarHBondContact O-CB 3.37Å; G203-S207 PolarHBondContact O-N 3.45Å |
| 204 | M | 94.3 | Very high | 91.2 | Very high | 22 Ų | 22 | 52 Ų | 52 | 11% | 0.108 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -62.8 | -45.5 | 176.4 | -73.4 | -171.6 | -72.4 | 0 | 0 | 111.9 | F92 L95 L96 F99 T200 I201 F202 S207 M208 | F92-M204 HydrophobicContact CD2-CB 4.1Å; F92-M204 HydrophobicContact CD2-CG 4.2Å; F92-M204 HydrophobicContact CE2-CB 3.86Å; F92-M204 HydrophobicContact CE2-CG 4.12Å; F92-M204 HydrophobicContact CE2-SD 4.46Å; L95-M204 HydrophobicContact CB-CG 3.64Å; L95-M204 HydrophobicContact CB-SD 4.37Å; L95-M204 HydrophobicContact CD1-CG 3.98Å; L96-M204 HydrophobicContact CB-SD 4.47Å; L96-M204 HydrophobicContact CG-SD 4.21Å; F99-M204 HydrophobicContact CB-CE 4.13Å; F99-M204 HydrophobicContact CD1-CE 4.44Å; F99-M204 HydrophobicContact CD2-CE 4.38Å; F99-M204 HydrophobicContact CG-CE 4.06Å; T200-M204 WeakPolarHBondContact O-CG 3.39Å; T200-M204 PolarHBondContact O-N 2.95Å; I201-M204 HydrophobicContact CB-CE 4.36Å; I201-M204 HydrophobicContact CG1-CE 3.89Å; I201-M204 WeakPolarHBondContact O-CB 3.46Å; I201-M204 PolarHBondContact O-N 3.34Å; I201-M204 VanDerWaalsContact O-N 3.16Å; F202-M204 PolarHBondContact O-N 2.98Å; M204-S207 PolarHBondContact O-N 3.27Å; M204-M208 WeakPolarHBondContact O-CB 3.33Å; M204-M208 PolarHBondContact O-N 3.35Å |
| 205 | I | 93.3 | Very high | 90.7 | Very high | 84 Ų | 84 | 52.7 Ų | 52.7 | 43% | 0.431 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -60.7 | -50.9 | 178.2 | -66.7 | 166.6 | 0 | 0 | 0 | 110.3 | I201 F202 S207 M208 V209 | I201-I205 HydrophobicContact CG2-CD1 3.85Å; I201-I205 HydrophobicContact CG2-CG1 4.42Å; I201-I205 WeakPolarHBondContact O-CG1 3.29Å; I201-I205 PolarHBondContact O-N 3.42Å; F202-I205 PolarHBondContact O-N 2.89Å; I205-S207 VanDerWaalsContact C-N 3.33Å; I205-S207 PolarHBondContact O-N 2.93Å; I205-M208 PolarHBondContact O-N 3.38Å; I205-V209 HydrophobicContact CG2-CG2 4.35Å; I205-V209 VanDerWaalsContact O-CG2 3.31Å; I205-V209 WeakPolarHBondContact O-CG2 3.18Å; I205-V209 PolarHBondContact O-N 2.96Å |
| 206 | F | 89.9 | Confident | 90.1 | Very high | 73 Ų | 73 | 55.9 Ų | 55.9 | 32% | 0.32 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -65.3 | -37.3 | -179.1 | -69.8 | -45.9 | 0 | 0 | 0 | 112.5 | I11 L15 F202 L210 | I11-F206 HydrophobicContact CG1-CE1 4.5Å; I11-F206 HydrophobicContact CG2-CB 4.33Å; I11-F206 HydrophobicContact CG2-CD1 3.83Å; I11-F206 HydrophobicContact CG2-CG 4.3Å; L15-F206 HydrophobicContact CD1-CB 3.8Å; L15-F206 HydrophobicContact CD2-CB 3.85Å; L15-F206 HydrophobicContact CG-CB 3.9Å; F202-F206 HydrophobicContact CB-CE2 4.4Å; F202-F206 HydrophobicContact CD1-CE2 4.39Å; F202-F206 WeakPolarHBondContact O-CD2 3.35Å; F202-F206 WeakPolarHBondContact O-CG 3.41Å; F202-F206 PolarHBondContact O-N 2.93Å; F206-L210 VanDerWaalsContact O-CB 3.28Å; F206-L210 WeakPolarHBondContact O-CB 3.42Å; F206-L210 PolarHBondContact O-N 2.93Å |
