| 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 | 58.9 | Low | 78 | Confident | 147 Ų | 147 | 111.7 Ų | 111.7 | 72% | 0.724 | 55% | 0.551 | S | S | * | * | 0 | -44 | 0 | -115.4 | -179.9 | -179.8 | 0 | 0 | 113.3 | S3 F4 V5 | M1-S3 PolarHBondContact O-N 2.8Å; M1-F4 PolarHBondContact O-N 3.43Å; M1-V5 PolarHBondContact O-N 3.15Å | |||
| 2 | F | 64 | Low | 78.6 | Confident | 174 Ų | 174 | 108.1 Ų | 108.1 | 76% | 0.763 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -60.7 | -38.1 | -177 | -80.1 | -82.5 | 0 | 0 | 0 | 115.4 | F4 V5 K6 | F2-F4 VanDerWaalsContact C-N 3.34Å; F2-F4 PolarHBondContact O-N 3.22Å; F2-V5 PolarHBondContact O-N 2.65Å; F2-K6 WeakPolarHBondContact O-CG 3.48Å; F2-K6 PolarHBondContact O-N 3.38Å |
| 3 | S | 77.6 | Confident | 79.1 | Confident | 102 Ų | 102 | 109.7 Ų | 109.7 | 71% | 0.713 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -66.2 | -35.4 | -179.2 | -48.5 | 0 | 0 | 0 | 0 | 112.9 | M1 K6 Y7 | M1-S3 PolarHBondContact O-N 2.8Å; S3-K6 PolarHBondContact O-N 2.7Å; S3-Y7 WeakPolarHBondContact O-CB 3.32Å; S3-Y7 PolarHBondContact O-N 2.85Å |
| 4 | F | 75.4 | Confident | 79.6 | Confident | 109 Ų | 109 | 107.6 Ų | 107.6 | 48% | 0.478 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -71.3 | -40.5 | 179.2 | -165.9 | -105.6 | 0 | 0 | 0 | 111.9 | M1 F2 Y7 I8 | M1-F4 PolarHBondContact O-N 3.43Å; F2-F4 VanDerWaalsContact C-N 3.34Å; F2-F4 PolarHBondContact O-N 3.22Å; F4-Y7 PolarHBondContact O-N 3.28Å; F4-I8 HydrophobicContact CD1-CD1 3.51Å; F4-I8 HydrophobicContact CD1-CG1 4.43Å; F4-I8 HydrophobicContact CE1-CD1 3.33Å; F4-I8 HydrophobicContact CE1-CG1 4.28Å; F4-I8 HydrophobicContact CG-CD1 4.41Å; F4-I8 HydrophobicContact CZ-CD1 4.08Å; F4-I8 WeakPolarHBondContact O-CG1 3.16Å; F4-I8 PolarHBondContact O-N 3.36Å |
| 5 | V | 77.3 | Confident | 79.6 | Confident | 84 Ų | 84 | 106 Ų | 106 | 51% | 0.509 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -64.3 | -42.9 | 175.2 | 178.6 | 0 | 0 | 0 | 0 | 110.6 | M1 F2 Y7 I8 T9 | M1-V5 PolarHBondContact O-N 3.15Å; F2-V5 PolarHBondContact O-N 2.65Å; V5-Y7 PolarHBondContact O-N 2.96Å; V5-I8 PolarHBondContact O-N 3.4Å; V5-T9 HydrophobicContact CG1-CG2 4.47Å; V5-T9 WeakPolarHBondContact O-CG2 3.4Å; V5-T9 PolarHBondContact O-N 3.31Å; V5-T9 PolarHBondContact O-OG1 3.23Å; V5-T9 VanDerWaalsContact O-OG1 3.1Å |
| 6 | K | 82.4 | Confident | 79.7 | Confident | 142 Ų | 142 | 105.5 Ų | 105.5 | 62% | 0.617 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -60 | -45.4 | 175.1 | -75.3 | 178.3 | 177.3 | 176.5 | 0 | 111.8 | F2 S3 T9 F10 | F2-K6 WeakPolarHBondContact O-CG 3.48Å; F2-K6 PolarHBondContact O-N 3.38Å; S3-K6 PolarHBondContact O-N 2.7Å; K6-T9 WeakPolarHBondContact CA-OG1 3.38Å; K6-T9 PolarHBondContact O-N 3.32Å; K6-T9 PolarHBondContact O-OG1 3.43Å; K6-F10 VanDerWaalsContact O-CB 3.3Å; K6-F10 WeakPolarHBondContact O-CB 3.44Å; K6-F10 PolarHBondContact O-N 3.03Å |
| 7 | Y | 83 | Confident | 79.7 | Confident | 158 Ų | 158 | 103.1 Ų | 103.1 | 62% | 0.62 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -59.2 | -48.9 | 176.7 | -172.4 | -95.9 | 0 | 0 | 0 | 111.4 | S3 F4 V5 T9 F10 T11 | S3-Y7 WeakPolarHBondContact O-CB 3.32Å; S3-Y7 PolarHBondContact O-N 2.85Å; F4-Y7 PolarHBondContact O-N 3.28Å; V5-Y7 PolarHBondContact O-N 2.96Å; Y7-T9 PolarHBondContact O-N 2.92Å; Y7-F10 PolarHBondContact O-N 3.45Å; Y7-T11 PolarHBondContact O-N 3.19Å; Y7-T11 PolarHBondContact O-OG1 2.69Å |
| 8 | I | 83.7 | Confident | 79.6 | Confident | 58 Ų | 58 | 104.4 Ų | 104.4 | 30% | 0.297 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -59.6 | -46.6 | 177.1 | -69.1 | 164.6 | 0 | 0 | 0 | 111.4 | F4 V5 F10 T11 L12 | F4-I8 HydrophobicContact CD1-CD1 3.51Å; F4-I8 HydrophobicContact CD1-CG1 4.43Å; F4-I8 HydrophobicContact CE1-CD1 3.33Å; F4-I8 HydrophobicContact CE1-CG1 4.28Å; F4-I8 HydrophobicContact CG-CD1 4.41Å; F4-I8 HydrophobicContact CZ-CD1 4.08Å; F4-I8 WeakPolarHBondContact O-CG1 3.16Å; F4-I8 PolarHBondContact O-N 3.36Å; V5-I8 PolarHBondContact O-N 3.4Å; I8-F10 VanDerWaalsContact C-N 3.28Å; I8-F10 PolarHBondContact O-N 2.92Å; I8-T11 PolarHBondContact O-N 3.16Å; I8-L12 HydrophobicContact CG2-CD1 3.95Å; I8-L12 HydrophobicContact CG2-CG 4.35Å; I8-L12 WeakPolarHBondContact O-CB 3.27Å; I8-L12 WeakPolarHBondContact O-CG 3.48Å; I8-L12 PolarHBondContact O-N 3.45Å |
| 9 | T | 83.6 | Confident | 79.2 | Confident | 79 Ų | 79 | 103.8 Ų | 103.8 | 49% | 0.485 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -63.2 | -36.8 | 179 | 52.2 | 0 | 0 | 0 | 0 | 112.1 | V5 K6 Y7 F13 | V5-T9 HydrophobicContact CG1-CG2 4.47Å; V5-T9 WeakPolarHBondContact O-CG2 3.4Å; V5-T9 PolarHBondContact O-N 3.31Å; V5-T9 PolarHBondContact O-OG1 3.23Å; V5-T9 VanDerWaalsContact O-OG1 3.1Å; K6-T9 WeakPolarHBondContact CA-OG1 3.38Å; K6-T9 PolarHBondContact O-N 3.32Å; K6-T9 PolarHBondContact O-OG1 3.43Å; Y7-T9 PolarHBondContact O-N 2.92Å; T9-F13 VanDerWaalsContact O-CB 3.26Å; T9-F13 WeakPolarHBondContact O-CB 3.48Å; T9-F13 PolarHBondContact O-N 2.93Å |
| 10 | F | 86.5 | Confident | 78.6 | Confident | 126 Ų | 126 | 104.1 Ų | 104.1 | 55% | 0.553 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -68.9 | -44.8 | 177.4 | -176.3 | -107.2 | 0 | 0 | 0 | 111.4 | K6 Y7 I8 L12 F13 I14 | K6-F10 VanDerWaalsContact O-CB 3.3Å; K6-F10 WeakPolarHBondContact O-CB 3.44Å; K6-F10 PolarHBondContact O-N 3.03Å; Y7-F10 PolarHBondContact O-N 3.45Å; I8-F10 VanDerWaalsContact C-N 3.28Å; I8-F10 PolarHBondContact O-N 2.92Å; F10-L12 PolarHBondContact O-N 2.75Å; F10-F13 PolarHBondContact O-N 2.87Å; F10-I14 HydrophobicContact CD1-CD1 3.62Å; F10-I14 HydrophobicContact CE1-CD1 3.21Å; F10-I14 HydrophobicContact CE1-CG1 4.3Å; F10-I14 HydrophobicContact CE2-CD1 4.28Å; F10-I14 HydrophobicContact CG-CD1 4.32Å; F10-I14 HydrophobicContact CZ-CD1 3.59Å; F10-I14 HydrophobicContact CZ-CG1 4.35Å; F10-I14 WeakPolarHBondContact O-CG1 3.45Å; F10-I14 PolarHBondContact O-N 3.42Å |
| 11 | T | 85.9 | Confident | 77.8 | Confident | 50 Ų | 50 | 102.8 Ų | 102.8 | 31% | 0.307 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -62.3 | -44 | 175.6 | -51.2 | 0 | 0 | 0 | 0 | 111.4 | Y7 I8 F13 I14 I15 | Y7-T11 PolarHBondContact O-N 3.19Å; Y7-T11 PolarHBondContact O-OG1 2.69Å; I8-T11 PolarHBondContact O-N 3.16Å; T11-F13 PolarHBondContact O-N 3.23Å; T11-I14 PolarHBondContact O-N 3.03Å; T11-I15 HydrophobicContact CG2-CD1 3.92Å; T11-I15 VanDerWaalsContact O-CG1 3.25Å; T11-I15 WeakPolarHBondContact O-CG1 3.42Å; T11-I15 PolarHBondContact O-N 3.09Å |
| 12 | L | 84.8 | Confident | 77.8 | Confident | 68 Ų | 68 | 101.8 Ų | 101.8 | 36% | 0.356 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -62.9 | -41.8 | 174.8 | -72.5 | 176.4 | 0 | 0 | 0 | 111.6 | I8 F10 I14 I15 I16 | I8-L12 HydrophobicContact CG2-CD1 3.95Å; I8-L12 HydrophobicContact CG2-CG 4.35Å; I8-L12 WeakPolarHBondContact O-CB 3.27Å; I8-L12 WeakPolarHBondContact O-CG 3.48Å; I8-L12 PolarHBondContact O-N 3.45Å; F10-L12 PolarHBondContact O-N 2.75Å; L12-I14 PolarHBondContact O-N 3.39Å; L12-I15 PolarHBondContact O-N 2.91Å; L12-I16 WeakPolarHBondContact O-CB 3.23Å; L12-I16 WeakPolarHBondContact O-CD1 3.47Å; L12-I16 WeakPolarHBondContact O-CG1 3.07Å; L12-I16 PolarHBondContact O-N 2.65Å |
| 13 | F | 85.3 | Confident | 77.4 | Confident | 129 Ų | 129 | 95 Ų | 95 | 57% | 0.566 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -62.1 | -42.5 | 176.1 | -174.1 | -101.4 | 0 | 0 | 0 | 111.6 | T9 F10 T11 I16 N17 | T9-F13 VanDerWaalsContact O-CB 3.26Å; T9-F13 WeakPolarHBondContact O-CB 3.48Å; T9-F13 PolarHBondContact O-N 2.93Å; F10-F13 PolarHBondContact O-N 2.87Å; T11-F13 PolarHBondContact O-N 3.23Å; F13-I16 PolarHBondContact O-N 3.48Å; F13-N17 VanDerWaalsContact CD1-ND2 3.3Å; F13-N17 WeakPolarHBondContact CD1-ND2 3.28Å; F13-N17 WeakPolarHBondContact CE1-ND2 3.3Å; F13-N17 VanDerWaalsContact CE2-ND2 3.33Å; F13-N17 WeakPolarHBondContact CE2-ND2 3.25Å; F13-N17 WeakPolarHBondContact CZ-ND2 3.41Å; F13-N17 WeakPolarHBondContact O-CB 3.47Å; F13-N17 PolarHBondContact O-N 3.06Å; F13-N17 PolarHBondContact O-ND2 3.2Å |
| 14 | I | 85.5 | Confident | 76.1 | Confident | 80 Ų | 80 | 99.2 Ų | 99.2 | 41% | 0.41 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -62.5 | -47.7 | 174.6 | -70.9 | 169.3 | 0 | 0 | 0 | 110.6 | F10 T11 L12 I16 N17 Y18 | F10-I14 HydrophobicContact CD1-CD1 3.62Å; F10-I14 HydrophobicContact CE1-CD1 3.21Å; F10-I14 HydrophobicContact CE1-CG1 4.3Å; F10-I14 HydrophobicContact CE2-CD1 4.28Å; F10-I14 HydrophobicContact CG-CD1 4.32Å; F10-I14 HydrophobicContact CZ-CD1 3.59Å; F10-I14 HydrophobicContact CZ-CG1 4.35Å; F10-I14 WeakPolarHBondContact O-CG1 3.45Å; F10-I14 PolarHBondContact O-N 3.42Å; T11-I14 PolarHBondContact O-N 3.03Å; L12-I14 PolarHBondContact O-N 3.39Å; I14-I16 VanDerWaalsContact C-N 3.33Å; I14-I16 PolarHBondContact O-N 3.4Å; I14-N17 PolarHBondContact O-N 3.17Å; I14-Y18 WeakPolarHBondContact O-CB 3.36Å; I14-Y18 PolarHBondContact O-N 3.43Å |