| 207 | S | 89.6 | Confident | 89.3 | Confident | 1 Ų | 1 | 55.3 Ų | 55.3 | 1% | 0.007 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -59.3 | -48.1 | 173.2 | 178.3 | 0 | 0 | 0 | 0 | 111.5 | L88 G203 M204 I205 L210 C211 | L88-S207 WeakPolarHBondContact CD1-OG 3.38Å; L88-S207 WeakPolarHBondContact CD2-O 3.33Å; L88-S207 PolarHBondContact O-OG 2.98Å; G203-S207 VanDerWaalsContact O-CB 3.25Å; G203-S207 WeakPolarHBondContact O-CB 3.37Å; G203-S207 PolarHBondContact O-N 3.45Å; M204-S207 PolarHBondContact O-N 3.27Å; I205-S207 VanDerWaalsContact C-N 3.33Å; I205-S207 PolarHBondContact O-N 2.93Å; S207-L210 PolarHBondContact O-N 3.4Å; S207-C211 VanDerWaalsContact O-CB 3.3Å; S207-C211 WeakPolarHBondContact O-CB 3.47Å; S207-C211 PolarHBondContact O-N 2.87Å |
| 208 | M | 90 | Very high | 88.3 | Confident | 115 Ų | 115 | 60.9 Ų | 60.9 | 57% | 0.567 | 32% | 0.317 | S | S | * | . | H | α-helix | trans | -64.8 | -45.9 | 179.7 | -170.6 | 177.8 | -174.6 | 0 | 0 | 112 | M204 I205 L210 C211 C212 | M204-M208 WeakPolarHBondContact O-CB 3.33Å; M204-M208 PolarHBondContact O-N 3.35Å; I205-M208 PolarHBondContact O-N 3.38Å; M208-L210 VanDerWaalsContact C-N 3.33Å; M208-L210 PolarHBondContact O-N 2.99Å; M208-C211 PolarHBondContact O-N 3.41Å; M208-C212 WeakPolarHBondContact O-CB 3.34Å; M208-C212 PolarHBondContact O-N 3.17Å; M208-C212 PolarHBondContact O-SG 2.9Å; M208-C212 VanDerWaalsContact O-SG 3.33Å |
| 209 | V | 89.5 | Confident | 87.1 | Confident | 66 Ų | 66 | 65.3 Ų | 65.3 | 40% | 0.4 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -58.6 | -45.7 | 177.1 | 170 | 0 | 0 | 0 | 0 | 110.8 | I11 I205 C212 A213 | I11-V209 HydrophobicContact CD1-CG1 4.46Å; I205-V209 HydrophobicContact CG2-CG2 4.35Å; I205-V209 VanDerWaalsContact O-CG2 3.31Å; I205-V209 WeakPolarHBondContact O-CG2 3.18Å; I205-V209 PolarHBondContact O-N 2.96Å; V209-C212 PolarHBondContact O-N 3.02Å; V209-A213 WeakPolarHBondContact O-CB 3.44Å; V209-A213 PolarHBondContact O-N 3.28Å |
| 210 | L | 85.9 | Confident | 85.7 | Confident | 6 Ų | 6 | 66.4 Ų | 66.4 | 3% | 0.031 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -67 | -38.6 | 178.7 | -173 | 65.7 | 0 | 0 | 0 | 111.3 | L8 L15 L88 F206 S207 M208 A213 I214 | L8-L210 HydrophobicContact CD1-CD1 4.28Å; L8-L210 HydrophobicContact CG-CD1 4.38Å; L15-L210 HydrophobicContact CD1-CB 4.42Å; L15-L210 HydrophobicContact CD1-CD2 3.86Å; L88-L210 HydrophobicContact CD1-CD2 4.46Å; L88-L210 HydrophobicContact CD2-CB 3.95Å; L88-L210 HydrophobicContact CD2-CD2 4.14Å; L88-L210 HydrophobicContact CD2-CG 3.98Å; F206-L210 VanDerWaalsContact O-CB 3.28Å; F206-L210 WeakPolarHBondContact O-CB 3.42Å; F206-L210 PolarHBondContact O-N 2.93Å; S207-L210 PolarHBondContact O-N 3.4Å; M208-L210 VanDerWaalsContact C-N 3.33Å; M208-L210 PolarHBondContact O-N 2.99Å; L210-A213 PolarHBondContact O-N 3.46Å; L210-I214 HydrophobicContact CD1-CD1 4.42Å; L210-I214 HydrophobicContact CG-CD1 3.98Å; L210-I214 WeakPolarHBondContact O-CB 3.48Å; L210-I214 WeakPolarHBondContact O-CD1 3.05Å; L210-I214 VanDerWaalsContact O-CG1 3.23Å; L210-I214 WeakPolarHBondContact O-CG1 3.46Å; L210-I214 PolarHBondContact O-N 2.99Å |