| 15 | I | 80.7 | Confident | 74.9 | Confident | 84 Ų | 84 | 97.7 Ų | 97.7 | 43% | 0.431 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -63.3 | -40.3 | -179.1 | -68.5 | 166.2 | 0 | 0 | 0 | 111.2 | T11 L12 Y18 N19 | T11-I15 HydrophobicContact CG2-CD1 3.92Å; T11-I15 VanDerWaalsContact O-CG1 3.25Å; T11-I15 WeakPolarHBondContact O-CG1 3.42Å; T11-I15 PolarHBondContact O-N 3.09Å; L12-I15 PolarHBondContact O-N 2.91Å; I15-Y18 PolarHBondContact O-N 3.02Å; I15-N19 WeakPolarHBondContact O-CB 3.05Å; I15-N19 PolarHBondContact O-N 2.79Å; I15-N19 PolarHBondContact O-ND2 3.28Å |
| 16 | I | 80.8 | Confident | 73.4 | Confident | 98 Ų | 98 | 95.7 Ų | 95.7 | 50% | 0.503 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -66.6 | -46.8 | 176.8 | -68.9 | 164.2 | 0 | 0 | 0 | 110.1 | L12 F13 I14 Y18 N19 L20 | L12-I16 WeakPolarHBondContact O-CB 3.23Å; L12-I16 WeakPolarHBondContact O-CD1 3.47Å; L12-I16 WeakPolarHBondContact O-CG1 3.07Å; L12-I16 PolarHBondContact O-N 2.65Å; F13-I16 PolarHBondContact O-N 3.48Å; I14-I16 VanDerWaalsContact C-N 3.33Å; I14-I16 PolarHBondContact O-N 3.4Å; I16-Y18 VanDerWaalsContact C-N 3.33Å; I16-Y18 PolarHBondContact O-N 2.88Å; I16-N19 PolarHBondContact O-N 3.03Å; I16-L20 HydrophobicContact CG2-CD1 4.28Å; I16-L20 WeakPolarHBondContact O-CB 3.41Å; I16-L20 PolarHBondContact O-N 3Å |
| 17 | N | 79 | Confident | 71.6 | Confident | 64 Ų | 64 | 95.6 Ų | 95.6 | 34% | 0.342 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -65.2 | -37.3 | 177.4 | -81.6 | -76.7 | 0 | 0 | 0 | 111.9 | F13 I14 L20 T21 | F13-N17 VanDerWaalsContact CD1-ND2 3.3Å; F13-N17 WeakPolarHBondContact CD1-ND2 3.28Å; F13-N17 WeakPolarHBondContact CE1-ND2 3.3Å; F13-N17 VanDerWaalsContact CE2-ND2 3.33Å; F13-N17 WeakPolarHBondContact CE2-ND2 3.25Å; F13-N17 WeakPolarHBondContact CZ-ND2 3.41Å; F13-N17 WeakPolarHBondContact O-CB 3.47Å; F13-N17 PolarHBondContact O-N 3.06Å; F13-N17 PolarHBondContact O-ND2 3.2Å; I14-N17 PolarHBondContact O-N 3.17Å; N17-L20 PolarHBondContact O-N 2.82Å; N17-T21 WeakPolarHBondContact O-CB 3.41Å; N17-T21 PolarHBondContact O-N 3.4Å; N17-T21 PolarHBondContact O-OG1 3.34Å |
| 18 | Y | 78.9 | Confident | 69.7 | Low | 128 Ų | 128 | 94.3 Ų | 94.3 | 50% | 0.502 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -64.3 | -49.2 | 174.3 | -164.4 | -86.1 | 0 | 0 | 0 | 109.7 | I14 I15 I16 L20 T21 Y22 | I14-Y18 WeakPolarHBondContact O-CB 3.36Å; I14-Y18 PolarHBondContact O-N 3.43Å; I15-Y18 PolarHBondContact O-N 3.02Å; I16-Y18 VanDerWaalsContact C-N 3.33Å; I16-Y18 PolarHBondContact O-N 2.88Å; Y18-L20 PolarHBondContact O-N 3.07Å; Y18-T21 PolarHBondContact O-N 3.13Å; Y18-Y22 AromaticContact CD1-CD2 3.56Å; Y18-Y22 HydrophobicContact CD1-CD2 3.56Å; Y18-Y22 HydrophobicContact CD1-CE2 4.04Å; Y18-Y22 HydrophobicContact CD1-CG 4.14Å; Y18-Y22 AromaticContact CD2-CD2 3.61Å; Y18-Y22 HydrophobicContact CD2-CD2 3.61Å; Y18-Y22 AromaticContact CD2-CE2 3.25Å; Y18-Y22 HydrophobicContact CD2-CE2 3.25Å; Y18-Y22 HydrophobicContact CE1-CD1 4.36Å; Y18-Y22 AromaticContact CE1-CD2 3.53Å; Y18-Y22 HydrophobicContact CE1-CD2 3.53Å; Y18-Y22 AromaticContact CE1-CE2 3.82Å; Y18-Y22 HydrophobicContact CE1-CE2 3.82Å; Y18-Y22 AromaticContact CE1-CG 3.83Å; Y18-Y22 HydrophobicContact CE1-CG 3.83Å; Y18-Y22 AromaticContact CE2-CD2 3.61Å; Y18-Y22 HydrophobicContact CE2-CD2 3.61Å; Y18-Y22 HydrophobicContact CE2-CE1 4.35Å; Y18-Y22 AromaticContact CE2-CE2 3Å; Y18-Y22 HydrophobicContact CE2-CE2 3Å; Y18-Y22 HydrophobicContact CE2-CG 4.5Å; Y18-Y22 AromaticContact CE2-CZ 3.42Å; Y18-Y22 VanDerWaalsContact CE2-CZ 3.42Å; Y18-Y22 AromaticContact CG-CD2 3.58Å; Y18-Y22 HydrophobicContact CG-CD2 3.58Å; Y18-Y22 AromaticContact CG-CE2 3.76Å; Y18-Y22 HydrophobicContact CG-CE2 3.76Å; Y18-Y22 AromaticContact CZ-CD2 3.54Å; Y18-Y22 AromaticContact CZ-CE1 3.98Å; Y18-Y22 AromaticContact CZ-CE2 3.29Å; Y18-Y22 AromaticContact CZ-CZ 3.5Å; Y18-Y22 VanDerWaalsContact CZ-CZ 3.5Å; Y18-Y22 VanDerWaalsContact O-CB 3.31Å; Y18-Y22 WeakPolarHBondContact O-CB 3.29Å; Y18-Y22 WeakPolarHBondContact O-CD2 3.48Å; Y18-Y22 PolarHBondContact O-N 2.65Å |
| 19 | N | 71.8 | Confident | 67.8 | Low | 93 Ų | 93 | 94.9 Ų | 94.9 | 50% | 0.497 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -64.9 | -35 | 175.9 | -83 | -76.2 | 0 | 0 | 0 | 113.5 | I15 I16 G23 | I15-N19 WeakPolarHBondContact O-CB 3.05Å; I15-N19 PolarHBondContact O-N 2.79Å; I15-N19 PolarHBondContact O-ND2 3.28Å; I16-N19 PolarHBondContact O-N 3.03Å; N19-G23 WeakPolarHBondContact O-CA 3.34Å; N19-G23 PolarHBondContact O-N 3.29Å |
| 20 | L | 67.2 | Low | 65.8 | Low | 108 Ų | 108 | 97.1 Ų | 97.1 | 57% | 0.565 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -69 | -41.9 | 174.6 | -112 | 71.2 | 0 | 0 | 0 | 111.5 | I16 N17 Y18 R24 | I16-L20 HydrophobicContact CG2-CD1 4.28Å; I16-L20 WeakPolarHBondContact O-CB 3.41Å; I16-L20 PolarHBondContact O-N 3Å; N17-L20 PolarHBondContact O-N 2.82Å; Y18-L20 PolarHBondContact O-N 3.07Å; L20-R24 WeakPolarHBondContact O-CB 3.22Å; L20-R24 PolarHBondContact O-N 2.83Å |
| 21 | T | 61.4 | Low | 63.6 | Low | 77 Ų | 77 | 99.1 Ų | 99.1 | 47% | 0.472 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -73 | -50.5 | -177.6 | -55.3 | 0 | 0 | 0 | 0 | 110.5 | N17 Y18 I25 | N17-T21 WeakPolarHBondContact O-CB 3.41Å; N17-T21 PolarHBondContact O-N 3.4Å; N17-T21 PolarHBondContact O-OG1 3.34Å; Y18-T21 PolarHBondContact O-N 3.13Å; T21-I25 VanDerWaalsContact O-CB 3.31Å; T21-I25 WeakPolarHBondContact O-CB 3.49Å; T21-I25 PolarHBondContact O-N 3.43Å |
| 22 | Y | 58.3 | Low | 61.5 | Low | 127 Ų | 127 | 102.1 Ų | 102.1 | 50% | 0.498 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -76.9 | -31.6 | 179.7 | -71.1 | -93.1 | 0 | 0 | 0 | 112.4 | Y18 I25 G26 | Y18-Y22 AromaticContact CD1-CD2 3.56Å; Y18-Y22 HydrophobicContact CD1-CD2 3.56Å; Y18-Y22 HydrophobicContact CD1-CE2 4.04Å; Y18-Y22 HydrophobicContact CD1-CG 4.14Å; Y18-Y22 AromaticContact CD2-CD2 3.61Å; Y18-Y22 HydrophobicContact CD2-CD2 3.61Å; Y18-Y22 AromaticContact CD2-CE2 3.25Å; Y18-Y22 HydrophobicContact CD2-CE2 3.25Å; Y18-Y22 HydrophobicContact CE1-CD1 4.36Å; Y18-Y22 AromaticContact CE1-CD2 3.53Å; Y18-Y22 HydrophobicContact CE1-CD2 3.53Å; Y18-Y22 AromaticContact CE1-CE2 3.82Å; Y18-Y22 HydrophobicContact CE1-CE2 3.82Å; Y18-Y22 AromaticContact CE1-CG 3.83Å; Y18-Y22 HydrophobicContact CE1-CG 3.83Å; Y18-Y22 AromaticContact CE2-CD2 3.61Å; Y18-Y22 HydrophobicContact CE2-CD2 3.61Å; Y18-Y22 HydrophobicContact CE2-CE1 4.35Å; Y18-Y22 AromaticContact CE2-CE2 3Å; Y18-Y22 HydrophobicContact CE2-CE2 3Å; Y18-Y22 HydrophobicContact CE2-CG 4.5Å; Y18-Y22 AromaticContact CE2-CZ 3.42Å; Y18-Y22 VanDerWaalsContact CE2-CZ 3.42Å; Y18-Y22 AromaticContact CG-CD2 3.58Å; Y18-Y22 HydrophobicContact CG-CD2 3.58Å; Y18-Y22 AromaticContact CG-CE2 3.76Å; Y18-Y22 HydrophobicContact CG-CE2 3.76Å; Y18-Y22 AromaticContact CZ-CD2 3.54Å; Y18-Y22 AromaticContact CZ-CE1 3.98Å; Y18-Y22 AromaticContact CZ-CE2 3.29Å; Y18-Y22 AromaticContact CZ-CZ 3.5Å; Y18-Y22 VanDerWaalsContact CZ-CZ 3.5Å; Y18-Y22 VanDerWaalsContact O-CB 3.31Å; Y18-Y22 WeakPolarHBondContact O-CB 3.29Å; Y18-Y22 WeakPolarHBondContact O-CD2 3.48Å; Y18-Y22 PolarHBondContact O-N 2.65Å; Y22-I25 PolarHBondContact O-N 3.48Å; Y22-G26 PolarHBondContact O-N 3.09Å |
| 23 | G | 55.5 | Low | 59.2 | Low | 32 Ų | 32 | 108.2 Ų | 108.2 | 33% | 0.33 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -65.6 | -46.6 | 170.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | N19 I25 G26 Y27 | N19-G23 WeakPolarHBondContact O-CA 3.34Å; N19-G23 PolarHBondContact O-N 3.29Å; G23-I25 PolarHBondContact O-N 2.84Å; G23-G26 PolarHBondContact O-N 3.44Å; G23-Y27 WeakPolarHBondContact O-CD2 3.4Å; G23-Y27 PolarHBondContact O-N 3.22Å |
| 24 | R | 50.6 | Low | 57 | Low | 189 Ų | 189 | 110 Ų | 110 | 71% | 0.713 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -65 | -37.2 | 171.9 | -92.6 | -177.2 | 141 | 162.2 | -4.8 | 112.4 | L20 G26 Y27 F28 | L20-R24 WeakPolarHBondContact O-CB 3.22Å; L20-R24 PolarHBondContact O-N 2.83Å; R24-G26 VanDerWaalsContact C-N 3.26Å; R24-G26 PolarHBondContact O-N 2.88Å; R24-Y27 PolarHBondContact O-N 3.49Å; R24-F28 VanDerWaalsContact O-CB 3.31Å; R24-F28 WeakPolarHBondContact O-CB 3.31Å; R24-F28 PolarHBondContact O-N 2.72Å |
| 25 | I | 49.9 | Very low | 54.9 | Low | 78 Ų | 78 | 112.5 Ų | 112.5 | 40% | 0.4 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -65.1 | -31 | 176.3 | -110.1 | 70.4 | 0 | 0 | 0 | 111.4 | T21 Y22 G23 N29 | T21-I25 VanDerWaalsContact O-CB 3.31Å; T21-I25 WeakPolarHBondContact O-CB 3.49Å; T21-I25 PolarHBondContact O-N 3.43Å; Y22-I25 PolarHBondContact O-N 3.48Å; G23-I25 PolarHBondContact O-N 2.84Å; I25-N29 WeakPolarHBondContact O-CA 3.32Å; I25-N29 WeakPolarHBondContact O-CB 3.5Å; I25-N29 PolarHBondContact O-N 3.01Å; I25-N29 PolarHBondContact O-ND2 3.06Å |
| 26 | G | 46.7 | Very low | 53 | Low | 41 Ų | 41 | 113.3 Ų | 113.3 | 42% | 0.423 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -67.1 | -35 | 171.9 | 0 | 0 | 0 | 0 | 0 | 114 | Y22 G23 R24 Q30 | Y22-G26 PolarHBondContact O-N 3.09Å; G23-G26 PolarHBondContact O-N 3.44Å; R24-G26 VanDerWaalsContact C-N 3.26Å; R24-G26 PolarHBondContact O-N 2.88Å; G26-Q30 WeakPolarHBondContact O-CG 3.37Å |