| 211 | C | 86.3 | Confident | 83.7 | Confident | 32 Ų | 32 | 75.5 Ų | 75.5 | 22% | 0.216 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -64.2 | -45.7 | 177.4 | -167.6 | 0 | 0 | 0 | 0 | 111.8 | L88 S207 M208 I214 R215 | L88-C211 VanDerWaalsContact CD2-CA 3.5Å; L88-C211 HydrophobicContact CD2-CB 3.59Å; L88-C211 VanDerWaalsContact CD2-N 3.29Å; L88-C211 HydrophobicContact CG-CB 4.18Å; S207-C211 VanDerWaalsContact O-CB 3.3Å; S207-C211 WeakPolarHBondContact O-CB 3.47Å; S207-C211 PolarHBondContact O-N 2.87Å; M208-C211 PolarHBondContact O-N 3.41Å; C211-I214 PolarHBondContact O-N 3.44Å; C211-R215 PolarHBondContact O-N 3.43Å |
| 212 | C | 86.3 | Confident | 83.1 | Confident | 56 Ų | 56 | 75.7 Ų | 75.7 | 38% | 0.378 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -62.9 | -41.9 | 175.5 | -69.7 | 0 | 0 | 0 | 0 | 111.8 | M208 V209 R215 N216 | M208-C212 WeakPolarHBondContact O-CB 3.34Å; M208-C212 PolarHBondContact O-N 3.17Å; M208-C212 PolarHBondContact O-SG 2.9Å; M208-C212 VanDerWaalsContact O-SG 3.33Å; V209-C212 PolarHBondContact O-N 3.02Å; C212-R215 PolarHBondContact O-N 2.66Å; C212-N216 WeakPolarHBondContact O-CB 3.07Å; C212-N216 PolarHBondContact O-N 3.47Å |
| 213 | A | 84.4 | Confident | 82.6 | Confident | 24 Ų | 24 | 73.3 Ų | 73.3 | 20% | 0.198 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -65.8 | -39.3 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | L8 V209 L210 S217 | L8-A213 HydrophobicContact CD1-CB 3.45Å; L8-A213 VanDerWaalsContact CD1-CB 3.45Å; L8-A213 HydrophobicContact CD2-CB 3.6Å; L8-A213 HydrophobicContact CG-CB 4.17Å; V209-A213 WeakPolarHBondContact O-CB 3.44Å; V209-A213 PolarHBondContact O-N 3.28Å; L210-A213 PolarHBondContact O-N 3.46Å; A213-S217 WeakPolarHBondContact O-CB 3.28Å; A213-S217 PolarHBondContact O-N 3.11Å; A213-S217 PolarHBondContact O-OG 3.19Å |
| 214 | I | 82.5 | Confident | 82.1 | Confident | 17 Ų | 17 | 76.8 Ų | 76.8 | 9% | 0.087 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -64.5 | -44.7 | 173.5 | -69.7 | 164.2 | 0 | 0 | 0 | 110.3 | E83 Q85 L88 L210 C211 S217 R218 | E83-I214 HydrophobicContact CB-CD1 4.04Å; E83-I214 HydrophobicContact CB-CG1 4.35Å; E83-I214 HydrophobicContact CG-CD1 4.47Å; E83-I214 WeakPolarHBondContact O-CG2 3.18Å; Q85-I214 HydrophobicContact CG-CG2 3.99Å; L88-I214 HydrophobicContact CD2-CD1 4.17Å; L210-I214 HydrophobicContact CD1-CD1 4.42Å; L210-I214 HydrophobicContact CG-CD1 3.98Å; L210-I214 WeakPolarHBondContact O-CB 3.48Å; L210-I214 WeakPolarHBondContact O-CD1 3.05Å; L210-I214 VanDerWaalsContact O-CG1 3.23Å; L210-I214 WeakPolarHBondContact O-CG1 3.46Å; L210-I214 PolarHBondContact O-N 2.99Å; C211-I214 PolarHBondContact O-N 3.44Å; I214-S217 PolarHBondContact O-N 2.87Å; I214-R218 PolarHBondContact O-N 3.12Å; I214-R218 VanDerWaalsContact O-N 3.11Å |
| 215 | R | 83.7 | Confident | 81.4 | Confident | 144 Ų | 144 | 80 Ų | 80 | 54% | 0.543 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -56.7 | -53.9 | 177.6 | -168.7 | 168.9 | 70.4 | -175 | 2.4 | 111.4 | C211 C212 S217 R218 D219 | C211-R215 PolarHBondContact O-N 3.43Å; C212-R215 PolarHBondContact O-N 2.66Å; R215-S217 PolarHBondContact O-N 3Å; R215-R218 WeakPolarHBondContact O-CA 3.37Å; R215-R218 WeakPolarHBondContact O-CB 3.5Å; R215-R218 PolarHBondContact O-N 3.24Å; R215-D219 PolarHBondContact O-N 3.24Å |
| 216 | N | 83.6 | Confident | 80.7 | Confident | 106 Ų | 106 | 79.8 Ų | 79.8 | 57% | 0.567 | 42% | 0.415 | S | S | * | . | H | α-helix | trans | -61.4 | -29.8 | 180 | -173.2 | 86.6 | 0 | 0 | 0 | 112.6 | C212 R218 V220 | C212-N216 WeakPolarHBondContact O-CB 3.07Å; C212-N216 PolarHBondContact O-N 3.47Å; N216-R218 VanDerWaalsContact C-N 3.34Å; N216-V220 WeakPolarHBondContact O-CG2 3.42Å |
| 217 | S | 78 | Confident | 80 | Confident | 69 Ų | 69 | 80.2 Ų | 80.2 | 48% | 0.483 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -72.7 | -28.5 | 175.5 | -57.5 | 0 | 0 | 0 | 0 | 112.5 | A213 I214 R215 | A213-S217 WeakPolarHBondContact O-CB 3.28Å; A213-S217 PolarHBondContact O-N 3.11Å; A213-S217 PolarHBondContact O-OG 3.19Å; I214-S217 PolarHBondContact O-N 2.87Å; R215-S217 PolarHBondContact O-N 3Å |
| 218 | R | 74.1 | Confident | 79.4 | Confident | 138 Ų | 138 | 85.9 Ų | 85.9 | 52% | 0.521 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -80.2 | -35.3 | 177.4 | -165.8 | -179.7 | -66.3 | -175.3 | -1.5 | 112.3 | I214 R215 N216 V220 I221 | I214-R218 PolarHBondContact O-N 3.12Å; I214-R218 VanDerWaalsContact O-N 3.11Å; R215-R218 WeakPolarHBondContact O-CA 3.37Å; R215-R218 WeakPolarHBondContact O-CB 3.5Å; R215-R218 PolarHBondContact O-N 3.24Å; N216-R218 VanDerWaalsContact C-N 3.34Å; R218-V220 PolarHBondContact O-N 2.76Å; R218-I221 PolarHBondContact O-N 3.42Å |
| 219 | D | 71.3 | Confident | 78.5 | Confident | 118 Ų | 118 | 83.6 Ų | 83.6 | 63% | 0.631 | 44% | 0.442 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.7 | -12.3 | 178.7 | -61.7 | -34.6 | 0 | 0 | 0 | 113.6 | R215 | R215-D219 PolarHBondContact O-N 3.24Š|
| 220 | V | 63.5 | Low | 77.6 | Confident | 107 Ų | 107 | 85.1 Ų | 85.1 | 65% | 0.648 | 45% | 0.446 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -98.8 | -3.3 | -177.4 | 176.1 | 0 | 0 | 0 | 0 | 112.6 | N216 R218 | N216-V220 WeakPolarHBondContact O-CG2 3.42Å; R218-V220 PolarHBondContact O-N 2.76Å |
| 221 | I | 51.9 | Low | 76.9 | Confident | 204 Ų | 204 | 92.3 Ų | 92.3 | 100% | 1.046 | 48% | 0.484 | S | S | * | . | trans | -109 | 0 | 178.6 | -60 | 169.4 | 0 | 0 | 0 | 108.7 | R218 | R218-I221 PolarHBondContact O-N 3.42Š|
Retrieved 221 of 221 residues in 380.7 ms
(Link to these results)