| 27 | Y | 44.1 | Very low | 50.8 | Low | 141 Ų | 141 | 111.8 Ų | 111.8 | 55% | 0.553 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -84.2 | -30.7 | 176.4 | -71.9 | -74.4 | 0 | 0 | 0 | 113.2 | G23 R24 W135 | G23-Y27 WeakPolarHBondContact O-CD2 3.4Å; G23-Y27 PolarHBondContact O-N 3.22Å; R24-Y27 PolarHBondContact O-N 3.49Å; Y27-W135 HydrophobicContact CE1-CE3 4.22Å |
| 28 | F | 43.7 | Very low | 48.7 | Very low | 130 Ų | 130 | 116.2 Ų | 116.2 | 57% | 0.57 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -84.9 | -26.4 | 178.8 | -133.9 | -94.1 | 0 | 0 | 0 | 112.5 | R24 F31 K32 | R24-F28 VanDerWaalsContact O-CB 3.31Å; R24-F28 WeakPolarHBondContact O-CB 3.31Å; R24-F28 PolarHBondContact O-N 2.72Å; F28-F31 PolarHBondContact O-N 3.47Å; F28-K32 HydrophobicContact CD1-CD 4.5Å; F28-K32 WeakPolarHBondContact O-CB 3.29Å; F28-K32 PolarHBondContact O-N 3.16Å |
| 29 | N | 44.1 | Very low | 46.8 | Very low | 70 Ų | 70 | 117.9 Ų | 117.9 | 37% | 0.374 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -82.6 | -13.3 | 177 | -68.2 | -14 | 0 | 0 | 0 | 113.6 | I25 R33 | I25-N29 WeakPolarHBondContact O-CA 3.32Å; I25-N29 WeakPolarHBondContact O-CB 3.5Å; I25-N29 PolarHBondContact O-N 3.01Å; I25-N29 PolarHBondContact O-ND2 3.06Å; N29-R33 WeakPolarHBondContact O-CB 3.45Å; N29-R33 WeakPolarHBondContact O-CG 3.37Å; N29-R33 PolarHBondContact O-N 2.78Å |
| 30 | Q | 41.1 | Very low | 45.3 | Very low | 126 Ų | 126 | 118.8 Ų | 118.8 | 59% | 0.589 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -77.2 | -27.5 | 165.1 | -68.5 | -71 | 0.3 | 0 | 0 | 111.5 | G26 F34 | G26-Q30 WeakPolarHBondContact O-CG 3.37Å; Q30-F34 WeakPolarHBondContact O-CD2 3.39Å |
| 31 | F | 40.8 | Very low | 44.2 | Very low | 169 Ų | 169 | 122.1 Ų | 122.1 | 74% | 0.741 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -84.7 | -30.1 | 172.7 | -99 | -89 | 0 | 0 | 0 | 113.1 | F28 | F28-F31 PolarHBondContact O-N 3.47Å |
| 32 | K | 41 | Very low | 43 | Very low | 113 Ų | 113 | 122 Ų | 122 | 49% | 0.491 | 63% | 0.63 | S | S | . | * | H | α-helix | trans | -85.3 | -21 | 173.3 | -99.6 | -177.1 | 173.9 | -179.7 | 0 | 115 | F28 F34 D35 T36 | F28-K32 HydrophobicContact CD1-CD 4.5Å; F28-K32 WeakPolarHBondContact O-CB 3.29Å; F28-K32 PolarHBondContact O-N 3.16Å; K32-F34 PolarHBondContact O-N 3.47Å; K32-D35 PolarHBondContact O-N 2.79Å; K32-D35 VanDerWaalsContact O-N 3.12Å; K32-T36 PolarHBondContact O-N 2.95Å; K32-T36 VanDerWaalsContact O-N 3.08Å; K32-T36 PolarHBondContact O-OG1 3.25Å; K32-T36 VanDerWaalsContact O-OG1 3.05Å |
| 33 | R | 36.4 | Very low | 42.3 | Very low | 195 Ų | 195 | 122.6 Ų | 122.6 | 74% | 0.736 | 64% | 0.641 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.2 | -11.9 | 172.8 | -88.4 | -177.9 | 172.8 | -156.1 | -2.1 | 114.1 | N29 | N29-R33 WeakPolarHBondContact O-CB 3.45Å; N29-R33 WeakPolarHBondContact O-CG 3.37Å; N29-R33 PolarHBondContact O-N 2.78Å |
| 34 | F | 39.8 | Very low | 41.8 | Very low | 168 Ų | 168 | 124.2 Ų | 124.2 | 74% | 0.737 | 65% | 0.645 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.5 | -18.7 | 169.5 | -85.3 | -79.5 | 0 | 0 | 0 | 113.7 | Q30 K32 | Q30-F34 WeakPolarHBondContact O-CD2 3.39Å; K32-F34 PolarHBondContact O-N 3.47Å |
| 35 | D | 41 | Very low | 41.5 | Very low | 131 Ų | 131 | 123.8 Ų | 123.8 | 70% | 0.701 | 65% | 0.653 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -114.3 | -12.9 | -174.2 | -70.6 | -29.3 | 0 | 0 | 0 | 114.8 | K32 | K32-D35 PolarHBondContact O-N 2.79Å; K32-D35 VanDerWaalsContact O-N 3.12Å |
| 36 | T | 41.7 | Very low | 41.6 | Very low | 101 Ų | 101 | 130.2 Ų | 130.2 | 62% | 0.62 | 67% | 0.673 | S | S | * | * | S | Bend | trans | -127 | 13.4 | -176 | 65.5 | 0 | 0 | 0 | 0 | 115.3 | K32 | K32-T36 PolarHBondContact O-N 2.95Å; K32-T36 VanDerWaalsContact O-N 3.08Å; K32-T36 PolarHBondContact O-OG1 3.25Å; K32-T36 VanDerWaalsContact O-OG1 3.05Å |
| 37 | G | 32.8 | Very low | 41.4 | Very low | 67 Ų | 67 | 133.9 Ų | 133.9 | 69% | 0.691 | 68% | 0.682 | S | S | * | * | S | Bend | trans | -97.2 | 4 | 172.2 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||
| 38 | L | 36.7 | Very low | 41.7 | Very low | 156 Ų | 156 | 135.5 Ų | 135.5 | 82% | 0.817 | 70% | 0.695 | S | S | * | * | S | Bend | trans | -102.8 | 15 | -171.5 | -107.4 | 165.7 | 0 | 0 | 0 | 114 | ||
| 39 | L | 38.2 | Very low | 41.7 | Very low | 164 Ų | 164 | 138.4 Ų | 138.4 | 86% | 0.859 | 71% | 0.707 | S | S | * | * | S | Bend | trans | -136.6 | 6.8 | -168.3 | -97.4 | 167.5 | 0 | 0 | 0 | 117.8 | ||
| 40 | S | 39.2 | Very low | 41.6 | Very low | 111 Ų | 111 | 146 Ų | 146 | 78% | 0.776 | 73% | 0.731 | S | S | * | * | S | Bend | trans | -145 | -5.8 | 178.7 | 79.3 | 0 | 0 | 0 | 0 | 119.5 | ||
| 41 | E | 44.1 | Very low | 41.6 | Very low | 179 Ų | 179 | 148.9 Ų | 148.9 | 84% | 0.836 | 74% | 0.744 | S | S | * | * | S | Bend | trans | -129.3 | 106 | -179.5 | -59.7 | -143.8 | 176.5 | 0 | 0 | 111.8 | ||
| 42 | G | 36.4 | Very low | 41.7 | Very low | 75 Ų | 75 | 148 Ų | 148 | 77% | 0.773 | 74% | 0.742 | S | S | * | * | trans | 41 | 90 | 155.3 | 0 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 43 | L | 44.2 | Very low | 41.7 | Very low | 139 Ų | 139 | 151.4 Ų | 151.4 | 73% | 0.728 | 76% | 0.757 | S | S | * | * | trans | -57.7 | 133.7 | 163.9 | -96 | 108.3 | 0 | 0 | 0 | 110.1 | M45 L47 | L43-M45 PolarHBondContact O-N 3.25Å; L43-L47 HydrophobicContact CD2-CB 3.9Å; L43-L47 HydrophobicContact CD2-CD1 3.83Å; L43-L47 HydrophobicContact CD2-CG 4.42Å | ||
| 44 | P | 44.5 | Very low | 41.9 | Very low | 65 Ų | 65 | 151.4 Ų | 151.4 | 42% | 0.422 | 77% | 0.766 | S | S | . | * | trans | -59.5 | 135.1 | 173.2 | 22.8 | -31 | 0 | 0 | 0 | 110.7 | W46 L47 | P44-W46 HydrophobicContact CB-CD2 4.33Å; P44-W46 HydrophobicContact CB-CZ2 4.25Å; P44-W46 HydrophobicContact CG-CZ2 4.13Å; P44-W46 PolarHBondContact O-N 3.46Å; P44-L47 PolarHBondContact O-N 3.03Å | ||
| 45 | M | 44.5 | Very low | 42.6 | Very low | 180 Ų | 180 | 148.3 Ų | 148.3 | 89% | 0.887 | 76% | 0.76 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -49 | -5.5 | -173.7 | -156.2 | -173.9 | -55.1 | 0 | 0 | 116.9 | L43 | L43-M45 PolarHBondContact O-N 3.25Š|
| 46 | W | 51.8 | Low | 43.1 | Very low | 214 Ų | 214 | 148 Ų | 148 | 81% | 0.811 | 77% | 0.765 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.1 | -2.2 | 178.5 | 60.1 | 41.3 | 0 | 0 | 0 | 114.5 | P44 | P44-W46 HydrophobicContact CB-CD2 4.33Å; P44-W46 HydrophobicContact CB-CZ2 4.25Å; P44-W46 HydrophobicContact CG-CZ2 4.13Å; P44-W46 PolarHBondContact O-N 3.46Å |
| 47 | L | 43.6 | Very low | 43.5 | Very low | 117 Ų | 117 | 152.6 Ų | 152.6 | 61% | 0.613 | 77% | 0.773 | S | S | * | * | S | Bend | trans | -106.6 | 3.8 | -176.4 | -102.4 | 160.9 | 0 | 0 | 0 | 114.1 | L43 P44 K49 | L43-L47 HydrophobicContact CD2-CB 3.9Å; L43-L47 HydrophobicContact CD2-CD1 3.83Å; L43-L47 HydrophobicContact CD2-CG 4.42Å; P44-L47 PolarHBondContact O-N 3.03Å; L47-K49 PolarHBondContact O-N 2.89Å |
| 48 | E | 50.8 | Low | 44.5 | Very low | 176 Ų | 176 | 151.6 Ų | 151.6 | 82% | 0.822 | 76% | 0.763 | S | S | * | * | S | Bend | trans | -93.9 | 15.8 | -173.6 | -168.1 | 152.3 | -172 | 0 | 0 | 114.2 | ||
| 49 | K | 42.2 | Very low | 45.4 | Very low | 190 Ų | 190 | 154 Ų | 154 | 83% | 0.826 | 76% | 0.762 | S | S | * | * | trans | -151.4 | 95.3 | -178.8 | -156.5 | 172.6 | -168.1 | 170.1 | 0 | 109 | L47 | L47-K49 PolarHBondContact O-N 2.89Š| ||
| 50 | R | 42.3 | Very low | 46.4 | Very low | 230 Ų | 230 | 151.6 Ų | 151.6 | 87% | 0.868 | 75% | 0.75 | S | S | * | * | trans | -178.2 | 88.2 | 135.2 | -68.5 | -138.2 | -153.4 | -173.9 | 9.3 | 108.7 | ||||
| 51 | E | 41.6 | Very low | 47.5 | Very low | 186 Ų | 186 | 148.7 Ų | 148.7 | 87% | 0.869 | 73% | 0.73 | S | S | * | * | trans | -51.3 | 145.8 | 132.6 | -70.5 | 176.3 | 145.5 | 0 | 0 | 107.7 | ||||
| 52 | E | 42.3 | Very low | 48.1 | Very low | 152 Ų | 152 | 144.5 Ų | 144.5 | 71% | 0.71 | 71% | 0.712 | S | S | * | * | trans | 76.9 | 96.5 | 175.6 | -46 | 176.9 | 178.9 | 0 | 0 | 115.5 | ||||
| 53 | F | 41.7 | Very low | 49.4 | Very low | 184 Ų | 184 | 144 Ų | 144 | 81% | 0.807 | 70% | 0.697 | S | S | * | * | 174.3 | 120.7 | 106.2 | -108.7 | -94.6 | 0 | 0 | 0 | 111 | V55 | F53-V55 PolarHBondContact O-N 3.35Š| |||
| 54 | E | 40.1 | Very low | 50.5 | Low | 194 Ų | 194 | 145.8 Ų | 145.8 | 91% | 0.907 | 69% | 0.694 | S | S | * | * | trans | -76.3 | 87.8 | 179.2 | -172.7 | 179.1 | -155.2 | 0 | 0 | 110.5 | ||||
| 55 | V | 53.9 | Low | 51.2 | Low | 103 Ų | 103 | 145.8 Ų | 145.8 | 62% | 0.624 | 70% | 0.699 | S | S | * | * | trans | -155.4 | 129.3 | 166.1 | -149.4 | 0 | 0 | 0 | 0 | 111.2 | F53 Y57 | F53-V55 PolarHBondContact O-N 3.35Å; V55-Y57 PolarHBondContact O-N 2.97Å | ||
| 56 | P | 51.8 | Low | 51.7 | Low | 124 Ų | 124 | 142.5 Ų | 142.5 | 81% | 0.805 | 69% | 0.685 | S | S | * | * | trans | -74.6 | 115.3 | 178.2 | 29.6 | -31.5 | 0 | 0 | 0 | 110 | G58 | P56-G58 PolarHBondContact O-N 3.34Š| ||
| 57 | Y | 51.1 | Low | 52.7 | Low | 199 Ų | 199 | 137.3 Ų | 137.3 | 78% | 0.78 | 67% | 0.668 | S | S | * | * | trans | -61.2 | 118.5 | 174.5 | -75.3 | -87.8 | 0 | 0 | 0 | 110.4 | V55 | V55-Y57 PolarHBondContact O-N 2.97Š| ||
| 58 | G | 54 | Low | 53.8 | Low | 46 Ų | 46 | 136.8 Ų | 136.8 | 47% | 0.474 | 67% | 0.666 | S | S | . | * | trans | -67.2 | 148.8 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | P56 D60 S61 | P56-G58 PolarHBondContact O-N 3.34Å; G58-D60 PolarHBondContact O-N 2.93Å; G58-S61 PolarHBondContact O-N 3.1Å; G58-S61 PolarHBondContact O-OG 3.07Å | ||
| 59 | Y | 54.9 | Low | 54.4 | Low | 206 Ų | 206 | 136.5 Ų | 136.5 | 81% | 0.808 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -46.4 | -28.2 | 179.7 | -85.8 | -90.8 | 0 | 0 | 0 | 114.2 | S61 I62 S63 | Y59-S61 VanDerWaalsContact C-N 3.32Å; Y59-S61 PolarHBondContact O-N 3.33Å; Y59-I62 PolarHBondContact O-N 2.92Å; Y59-S63 WeakPolarHBondContact O-CB 3.23Å; Y59-S63 PolarHBondContact O-N 2.81Å; Y59-S63 PolarHBondContact O-OG 3.45Å |
| 60 | D | 59.9 | Low | 55.5 | Low | 114 Ų | 114 | 130 Ų | 130 | 61% | 0.61 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -65.5 | -28.9 | 179 | -65.5 | -16.9 | 0 | 0 | 0 | 114.4 | G58 S63 R64 | G58-D60 PolarHBondContact O-N 2.93Å; D60-S63 WeakPolarHBondContact CA-OG 3.46Å; D60-S63 PolarHBondContact O-OG 3.31Å; D60-S63 VanDerWaalsContact O-OG 3.1Å; D60-R64 WeakPolarHBondContact O-CG 3.35Å; D60-R64 PolarHBondContact O-N 2.77Å |
| 61 | S | 62.5 | Low | 56.5 | Low | 49 Ų | 49 | 122.7 Ų | 122.7 | 34% | 0.343 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -75.8 | -37.8 | 176.9 | 61 | 0 | 0 | 0 | 0 | 111.6 | G58 Y59 A65 | G58-S61 PolarHBondContact O-N 3.1Å; G58-S61 PolarHBondContact O-OG 3.07Å; Y59-S61 VanDerWaalsContact C-N 3.32Å; Y59-S61 PolarHBondContact O-N 3.33Å; S61-A65 PolarHBondContact O-N 3.16Å; S61-A65 VanDerWaalsContact O-N 3.12Å |
| 62 | I | 56.9 | Low | 57.9 | Low | 92 Ų | 92 | 119.3 Ų | 119.3 | 47% | 0.472 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -72.5 | -39.1 | 178.5 | -57.9 | 171.6 | 0 | 0 | 0 | 110.3 | Y59 A65 L66 | Y59-I62 PolarHBondContact O-N 2.92Å; I62-A65 PolarHBondContact O-N 3.13Å; I62-L66 HydrophobicContact CG2-CD1 4.15Å; I62-L66 PolarHBondContact O-N 3.03Å |
| 63 | S | 62.1 | Low | 58.9 | Low | 64 Ų | 64 | 117 Ų | 117 | 45% | 0.448 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -67.6 | -37.5 | 177.5 | 66 | 0 | 0 | 0 | 0 | 112.5 | Y59 D60 K67 | Y59-S63 WeakPolarHBondContact O-CB 3.23Å; Y59-S63 PolarHBondContact O-N 2.81Å; Y59-S63 PolarHBondContact O-OG 3.45Å; D60-S63 WeakPolarHBondContact CA-OG 3.46Å; D60-S63 PolarHBondContact O-OG 3.31Å; D60-S63 VanDerWaalsContact O-OG 3.1Å; S63-K67 WeakPolarHBondContact O-CB 3.4Å; S63-K67 PolarHBondContact O-N 3.31Å |
| 64 | R | 67 | Low | 60.2 | Low | 177 Ų | 177 | 113 Ų | 113 | 67% | 0.668 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -63.7 | -45.6 | 171.4 | -79.3 | 176.2 | -177.4 | 146.2 | 4.2 | 112.1 | D60 L66 K67 D68 | D60-R64 WeakPolarHBondContact O-CG 3.35Å; D60-R64 PolarHBondContact O-N 2.77Å; R64-L66 VanDerWaalsContact C-N 3.34Å; R64-L66 PolarHBondContact O-N 2.92Å; R64-K67 PolarHBondContact O-N 3.04Å; R64-D68 PolarHBondContact O-N 3.15Å |
| 65 | A | 59.4 | Low | 61.8 | Low | 64 Ų | 64 | 109.5 Ų | 109.5 | 53% | 0.529 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -62.5 | -39.1 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | S61 I62 R69 | S61-A65 PolarHBondContact O-N 3.16Å; S61-A65 VanDerWaalsContact O-N 3.12Å; I62-A65 PolarHBondContact O-N 3.13Å; A65-R69 PolarHBondContact O-N 3.28Å |
| 66 | L | 56.7 | Low | 62.6 | Low | 112 Ų | 112 | 110.1 Ų | 110.1 | 59% | 0.586 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -68.8 | -37.4 | 174.5 | -79.4 | 165.5 | 0 | 0 | 0 | 112.4 | I62 R64 R69 S70 | I62-L66 HydrophobicContact CG2-CD1 4.15Å; I62-L66 PolarHBondContact O-N 3.03Å; R64-L66 VanDerWaalsContact C-N 3.34Å; R64-L66 PolarHBondContact O-N 2.92Å; L66-R69 PolarHBondContact O-N 2.84Å; L66-S70 PolarHBondContact O-N 3.39Å; L66-S70 VanDerWaalsContact O-N 3.09Å |
| 67 | K | 71 | Confident | 63.1 | Low | 104 Ų | 104 | 108.3 Ų | 108.3 | 45% | 0.452 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -64.3 | -44.4 | 175.6 | -170.1 | 122.9 | -177.1 | -176.6 | 0 | 111.3 | S63 R64 R69 S70 N71 | S63-K67 WeakPolarHBondContact O-CB 3.4Å; S63-K67 PolarHBondContact O-N 3.31Å; R64-K67 PolarHBondContact O-N 3.04Å; K67-R69 VanDerWaalsContact C-N 3.31Å; K67-R69 PolarHBondContact O-N 3.41Å; K67-S70 PolarHBondContact O-N 3.23Å; K67-S70 VanDerWaalsContact O-N 3.16Å; K67-S70 PolarHBondContact O-OG 2.89Å; K67-N71 VanDerWaalsContact O-CG 3.22Å; K67-N71 PolarHBondContact O-N 3.5Å; K67-N71 PolarHBondContact O-ND2 3.01Å |
| 68 | D | 68.4 | Low | 63.9 | Low | 107 Ų | 107 | 103.4 Ų | 103.4 | 57% | 0.572 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -63.7 | -36.9 | 178.2 | -73.1 | -13.2 | 0 | 0 | 0 | 112 | R64 N71 L72 | R64-D68 PolarHBondContact O-N 3.15Å; D68-N71 PolarHBondContact O-N 3.45Å; D68-L72 PolarHBondContact O-N 3.33Å |
| 69 | R | 62.5 | Low | 64.8 | Low | 170 Ų | 170 | 109 Ų | 109 | 64% | 0.642 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -64.3 | -41.3 | 173.3 | -169.2 | 174.5 | -177.4 | 171.7 | 3.8 | 112.6 | A65 L66 K67 N71 L72 E73 | A65-R69 PolarHBondContact O-N 3.28Å; L66-R69 PolarHBondContact O-N 2.84Å; K67-R69 VanDerWaalsContact C-N 3.31Å; K67-R69 PolarHBondContact O-N 3.41Å; R69-N71 VanDerWaalsContact C-N 3.33Å; R69-L72 PolarHBondContact O-N 2.92Å; R69-E73 PolarHBondContact O-N 3.44Å; R69-E73 VanDerWaalsContact O-N 3.11Å |
| 70 | S | 64.5 | Low | 65.2 | Low | 53 Ų | 53 | 104.7 Ų | 104.7 | 37% | 0.371 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -66.4 | -35.7 | 176.8 | 72.3 | 0 | 0 | 0 | 0 | 112.7 | L66 K67 L74 | L66-S70 PolarHBondContact O-N 3.39Å; L66-S70 VanDerWaalsContact O-N 3.09Å; K67-S70 PolarHBondContact O-N 3.23Å; K67-S70 VanDerWaalsContact O-N 3.16Å; K67-S70 PolarHBondContact O-OG 2.89Å; S70-L74 WeakPolarHBondContact O-CG 3.35Å; S70-L74 PolarHBondContact O-N 3.05Å; S70-L74 VanDerWaalsContact O-N 3.07Å |
| 71 | N | 64.9 | Low | 65.3 | Low | 77 Ų | 77 | 104 Ų | 104 | 41% | 0.412 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -69.2 | -37.1 | 176.8 | -65 | -29.5 | 0 | 0 | 0 | 111.2 | K67 D68 R69 L74 D75 | K67-N71 VanDerWaalsContact O-CG 3.22Å; K67-N71 PolarHBondContact O-N 3.5Å; K67-N71 PolarHBondContact O-ND2 3.01Å; D68-N71 PolarHBondContact O-N 3.45Å; R69-N71 VanDerWaalsContact C-N 3.33Å; N71-L74 PolarHBondContact O-N 2.87Å; N71-D75 WeakPolarHBondContact O-CB 3.46Å; N71-D75 PolarHBondContact O-N 2.93Å |
| 72 | L | 69.8 | Low | 65.1 | Low | 114 Ų | 114 | 106 Ų | 106 | 60% | 0.597 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -65.5 | -43.2 | 175.7 | -160.1 | 99.8 | 0 | 0 | 0 | 111.9 | D68 R69 L74 D75 E76 | D68-L72 PolarHBondContact O-N 3.33Å; R69-L72 PolarHBondContact O-N 2.92Å; L72-L74 VanDerWaalsContact C-N 3.35Å; L72-L74 PolarHBondContact O-N 3.49Å; L72-D75 PolarHBondContact O-N 3.37Å; L72-E76 PolarHBondContact O-N 2.86Å |
| 73 | E | 65 | Low | 65.2 | Low | 105 Ų | 105 | 110.2 Ų | 110.2 | 49% | 0.491 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -66.6 | -35.8 | 177 | -72.1 | -169.2 | 178.7 | 0 | 0 | 112.1 | R69 I77 | R69-E73 PolarHBondContact O-N 3.44Å; R69-E73 VanDerWaalsContact O-N 3.11Å; E73-I77 WeakPolarHBondContact O-CB 3.47Å; E73-I77 WeakPolarHBondContact O-CD1 3.42Å; E73-I77 WeakPolarHBondContact O-CG1 3.37Å; E73-I77 PolarHBondContact O-N 3.21Å |
| 74 | L | 69.1 | Low | 64.8 | Low | 99 Ų | 99 | 110.1 Ų | 110.1 | 52% | 0.518 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -66.3 | -38.4 | 173.3 | -81.9 | 161.8 | 0 | 0 | 0 | 112.4 | S70 N71 L72 I77 N78 | S70-L74 WeakPolarHBondContact O-CG 3.35Å; S70-L74 PolarHBondContact O-N 3.05Å; S70-L74 VanDerWaalsContact O-N 3.07Å; N71-L74 PolarHBondContact O-N 2.87Å; L72-L74 VanDerWaalsContact C-N 3.35Å; L72-L74 PolarHBondContact O-N 3.49Å; L74-I77 PolarHBondContact O-N 2.91Å; L74-N78 WeakPolarHBondContact O-CB 3.26Å; L74-N78 PolarHBondContact O-N 3.01Å |
| 75 | D | 72.3 | Confident | 63.8 | Low | 121 Ų | 121 | 109.1 Ų | 109.1 | 65% | 0.647 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -70.8 | -37.1 | 178.4 | -143.3 | 33.6 | 0 | 0 | 0 | 111.2 | N71 L72 R79 | N71-D75 WeakPolarHBondContact O-CB 3.46Å; N71-D75 PolarHBondContact O-N 2.93Å; L72-D75 PolarHBondContact O-N 3.37Å; D75-R79 VanDerWaalsContact O-CB 3.23Å; D75-R79 WeakPolarHBondContact O-CB 3.22Å; D75-R79 PolarHBondContact O-N 2.93Å |
| 76 | E | 70.8 | Confident | 63.3 | Low | 115 Ų | 115 | 112.6 Ų | 112.6 | 54% | 0.537 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -65 | -43 | 170.9 | -76.6 | -162.4 | 155.2 | 0 | 0 | 112.3 | L72 R79 I80 | L72-E76 PolarHBondContact O-N 2.86Å; E76-R79 WeakPolarHBondContact O-CB 3.33Å; E76-R79 PolarHBondContact O-N 3.43Å; E76-I80 WeakPolarHBondContact O-CD1 3.39Å; E76-I80 WeakPolarHBondContact O-CG1 3.48Å; E76-I80 PolarHBondContact O-N 3.31Å |
| 77 | I | 62.6 | Low | 62.4 | Low | 87 Ų | 87 | 114.1 Ų | 114.1 | 45% | 0.446 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -65 | -43.6 | 176.8 | -69.7 | 166.1 | 0 | 0 | 0 | 110.7 | E73 L74 R79 I80 I81 | E73-I77 WeakPolarHBondContact O-CB 3.47Å; E73-I77 WeakPolarHBondContact O-CD1 3.42Å; E73-I77 WeakPolarHBondContact O-CG1 3.37Å; E73-I77 PolarHBondContact O-N 3.21Å; L74-I77 PolarHBondContact O-N 2.91Å; I77-R79 VanDerWaalsContact C-N 3.31Å; I77-R79 PolarHBondContact O-N 3.04Å; I77-I80 PolarHBondContact O-N 2.91Å; I77-I81 HydrophobicContact CG2-CD1 3.63Å; I77-I81 HydrophobicContact CG2-CG1 4.34Å; I77-I81 WeakPolarHBondContact O-CB 3.29Å; I77-I81 VanDerWaalsContact O-CG1 3.24Å; I77-I81 WeakPolarHBondContact O-CG1 3.48Å; I77-I81 PolarHBondContact O-N 3.23Å |
| 78 | N | 67 | Low | 61.2 | Low | 95 Ų | 95 | 116.8 Ų | 116.8 | 51% | 0.508 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -65.6 | -34.9 | 175.8 | -82.1 | -23.4 | 0 | 0 | 0 | 112.1 | L74 I81 S82 | L74-N78 WeakPolarHBondContact O-CB 3.26Å; L74-N78 PolarHBondContact O-N 3.01Å; N78-I81 PolarHBondContact O-N 3.41Å; N78-S82 WeakPolarHBondContact O-CB 3.33Å; N78-S82 PolarHBondContact O-N 3.49Å; N78-S82 PolarHBondContact O-OG 2.95Å; N78-S82 VanDerWaalsContact O-OG 3.09Å |
| 79 | R | 73.9 | Confident | 60.2 | Low | 163 Ų | 163 | 116.7 Ų | 116.7 | 62% | 0.615 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -64.1 | -44.5 | 170.6 | -171 | 174.6 | 178.5 | -112.3 | -2.5 | 110.9 | D75 E76 I77 I81 S82 Y83 | D75-R79 VanDerWaalsContact O-CB 3.23Å; D75-R79 WeakPolarHBondContact O-CB 3.22Å; D75-R79 PolarHBondContact O-N 2.93Å; E76-R79 WeakPolarHBondContact O-CB 3.33Å; E76-R79 PolarHBondContact O-N 3.43Å; I77-R79 VanDerWaalsContact C-N 3.31Å; I77-R79 PolarHBondContact O-N 3.04Å; R79-I81 VanDerWaalsContact C-N 3.34Å; R79-I81 PolarHBondContact O-N 2.93Å; R79-S82 WeakPolarHBondContact CA-OG 3.39Å; R79-S82 PolarHBondContact O-N 3.39Å; R79-S82 PolarHBondContact O-OG 3.04Å; R79-Y83 HydrophobicContact CG-CD2 4.19Å; R79-Y83 HydrophobicContact CG-CE2 4.18Å; R79-Y83 VanDerWaalsContact O-CD2 3.29Å; R79-Y83 WeakPolarHBondContact O-CD2 3.34Å; R79-Y83 PolarHBondContact O-N 2.98Å |
| 80 | I | 64 | Low | 59.1 | Low | 116 Ų | 116 | 116.9 Ų | 116.9 | 60% | 0.595 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -63.4 | -40.6 | 177.4 | -67.7 | 161.3 | 0 | 0 | 0 | 111.2 | E76 I77 Y83 S84 | E76-I80 WeakPolarHBondContact O-CD1 3.39Å; E76-I80 WeakPolarHBondContact O-CG1 3.48Å; E76-I80 PolarHBondContact O-N 3.31Å; I77-I80 PolarHBondContact O-N 2.91Å; I80-Y83 PolarHBondContact O-N 2.95Å; I80-S84 PolarHBondContact O-N 2.97Å |
| 81 | I | 60.5 | Low | 58.4 | Low | 100 Ų | 100 | 120.7 Ų | 120.7 | 51% | 0.513 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -69.8 | -37 | 178.4 | -66.8 | 167 | 0 | 0 | 0 | 111.7 | I77 N78 R79 Y83 S84 | I77-I81 HydrophobicContact CG2-CD1 3.63Å; I77-I81 HydrophobicContact CG2-CG1 4.34Å; I77-I81 WeakPolarHBondContact O-CB 3.29Å; I77-I81 VanDerWaalsContact O-CG1 3.24Å; I77-I81 WeakPolarHBondContact O-CG1 3.48Å; I77-I81 PolarHBondContact O-N 3.23Å; N78-I81 PolarHBondContact O-N 3.41Å; R79-I81 VanDerWaalsContact C-N 3.34Å; R79-I81 PolarHBondContact O-N 2.93Å; I81-Y83 VanDerWaalsContact C-N 3.28Å; I81-Y83 PolarHBondContact O-N 3.14Å; I81-S84 PolarHBondContact O-N 3.38Å; I81-S84 PolarHBondContact O-OG 2.94Å; I81-S84 VanDerWaalsContact O-OG 3.05Å |
| 82 | S | 59.9 | Low | 57.6 | Low | 91 Ų | 91 | 125 Ų | 125 | 64% | 0.636 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -70.7 | -22.4 | 176.8 | 61.4 | 0 | 0 | 0 | 0 | 113.7 | N78 R79 | N78-S82 WeakPolarHBondContact O-CB 3.33Å; N78-S82 PolarHBondContact O-N 3.49Å; N78-S82 PolarHBondContact O-OG 2.95Å; N78-S82 VanDerWaalsContact O-OG 3.09Å; R79-S82 WeakPolarHBondContact CA-OG 3.39Å; R79-S82 PolarHBondContact O-N 3.39Å; R79-S82 PolarHBondContact O-OG 3.04Å |
| 83 | Y | 58.4 | Low | 56.5 | Low | 180 Ų | 180 | 127.4 Ų | 127.4 | 71% | 0.706 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -86.5 | -16.3 | 174.7 | -89.2 | -94.4 | 0 | 0 | 0 | 113.5 | R79 I80 I81 N85 | R79-Y83 HydrophobicContact CG-CD2 4.19Å; R79-Y83 HydrophobicContact CG-CE2 4.18Å; R79-Y83 VanDerWaalsContact O-CD2 3.29Å; R79-Y83 WeakPolarHBondContact O-CD2 3.34Å; R79-Y83 PolarHBondContact O-N 2.98Å; I80-Y83 PolarHBondContact O-N 2.95Å; I81-Y83 VanDerWaalsContact C-N 3.28Å; I81-Y83 PolarHBondContact O-N 3.14Å; Y83-N85 PolarHBondContact O-N 3.37Å |
| 84 | S | 52.5 | Low | 55.6 | Low | 62 Ų | 62 | 128.2 Ų | 128.2 | 43% | 0.434 | 64% | 0.636 | S | S | . | * | trans | -86.6 | 89.8 | 175.8 | 55.7 | 0 | 0 | 0 | 0 | 111.1 | I80 I81 I86 | I80-S84 PolarHBondContact O-N 2.97Å; I81-S84 PolarHBondContact O-N 3.38Å; I81-S84 PolarHBondContact O-OG 2.94Å; I81-S84 VanDerWaalsContact O-OG 3.05Å; S84-I86 PolarHBondContact O-N 3Å | ||
| 85 | N | 46.6 | Very low | 54.6 | Low | 156 Ų | 156 | 130.1 Ų | 130.1 | 83% | 0.834 | 65% | 0.646 | S | S | * | * | trans | -69.4 | 64.2 | 167.7 | -168.7 | 4.3 | 0 | 0 | 0 | 111.1 | Y83 | Y83-N85 PolarHBondContact O-N 3.37Š| ||
| 86 | I | 48.3 | Very low | 53.4 | Low | 138 Ų | 138 | 129.2 Ų | 129.2 | 71% | 0.708 | 65% | 0.649 | S | S | * | * | trans | -130.4 | 85.5 | 179 | -52.3 | 176.9 | 0 | 0 | 0 | 108.3 | S84 | S84-I86 PolarHBondContact O-N 3Š| ||
| 87 | N | 39.5 | Very low | 52.4 | Low | 143 Ų | 143 | 132.5 Ų | 132.5 | 77% | 0.765 | 66% | 0.662 | S | S | * | * | trans | 39.4 | 101.5 | 140.5 | -57.1 | -37 | 0 | 0 | 0 | 118 | ||||
| 88 | H | 45.9 | Very low | 51.7 | Low | 161 Ų | 161 | 135.2 Ų | 135.2 | 75% | 0.745 | 68% | 0.676 | S | S | * | * | trans | -47.7 | 153.2 | 148.7 | -74.2 | -103.4 | 0 | 0 | 0 | 111.6 | ||||
| 89 | P | 45.9 | Very low | 50.5 | Low | 105 Ų | 105 | 137.1 Ų | 137.1 | 68% | 0.682 | 69% | 0.686 | S | S | * | * | cis | -137.9 | 104.5 | 31.3 | 35.9 | -14 | 0 | 0 | 0 | 113.9 | ||||
| 90 | F | 39.7 | Very low | 49.1 | Very low | 173 Ų | 173 | 135.3 Ų | 135.3 | 76% | 0.759 | 70% | 0.696 | S | S | * | * | S | Bend | trans | -106.7 | -3.1 | 162.6 | -167.8 | -107.5 | 0 | 0 | 0 | 112.6 | F94 | F90-F94 HydrophobicContact CE1-CE2 4.19Š|
| 91 | M | 49.6 | Very low | 48.3 | Very low | 133 Ų | 133 | 133.8 Ų | 133.8 | 66% | 0.655 | 70% | 0.695 | S | S | * | * | G | 310 helix | trans | -87.8 | -14 | -175 | -82 | -67.9 | -136.6 | 0 | 0 | 115.3 | F93 | M91-F93 VanDerWaalsContact C-N 3.29Å; M91-F93 PolarHBondContact O-N 3.47Å |
| 92 | E | 48.6 | Very low | 47.6 | Very low | 167 Ų | 167 | 135.9 Ų | 135.9 | 78% | 0.78 | 71% | 0.713 | S | S | * | * | G | 310 helix | trans | -76.2 | -9.7 | -178 | -88.1 | -175.3 | 158.4 | 0 | 0 | 114.9 | ||
| 93 | F | 46 | Very low | 46.8 | Very low | 166 Ų | 166 | 138.7 Ų | 138.7 | 73% | 0.728 | 71% | 0.71 | S | S | * | * | G | 310 helix | trans | -84.2 | -21 | 178.8 | -169.4 | -107.5 | 0 | 0 | 0 | 113.4 | M91 | M91-F93 VanDerWaalsContact C-N 3.29Å; M91-F93 PolarHBondContact O-N 3.47Å |
| 94 | F | 47 | Very low | 46.2 | Very low | 122 Ų | 122 | 134.4 Ų | 134.4 | 54% | 0.535 | 71% | 0.707 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -98.9 | -13.8 | -175.1 | -72.1 | -75 | 0 | 0 | 0 | 114.7 | F90 S96 | F90-F94 HydrophobicContact CE1-CE2 4.19Å; F94-S96 PolarHBondContact O-N 3.31Å |
| 95 | D | 47.5 | Very low | 46.1 | Very low | 139 Ų | 139 | 137.6 Ų | 137.6 | 74% | 0.743 | 72% | 0.719 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.1 | -12.3 | -179 | -97.2 | -22.4 | 0 | 0 | 0 | 114.8 | ||
| 96 | S | 48.4 | Very low | 46.3 | Very low | 101 Ų | 101 | 136.9 Ų | 136.9 | 71% | 0.706 | 72% | 0.715 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.9 | -5.9 | -178.6 | 64.6 | 0 | 0 | 0 | 0 | 114.9 | F94 | F94-S96 PolarHBondContact O-N 3.31Š|
| 97 | K | 48.4 | Very low | 46.3 | Very low | 185 Ų | 185 | 135.9 Ų | 135.9 | 80% | 0.804 | 71% | 0.71 | S | S | * | * | S | Bend | trans | -111.9 | -1 | -173.9 | -95.3 | -78.1 | -174 | 177.7 | 0 | 115.6 | ||
| 98 | L | 48.4 | Very low | 46.7 | Very low | 144 Ų | 144 | 136 Ų | 136 | 75% | 0.754 | 71% | 0.709 | S | S | * | * | trans | -122.9 | 67.3 | 175.5 | -72 | 110.8 | 0 | 0 | 0 | 110.5 | P100 | L98-P100 WeakPolarHBondContact O-CD 3.38Š| ||
| 99 | N | 41.6 | Very low | 46.8 | Very low | 134 Ų | 134 | 135.2 Ų | 135.2 | 72% | 0.717 | 71% | 0.71 | S | S | * | * | trans | -75.4 | 109.5 | 164.3 | -173 | -9.4 | 0 | 0 | 0 | 108.4 | S101 | N99-S101 PolarHBondContact O-N 2.88Å; N99-S101 PolarHBondContact OD1-OG 3.41Å | ||
| 100 | P | 44.8 | Very low | 46.8 | Very low | 126 Ų | 126 | 141.4 Ų | 141.4 | 82% | 0.818 | 72% | 0.72 | S | S | * | * | trans | -97.9 | 86.7 | 179.7 | 31.4 | -13.7 | 0 | 0 | 0 | 107.7 | L98 | L98-P100 WeakPolarHBondContact O-CD 3.38Š| ||
| 101 | S | 47 | Very low | 47 | Very low | 83 Ų | 83 | 139.5 Ų | 139.5 | 58% | 0.58 | 72% | 0.718 | S | S | * | * | trans | -140.5 | 47 | 178.6 | 52.7 | 0 | 0 | 0 | 0 | 113 | N99 | N99-S101 PolarHBondContact O-N 2.88Å; N99-S101 PolarHBondContact OD1-OG 3.41Å | ||
| 102 | V | 46.4 | Very low | 47 | Very low | 144 Ų | 144 | 139.5 Ų | 139.5 | 87% | 0.873 | 72% | 0.718 | S | S | * | * | trans | -145.7 | 97 | 151.5 | -174.1 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 103 | Y | 42.1 | Very low | 46.8 | Very low | 151 Ų | 151 | 143 Ų | 143 | 59% | 0.592 | 72% | 0.724 | S | S | * | * | trans | -84.3 | 130.9 | 174.6 | -162.3 | -108.2 | 0 | 0 | 0 | 108.5 | D105 I107 | Y103-D105 HydrophobicContact CE1-CB 4.46Å; Y103-D105 VanDerWaalsContact CE1-CG 3.45Å; Y103-D105 WeakPolarHBondContact CE1-OD1 3.38Å; Y103-I107 HydrophobicContact CD2-CD1 4.08Å; Y103-I107 HydrophobicContact CE2-CD1 3.49Å; Y103-I107 VanDerWaalsContact CE2-CD1 3.49Å | ||
| 104 | S | 45.6 | Very low | 46.8 | Very low | 90 Ų | 90 | 139.4 Ų | 139.4 | 63% | 0.629 | 73% | 0.725 | S | S | * | * | trans | -129.9 | 131.2 | 149.2 | -75.4 | 0 | 0 | 0 | 0 | 108 | D106 | S104-D106 VanDerWaalsContact C-N 3.25Å; S104-D106 PolarHBondContact O-N 2.87Å | ||
| 105 | D | 51.5 | Low | 46.6 | Very low | 129 Ų | 129 | 143.4 Ų | 143.4 | 69% | 0.69 | 74% | 0.742 | S | S | * | * | S | Bend | trans | -65.8 | 44.9 | -161.5 | -75.6 | -90.1 | 0 | 0 | 0 | 117.2 | Y103 | Y103-D105 HydrophobicContact CE1-CB 4.46Å; Y103-D105 VanDerWaalsContact CE1-CG 3.45Å; Y103-D105 WeakPolarHBondContact CE1-OD1 3.38Å |
| 106 | D | 50.6 | Low | 46.9 | Very low | 140 Ų | 140 | 142.8 Ų | 142.8 | 75% | 0.749 | 75% | 0.745 | S | S | * | * | trans | -94.7 | 2.9 | -178.5 | -51.2 | 24.7 | 0 | 0 | 0 | 112.2 | S104 I108 | S104-D106 VanDerWaalsContact C-N 3.25Å; S104-D106 PolarHBondContact O-N 2.87Å; D106-I108 VanDerWaalsContact C-N 3.29Å; D106-I108 PolarHBondContact O-N 3.37Å | ||
| 107 | I | 48.1 | Very low | 46.8 | Very low | 117 Ų | 117 | 142.9 Ų | 142.9 | 60% | 0.6 | 75% | 0.752 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68 | -3.8 | -158 | -77.3 | 176.8 | 0 | 0 | 0 | 116.5 | Y103 | Y103-I107 HydrophobicContact CD2-CD1 4.08Å; Y103-I107 HydrophobicContact CE2-CD1 3.49Å; Y103-I107 VanDerWaalsContact CE2-CD1 3.49Å |
| 108 | I | 47.9 | Very low | 46.3 | Very low | 146 Ų | 146 | 143.7 Ų | 143.7 | 75% | 0.749 | 76% | 0.756 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -111.4 | -1.9 | -165.8 | -58.7 | -176.2 | 0 | 0 | 0 | 116.2 | D106 | D106-I108 VanDerWaalsContact C-N 3.29Å; D106-I108 PolarHBondContact O-N 3.37Å |
| 109 | N | 48 | Very low | 46.2 | Very low | 144 Ų | 144 | 145.5 Ų | 145.5 | 77% | 0.77 | 76% | 0.761 | S | S | * | * | S | Bend | trans | -143.9 | 120.6 | 177.7 | -84.9 | -65.2 | 0 | 0 | 0 | 116.9 | ||
| 110 | R | 45.4 | Very low | 45.9 | Very low | 236 Ų | 236 | 143.6 Ų | 143.6 | 89% | 0.891 | 76% | 0.763 | S | S | * | * | trans | 92.2 | 73.9 | 154.6 | -71.1 | -179.6 | 168.5 | 159.4 | -2.9 | 118.9 | ||||
| 111 | D | 44.5 | Very low | 46.1 | Very low | 132 Ų | 132 | 145.1 Ų | 145.1 | 71% | 0.706 | 76% | 0.763 | S | S | * | * | 66.7 | 98.3 | 111.8 | -140 | 22 | 0 | 0 | 0 | 118.7 | |||||
| 112 | M | 49.5 | Very low | 45.8 | Very low | 134 Ų | 134 | 149.7 Ų | 149.7 | 66% | 0.66 | 78% | 0.781 | S | S | * | * | trans | 51.4 | 85.5 | 141 | -62.2 | -164.4 | -89.1 | 0 | 0 | 117.4 | ||||
| 113 | R | 43.8 | Very low | 45.6 | Very low | 240 Ų | 240 | 145 Ų | 145 | 91% | 0.906 | 76% | 0.761 | S | S | * | * | 66.7 | 85.9 | 93.4 | -169.5 | 175.7 | -83.5 | 163 | -5.2 | 112.8 | |||||
| 114 | A | 47.2 | Very low | 45.5 | Very low | 90 Ų | 90 | 146 Ų | 146 | 74% | 0.744 | 78% | 0.776 | S | S | * | * | 72.3 | 112 | 89.1 | 0 | 0 | 0 | 0 | 0 | 114.7 | |||||
| 115 | K | 43.1 | Very low | 45.3 | Very low | 207 Ų | 207 | 150.7 Ų | 150.7 | 90% | 0.9 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -49.5 | 136 | 165.5 | -64 | 166.8 | 174.8 | 177.9 | 0 | 111 | ||
| 116 | P | 53.2 | Low | 45 | Very low | 126 Ų | 126 | 149.9 Ų | 149.9 | 82% | 0.818 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -91.9 | 120.5 | 163.7 | 31.5 | -26.5 | 0 | 0 | 0 | 110.4 | ||
| 117 | A | 45.1 | Very low | 44.4 | Very low | 102 Ų | 102 | 150.7 Ų | 150.7 | 84% | 0.843 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -64.9 | 126.1 | 161.1 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||
| 118 | F | 38.9 | Very low | 44.4 | Very low | 202 Ų | 202 | 148.1 Ų | 148.1 | 89% | 0.886 | 79% | 0.794 | S | S | * | * | trans | -85.6 | 105.6 | 171.9 | 163.2 | -95.5 | 0 | 0 | 0 | 107.7 | ||||
| 119 | E | 45.7 | Very low | 44.3 | Very low | 183 Ų | 183 | 150.3 Ų | 150.3 | 86% | 0.855 | 81% | 0.807 | S | S | * | * | trans | -162.9 | 130.8 | 159.3 | -110.6 | 171.8 | -154 | 0 | 0 | 110.1 | ||||
| 120 | A | 36.7 | Very low | 44.4 | Very low | 93 Ų | 93 | 152.4 Ų | 152.4 | 77% | 0.769 | 80% | 0.804 | S | S | * | * | trans | 71.2 | 83.9 | 162.6 | 0 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 121 | I | 47.6 | Very low | 44.6 | Very low | 158 Ų | 158 | 147 Ų | 147 | 81% | 0.81 | 80% | 0.803 | S | S | * | * | trans | -139.1 | 80.9 | 145.2 | -47.4 | 177.3 | 0 | 0 | 0 | 109.1 | ||||
| 122 | N | 41.4 | Very low | 44.9 | Very low | 180 Ų | 180 | 149.3 Ų | 149.3 | 96% | 0.963 | 80% | 0.803 | S | S | * | * | trans | -89 | 95 | 162 | -75.1 | -33.7 | 0 | 0 | 0 | 107.4 | ||||
| 123 | G | 41.6 | Very low | 45.4 | Very low | 44 Ų | 44 | 151.1 Ų | 151.1 | 45% | 0.454 | 81% | 0.811 | S | S | . | * | S | Bend | trans | 144.9 | 126.8 | 174 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||
| 124 | L | 40.5 | Very low | 46.4 | Very low | 174 Ų | 174 | 144 Ų | 144 | 91% | 0.911 | 79% | 0.791 | S | S | * | * | trans | 78.4 | 88.8 | 174.6 | -68.3 | 69.5 | 0 | 0 | 0 | 116.1 | ||||
| 125 | Q | 40.9 | Very low | 47.9 | Very low | 187 Ų | 187 | 147.7 Ų | 147.7 | 87% | 0.874 | 79% | 0.786 | S | S | * | * | trans | -160.7 | 99.2 | 130.3 | -153.2 | 167.7 | -37.1 | 0 | 0 | 111.1 | ||||
| 126 | T | 44.7 | Very low | 49.3 | Very low | 113 Ų | 113 | 144.5 Ų | 144.5 | 69% | 0.693 | 77% | 0.774 | S | S | * | * | trans | -76.8 | 147 | 160.5 | 50.4 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 127 | N | 39.7 | Very low | 50.7 | Low | 156 Ų | 156 | 141.6 Ų | 141.6 | 83% | 0.834 | 76% | 0.755 | S | S | * | * | trans | 76.8 | 75.9 | 158.6 | -42.9 | -31.8 | 0 | 0 | 0 | 116.7 | ||||
| 128 | G | 47.2 | Very low | 52.4 | Low | 63 Ų | 63 | 139.5 Ų | 139.5 | 65% | 0.649 | 74% | 0.738 | S | S | * | * | trans | -145.2 | 111.4 | 157.3 | 0 | 0 | 0 | 0 | 0 | 108.6 | R130 | G128-R130 PolarHBondContact O-N 3.28Š| ||
| 129 | L | 46.6 | Very low | 54.7 | Low | 192 Ų | 192 | 134.2 Ų | 134.2 | 100% | 1.005 | 72% | 0.722 | S | S | * | * | trans | -65.4 | 60.1 | 176.1 | -78.7 | 150.4 | 0 | 0 | 0 | 111.4 | ||||
| 130 | R | 49.5 | Very low | 56.7 | Low | 189 Ų | 189 | 130.9 Ų | 130.9 | 71% | 0.713 | 71% | 0.709 | S | S | * | * | trans | -105.8 | 102.7 | 174.4 | -157.1 | 171.5 | -151.6 | -93.8 | 1.1 | 107.1 | G128 Y132 | G128-R130 PolarHBondContact O-N 3.28Å; R130-Y132 HydrophobicContact CG-CE2 4.47Å; R130-Y132 PolarHBondContact O-N 2.89Å | ||
| 131 | S | 49.3 | Very low | 59.1 | Low | 123 Ų | 123 | 128.3 Ų | 128.3 | 86% | 0.86 | 69% | 0.692 | S | S | * | * | trans | -51 | 78.9 | 175.9 | -59.1 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 132 | Y | 51.1 | Low | 61.1 | Low | 180 Ų | 180 | 124.3 Ų | 124.3 | 71% | 0.706 | 68% | 0.678 | S | S | * | * | trans | -95 | 92.5 | 147.9 | -78.2 | -87.3 | 0 | 0 | 0 | 105.1 | R130 N134 | R130-Y132 HydrophobicContact CG-CE2 4.47Å; R130-Y132 PolarHBondContact O-N 2.89Å; Y132-N134 PolarHBondContact O-N 2.93Å | ||
| 133 | M | 59.8 | Low | 63.4 | Low | 172 Ų | 172 | 119.2 Ų | 119.2 | 85% | 0.847 | 65% | 0.653 | S | S | * | * | trans | -62.3 | 91.1 | 164.7 | -170.1 | 111.3 | 65.2 | 0 | 0 | 105.9 | W135 | M133-W135 PolarHBondContact O-N 3.35Å; M133-W135 VanDerWaalsContact O-N 3.1Å | ||
| 134 | N | 65.2 | Low | 65.8 | Low | 91 Ų | 91 | 121.3 Ų | 121.3 | 49% | 0.487 | 66% | 0.66 | S | S | . | * | trans | -54.9 | 120.4 | 167.7 | 51.8 | -23.6 | 0 | 0 | 0 | 105.7 | Y132 Q136 P137 | Y132-N134 PolarHBondContact O-N 2.93Å; N134-Q136 PolarHBondContact O-N 3.25Å; N134-P137 WeakPolarHBondContact ND2-CD 3.32Å; N134-P137 WeakPolarHBondContact O-CD 3.37Å; N134-P137 WeakPolarHBondContact O-CG 3.44Å; N134-P137 WeakPolarHBondContact OD1-CD 3.46Å; N134-P137 WeakPolarHBondContact OD1-CG 3.39Å | ||
| 135 | W | 78.1 | Confident | 68.1 | Low | 167 Ų | 167 | 116 Ų | 116 | 63% | 0.633 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -60.7 | -10.4 | 175.3 | 45.7 | 37.7 | 0 | 0 | 0 | 112.4 | Y27 M133 A138 V139 | Y27-W135 HydrophobicContact CE1-CE3 4.22Å; M133-W135 PolarHBondContact O-N 3.35Å; M133-W135 VanDerWaalsContact O-N 3.1Å; W135-A138 PolarHBondContact O-N 3.07Å; W135-V139 VanDerWaalsContact O-CG2 3.3Å; W135-V139 WeakPolarHBondContact O-CG2 3.35Å; W135-V139 PolarHBondContact O-N 3.44Å |
| 136 | Q | 73.5 | Confident | 70.4 | Confident | 139 Ų | 139 | 109.7 Ų | 109.7 | 65% | 0.65 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -64.4 | -52.2 | -176.2 | -66.6 | -161.7 | -48 | 0 | 0 | 112.7 | N134 A138 V139 I140 | N134-Q136 PolarHBondContact O-N 3.25Å; Q136-A138 VanDerWaalsContact C-N 3.27Å; Q136-A138 PolarHBondContact O-N 3.4Å; Q136-V139 PolarHBondContact O-N 3.4Å; Q136-I140 WeakPolarHBondContact O-CG2 3.36Å; Q136-I140 PolarHBondContact O-N 3.43Å |
| 137 | P | 82.4 | Confident | 72.6 | Confident | 65 Ų | 65 | 109.2 Ų | 109.2 | 42% | 0.422 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -59.1 | -32.7 | 171.3 | 19.6 | -34.1 | 0 | 0 | 0 | 113.7 | N134 I140 G141 | N134-P137 WeakPolarHBondContact ND2-CD 3.32Å; N134-P137 WeakPolarHBondContact O-CD 3.37Å; N134-P137 WeakPolarHBondContact O-CG 3.44Å; N134-P137 WeakPolarHBondContact OD1-CD 3.46Å; N134-P137 WeakPolarHBondContact OD1-CG 3.39Å; P137-I140 VanDerWaalsContact O-CG2 3.28Å; P137-I140 WeakPolarHBondContact O-CG2 3.35Å; P137-G141 PolarHBondContact O-N 3.21Å |
| 138 | A | 81.1 | Confident | 74.9 | Confident | 58 Ų | 58 | 103.3 Ų | 103.3 | 48% | 0.479 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -69.1 | -43.8 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | W135 Q136 S142 | W135-A138 PolarHBondContact O-N 3.07Å; Q136-A138 VanDerWaalsContact C-N 3.27Å; Q136-A138 PolarHBondContact O-N 3.4Å; A138-S142 WeakPolarHBondContact O-CB 3.3Å; A138-S142 PolarHBondContact O-N 3.04Å |
| 139 | V | 86.1 | Confident | 77 | Confident | 92 Ų | 92 | 104.2 Ų | 104.2 | 56% | 0.558 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -66.7 | -46.4 | 177.5 | 173.5 | 0 | 0 | 0 | 0 | 110.9 | W135 Q136 G141 S142 V143 | W135-V139 VanDerWaalsContact O-CG2 3.3Å; W135-V139 WeakPolarHBondContact O-CG2 3.35Å; W135-V139 PolarHBondContact O-N 3.44Å; Q136-V139 PolarHBondContact O-N 3.4Å; V139-G141 VanDerWaalsContact C-N 3.34Å; V139-G141 PolarHBondContact O-N 2.84Å; V139-S142 PolarHBondContact O-N 3.44Å; V139-V143 HydrophobicContact CG1-CG2 4.47Å; V139-V143 WeakPolarHBondContact O-CG2 3.34Å; V139-V143 PolarHBondContact O-N 3.37Å |
| 140 | I | 88 | Confident | 79.1 | Confident | 113 Ų | 113 | 100.3 Ų | 100.3 | 58% | 0.579 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -64.8 | -38.2 | 178.5 | -168.3 | 65.5 | 0 | 0 | 0 | 111.8 | Q136 P137 V143 C144 | Q136-I140 WeakPolarHBondContact O-CG2 3.36Å; Q136-I140 PolarHBondContact O-N 3.43Å; P137-I140 VanDerWaalsContact O-CG2 3.28Å; P137-I140 WeakPolarHBondContact O-CG2 3.35Å; I140-V143 PolarHBondContact O-N 3.39Å; I140-C144 WeakPolarHBondContact O-CB 3.33Å; I140-C144 PolarHBondContact O-N 3.49Å |
| 141 | G | 87.5 | Confident | 81.1 | Confident | 39 Ų | 39 | 95.3 Ų | 95.3 | 40% | 0.402 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -63.1 | -42.5 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | P137 V139 C144 A145 | P137-G141 PolarHBondContact O-N 3.21Å; V139-G141 VanDerWaalsContact C-N 3.34Å; V139-G141 PolarHBondContact O-N 2.84Å; G141-C144 PolarHBondContact O-N 3.49Å; G141-A145 WeakPolarHBondContact O-CB 3.39Å; G141-A145 PolarHBondContact O-N 3.22Å |
| 142 | S | 88.3 | Confident | 83.1 | Confident | 74 Ų | 74 | 95.3 Ų | 95.3 | 52% | 0.517 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -63.7 | -44.5 | 176.1 | -178.5 | 0 | 0 | 0 | 0 | 112.4 | A138 V139 A145 A146 | A138-S142 WeakPolarHBondContact O-CB 3.3Å; A138-S142 PolarHBondContact O-N 3.04Å; V139-S142 PolarHBondContact O-N 3.44Å; S142-A145 PolarHBondContact O-N 2.93Å; S142-A146 PolarHBondContact O-N 3.38Å |
| 143 | V | 90.5 | Very high | 85 | Confident | 73 Ų | 73 | 88.5 Ų | 88.5 | 44% | 0.442 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -63.1 | -43.6 | 176.7 | 174.2 | 0 | 0 | 0 | 0 | 110.8 | V139 I140 A145 A146 L147 | V139-V143 HydrophobicContact CG1-CG2 4.47Å; V139-V143 WeakPolarHBondContact O-CG2 3.34Å; V139-V143 PolarHBondContact O-N 3.37Å; I140-V143 PolarHBondContact O-N 3.39Å; V143-A145 PolarHBondContact O-N 3.43Å; V143-A146 PolarHBondContact O-N 3.34Å; V143-L147 HydrophobicContact CG1-CD1 4.18Å; V143-L147 WeakPolarHBondContact O-CG 3.44Å; V143-L147 PolarHBondContact O-N 2.99Å |
| 144 | C | 91.1 | Very high | 86.4 | Confident | 88 Ų | 88 | 82.9 Ų | 82.9 | 60% | 0.595 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -63.3 | -42.8 | 178.6 | -167 | 0 | 0 | 0 | 0 | 112.1 | I140 G141 L147 G148 | I140-C144 WeakPolarHBondContact O-CB 3.33Å; I140-C144 PolarHBondContact O-N 3.49Å; G141-C144 PolarHBondContact O-N 3.49Å; C144-L147 PolarHBondContact O-N 3.07Å; C144-G148 PolarHBondContact O-N 3.43Å |
| 145 | A | 90.4 | Very high | 87.7 | Confident | 61 Ų | 61 | 82.8 Ų | 82.8 | 50% | 0.504 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -63 | -42.8 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | G141 S142 V143 L147 G148 V149 | G141-A145 WeakPolarHBondContact O-CB 3.39Å; G141-A145 PolarHBondContact O-N 3.22Å; S142-A145 PolarHBondContact O-N 2.93Å; V143-A145 PolarHBondContact O-N 3.43Å; A145-L147 PolarHBondContact O-N 3.17Å; A145-G148 PolarHBondContact O-N 3.31Å; A145-V149 WeakPolarHBondContact O-CG2 3.42Å; A145-V149 PolarHBondContact O-N 3.35Å |
| 146 | A | 88.2 | Confident | 88.3 | Confident | 56 Ų | 56 | 76.4 Ų | 76.4 | 46% | 0.463 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -62.6 | -42 | 177 | 0 | 0 | 0 | 0 | 0 | 112.1 | S142 V143 V149 L150 | S142-A146 PolarHBondContact O-N 3.38Å; V143-A146 PolarHBondContact O-N 3.34Å; A146-V149 PolarHBondContact O-N 2.98Å; A146-L150 WeakPolarHBondContact O-CG 3.43Å; A146-L150 PolarHBondContact O-N 3.48Å |
| 147 | L | 90.8 | Very high | 89.1 | Confident | 103 Ų | 103 | 72.7 Ų | 72.7 | 54% | 0.539 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -65.4 | -41.1 | 174.9 | -67.8 | 176.1 | 0 | 0 | 0 | 111.9 | V143 C144 A145 V149 L150 V151 | V143-L147 HydrophobicContact CG1-CD1 4.18Å; V143-L147 WeakPolarHBondContact O-CG 3.44Å; V143-L147 PolarHBondContact O-N 2.99Å; C144-L147 PolarHBondContact O-N 3.07Å; A145-L147 PolarHBondContact O-N 3.17Å; L147-V149 VanDerWaalsContact C-N 3.35Å; L147-V149 PolarHBondContact O-N 3.38Å; L147-L150 PolarHBondContact O-N 3.3Å; L147-V151 WeakPolarHBondContact O-CG2 3.48Å; L147-V151 PolarHBondContact O-N 3.17Å |
| 148 | G | 89.2 | Confident | 89.5 | Confident | 31 Ų | 31 | 72.4 Ų | 72.4 | 32% | 0.32 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -58 | -45.1 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | C144 A145 L150 V151 I152 | C144-G148 PolarHBondContact O-N 3.43Å; A145-G148 PolarHBondContact O-N 3.31Å; G148-L150 PolarHBondContact O-N 3.34Å; G148-V151 PolarHBondContact O-N 2.86Å; G148-I152 WeakPolarHBondContact O-CG1 3.34Å; G148-I152 PolarHBondContact O-N 2.98Å; G148-I152 VanDerWaalsContact O-N 3.07Å |
| 149 | V | 91.4 | Very high | 90 | Very high | 82 Ų | 82 | 77.1 Ų | 77.1 | 50% | 0.497 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -64.1 | -40.6 | 177.1 | 175.4 | 0 | 0 | 0 | 0 | 111.6 | A145 A146 L147 V151 I152 A153 | A145-V149 WeakPolarHBondContact O-CG2 3.42Å; A145-V149 PolarHBondContact O-N 3.35Å; A146-V149 PolarHBondContact O-N 2.98Å; L147-V149 VanDerWaalsContact C-N 3.35Å; L147-V149 PolarHBondContact O-N 3.38Å; V149-V151 PolarHBondContact O-N 2.9Å; V149-I152 PolarHBondContact O-N 3.32Å; V149-A153 WeakPolarHBondContact O-CB 3.45Å; V149-A153 PolarHBondContact O-N 2.92Å |
| 150 | L | 89.9 | Confident | 90.1 | Very high | 110 Ų | 110 | 77 Ų | 77 | 58% | 0.576 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -63.9 | -40.3 | 177.1 | -73.9 | 174 | 0 | 0 | 0 | 112.3 | A146 L147 G148 A153 A154 | A146-L150 WeakPolarHBondContact O-CG 3.43Å; A146-L150 PolarHBondContact O-N 3.48Å; L147-L150 PolarHBondContact O-N 3.3Å; G148-L150 PolarHBondContact O-N 3.34Å; L150-A153 PolarHBondContact O-N 2.89Å; L150-A154 WeakPolarHBondContact O-CB 3.41Å; L150-A154 PolarHBondContact O-N 3.49Å |
| 151 | V | 91.1 | Very high | 90.1 | Very high | 85 Ų | 85 | 77 Ų | 77 | 52% | 0.515 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -64.2 | -45 | 176.7 | 172.5 | 0 | 0 | 0 | 0 | 110.7 | L147 G148 V149 A153 A154 I155 | L147-V151 WeakPolarHBondContact O-CG2 3.48Å; L147-V151 PolarHBondContact O-N 3.17Å; G148-V151 PolarHBondContact O-N 2.86Å; V149-V151 PolarHBondContact O-N 2.9Å; V151-A153 PolarHBondContact O-N 2.79Å; V151-A154 PolarHBondContact O-N 3.1Å; V151-I155 HydrophobicContact CG1-CD1 3.81Å; V151-I155 VanDerWaalsContact O-CG1 3.26Å; V151-I155 WeakPolarHBondContact O-CG1 3.37Å; V151-I155 PolarHBondContact O-N 2.9Å |
| 152 | I | 91.2 | Very high | 90.1 | Very high | 122 Ų | 122 | 82.8 Ų | 82.8 | 63% | 0.626 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -63.8 | -42 | 178.3 | -64.9 | 165.1 | 0 | 0 | 0 | 110.9 | G148 V149 I155 G156 | G148-I152 WeakPolarHBondContact O-CG1 3.34Å; G148-I152 PolarHBondContact O-N 2.98Å; G148-I152 VanDerWaalsContact O-N 3.07Å; V149-I152 PolarHBondContact O-N 3.32Å; I152-I155 PolarHBondContact O-N 3.48Å; I152-G156 PolarHBondContact O-N 3.06Å |
| 153 | A | 90.7 | Very high | 90 | Very high | 38 Ų | 38 | 86 Ų | 86 | 31% | 0.314 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -65.3 | -40.6 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | V149 L150 V151 G156 T157 | V149-A153 WeakPolarHBondContact O-CB 3.45Å; V149-A153 PolarHBondContact O-N 2.92Å; L150-A153 PolarHBondContact O-N 2.89Å; V151-A153 PolarHBondContact O-N 2.79Å; A153-G156 PolarHBondContact O-N 3.27Å; A153-T157 WeakPolarHBondContact O-CB 3.33Å; A153-T157 VanDerWaalsContact O-CG2 3.29Å; A153-T157 WeakPolarHBondContact O-CG2 3.2Å; A153-T157 PolarHBondContact O-N 3.5Å; A153-T157 PolarHBondContact O-OG1 2.97Å |
| 154 | A | 90.6 | Very high | 89.6 | Confident | 54 Ų | 54 | 86.7 Ų | 86.7 | 45% | 0.446 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -62.6 | -42.6 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | L150 V151 T157 A158 | L150-A154 WeakPolarHBondContact O-CB 3.41Å; L150-A154 PolarHBondContact O-N 3.49Å; V151-A154 PolarHBondContact O-N 3.1Å; A154-T157 WeakPolarHBondContact CA-OG1 3.26Å; A154-T157 PolarHBondContact O-OG1 3.35Å; A154-A158 VanDerWaalsContact O-CB 3.23Å; A154-A158 WeakPolarHBondContact O-CB 3.28Å; A154-A158 PolarHBondContact O-N 3.41Å |
| 155 | I | 91.7 | Very high | 89 | Confident | 88 Ų | 88 | 90 Ų | 90 | 45% | 0.451 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -63.2 | -49 | 174.8 | -68.6 | 167.6 | 0 | 0 | 0 | 110.4 | V151 I152 T157 A158 Y159 | V151-I155 HydrophobicContact CG1-CD1 3.81Å; V151-I155 VanDerWaalsContact O-CG1 3.26Å; V151-I155 WeakPolarHBondContact O-CG1 3.37Å; V151-I155 PolarHBondContact O-N 2.9Å; I152-I155 PolarHBondContact O-N 3.48Å; I155-T157 PolarHBondContact O-N 3.4Å; I155-A158 PolarHBondContact O-N 2.94Å; I155-Y159 HydrophobicContact CG2-CD2 3.5Å; I155-Y159 HydrophobicContact CG2-CE2 3.42Å; I155-Y159 VanDerWaalsContact CG2-CE2 3.42Å; I155-Y159 VanDerWaalsContact O-CD2 3.22Å; I155-Y159 WeakPolarHBondContact O-CD2 3.36Å; I155-Y159 PolarHBondContact O-N 3.04Å |
| 156 | G | 91.3 | Very high | 88.3 | Confident | 34 Ų | 34 | 93.3 Ų | 93.3 | 35% | 0.351 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -59 | -44.1 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113 | I152 A153 Y159 Q160 | I152-G156 PolarHBondContact O-N 3.06Å; A153-G156 PolarHBondContact O-N 3.27Å; G156-Y159 PolarHBondContact O-N 3.35Å; G156-Q160 WeakPolarHBondContact O-CG 3.13Å; G156-Q160 PolarHBondContact O-N 3.48Å |
| 157 | T | 90.4 | Very high | 87.4 | Confident | 61 Ų | 61 | 96.2 Ų | 96.2 | 37% | 0.374 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -69.3 | -35.4 | 176.8 | 55.8 | 0 | 0 | 0 | 0 | 112.5 | A153 A154 I155 Q160 K161 | A153-T157 WeakPolarHBondContact O-CB 3.33Å; A153-T157 VanDerWaalsContact O-CG2 3.29Å; A153-T157 WeakPolarHBondContact O-CG2 3.2Å; A153-T157 PolarHBondContact O-N 3.5Å; A153-T157 PolarHBondContact O-OG1 2.97Å; A154-T157 WeakPolarHBondContact CA-OG1 3.26Å; A154-T157 PolarHBondContact O-OG1 3.35Å; I155-T157 PolarHBondContact O-N 3.4Å; T157-Q160 PolarHBondContact O-N 3.03Å; T157-K161 WeakPolarHBondContact O-CB 3.43Å; T157-K161 WeakPolarHBondContact O-CG 3.3Å; T157-K161 PolarHBondContact O-N 2.66Å |
| 158 | A | 89.8 | Confident | 85.9 | Confident | 58 Ų | 58 | 94.5 Ų | 94.5 | 48% | 0.479 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -65.9 | -40.9 | 172.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | A154 I155 R162 | A154-A158 VanDerWaalsContact O-CB 3.23Å; A154-A158 WeakPolarHBondContact O-CB 3.28Å; A154-A158 PolarHBondContact O-N 3.41Å; I155-A158 PolarHBondContact O-N 2.94Å; A158-R162 VanDerWaalsContact O-CB 3.29Å; A158-R162 WeakPolarHBondContact O-CB 3.25Å; A158-R162 PolarHBondContact O-N 3.33Å |
| 159 | Y | 91.8 | Very high | 84.4 | Confident | 158 Ų | 158 | 99.9 Ų | 99.9 | 62% | 0.62 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -65.1 | -43.7 | 174.1 | -87.7 | -72.9 | 0 | 0 | 0 | 112.2 | I155 G156 R162 K163 | I155-Y159 HydrophobicContact CG2-CD2 3.5Å; I155-Y159 HydrophobicContact CG2-CE2 3.42Å; I155-Y159 VanDerWaalsContact CG2-CE2 3.42Å; I155-Y159 VanDerWaalsContact O-CD2 3.22Å; I155-Y159 WeakPolarHBondContact O-CD2 3.36Å; I155-Y159 PolarHBondContact O-N 3.04Å; G156-Y159 PolarHBondContact O-N 3.35Å; Y159-R162 PolarHBondContact O-N 2.99Å; Y159-K163 WeakPolarHBondContact O-CB 3.37Å; Y159-K163 PolarHBondContact O-N 2.95Å |
| 160 | Q | 88.6 | Confident | 82.7 | Confident | 89 Ų | 89 | 101.8 Ų | 101.8 | 42% | 0.416 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -63.5 | -45.3 | 176.1 | -75.9 | -177.7 | -7.9 | 0 | 0 | 111.6 | G156 T157 K163 L164 | G156-Q160 WeakPolarHBondContact O-CG 3.13Å; G156-Q160 PolarHBondContact O-N 3.48Å; T157-Q160 PolarHBondContact O-N 3.03Å; Q160-K163 PolarHBondContact O-N 3.5Å; Q160-L164 WeakPolarHBondContact O-CG 3.4Å; Q160-L164 PolarHBondContact O-N 3.36Å |
| 161 | K | 88.1 | Confident | 81 | Confident | 113 Ų | 113 | 100 Ų | 100 | 49% | 0.491 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -58 | -52.7 | 171.7 | -80 | -170.4 | 176.1 | -171.8 | 0 | 109.8 | T157 K163 L164 W165 | T157-K161 WeakPolarHBondContact O-CB 3.43Å; T157-K161 WeakPolarHBondContact O-CG 3.3Å; T157-K161 PolarHBondContact O-N 2.66Å; K161-K163 PolarHBondContact O-N 2.9Å; K161-K163 VanDerWaalsContact O-N 3.15Å; K161-L164 CarbonylContact O-C 3.57Å; K161-L164 PolarHBondContact O-N 3.4Å; K161-W165 VanDerWaalsContact C-CD1 3.49Å; K161-W165 PolarHBondContact O-N 3.42Å |
| 162 | R | 86.9 | Confident | 79.3 | Confident | 161 Ų | 161 | 100.2 Ų | 100.2 | 61% | 0.608 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -56.7 | -36.8 | 179.3 | -165.2 | 176.8 | -173.9 | -172.4 | 2 | 113 | A158 Y159 K166 | A158-R162 VanDerWaalsContact O-CB 3.29Å; A158-R162 WeakPolarHBondContact O-CB 3.25Å; A158-R162 PolarHBondContact O-N 3.33Å; Y159-R162 PolarHBondContact O-N 2.99Å; R162-K166 WeakPolarHBondContact O-CB 3.38Å; R162-K166 VanDerWaalsContact O-CG 3.32Å; R162-K166 WeakPolarHBondContact O-CG 3.19Å; R162-K166 PolarHBondContact O-N 3.43Å |
| 163 | K | 87.3 | Confident | 77.5 | Confident | 141 Ų | 141 | 98.8 Ų | 98.8 | 61% | 0.613 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -65.2 | -46.9 | 174.4 | -174 | 177.7 | 179.8 | -179.8 | 0 | 111.7 | Y159 Q160 K161 K166 Q167 | Y159-K163 WeakPolarHBondContact O-CB 3.37Å; Y159-K163 PolarHBondContact O-N 2.95Å; Q160-K163 PolarHBondContact O-N 3.5Å; K161-K163 PolarHBondContact O-N 2.9Å; K161-K163 VanDerWaalsContact O-N 3.15Å; K163-K166 PolarHBondContact O-N 2.89Å; K163-Q167 PolarHBondContact O-N 2.94Å |
| 164 | L | 80.5 | Confident | 75.7 | Confident | 87 Ų | 87 | 104.9 Ų | 104.9 | 46% | 0.455 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -63 | -41.7 | 175.1 | -68.5 | 172.1 | 0 | 0 | 0 | 111.5 | Q160 K161 K166 Q167 S168 | Q160-L164 WeakPolarHBondContact O-CG 3.4Å; Q160-L164 PolarHBondContact O-N 3.36Å; K161-L164 CarbonylContact O-C 3.57Å; K161-L164 PolarHBondContact O-N 3.4Å; L164-K166 VanDerWaalsContact C-N 3.32Å; L164-K166 PolarHBondContact O-N 2.88Å; L164-Q167 PolarHBondContact O-N 2.86Å; L164-Q167 VanDerWaalsContact O-N 3.13Å; L164-S168 PolarHBondContact O-N 3.49Å; L164-S168 PolarHBondContact O-OG 3.18Å |
| 165 | W | 79.5 | Confident | 73.8 | Confident | 159 Ų | 159 | 109.3 Ų | 109.3 | 60% | 0.602 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -66 | -36.6 | 178 | -70.1 | 46.4 | 0 | 0 | 0 | 110.9 | K161 S168 R169 | K161-W165 VanDerWaalsContact C-CD1 3.49Å; K161-W165 PolarHBondContact O-N 3.42Å; W165-S168 PolarHBondContact O-N 3.45Å; W165-R169 VanDerWaalsContact O-CB 3.29Å; W165-R169 WeakPolarHBondContact O-CB 3.36Å; W165-R169 WeakPolarHBondContact O-CG 3.11Å; W165-R169 PolarHBondContact O-N 3.24Å |
| 166 | K | 75 | Confident | 71.7 | Confident | 130 Ų | 130 | 110 Ų | 110 | 57% | 0.565 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -64.4 | -38.3 | 171.6 | -76.5 | 180 | 177.3 | -165.9 | 0 | 112.2 | R162 K163 L164 R169 L170 | R162-K166 WeakPolarHBondContact O-CB 3.38Å; R162-K166 VanDerWaalsContact O-CG 3.32Å; R162-K166 WeakPolarHBondContact O-CG 3.19Å; R162-K166 PolarHBondContact O-N 3.43Å; K163-K166 PolarHBondContact O-N 2.89Å; L164-K166 VanDerWaalsContact C-N 3.32Å; L164-K166 PolarHBondContact O-N 2.88Å; K166-R169 PolarHBondContact O-N 3.31Å; K166-L170 WeakPolarHBondContact O-CD1 3.15Å; K166-L170 WeakPolarHBondContact O-CG 3.17Å; K166-L170 PolarHBondContact O-N 3.42Å |
| 167 | Q | 69 | Low | 69.8 | Low | 116 Ų | 116 | 114 Ų | 114 | 54% | 0.542 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -69.7 | -42 | 175.1 | -72.6 | -172.7 | -13.1 | 0 | 0 | 112 | K163 L164 R169 L170 S171 | K163-Q167 PolarHBondContact O-N 2.94Å; L164-Q167 PolarHBondContact O-N 2.86Å; L164-Q167 VanDerWaalsContact O-N 3.13Å; Q167-R169 VanDerWaalsContact C-N 3.31Å; Q167-R169 PolarHBondContact O-N 3.44Å; Q167-L170 PolarHBondContact O-N 2.99Å; Q167-S171 PolarHBondContact O-N 2.96Å; Q167-S171 VanDerWaalsContact O-N 3.07Å; Q167-S171 PolarHBondContact O-OG 3.27Å |
| 168 | S | 60.2 | Low | 67.8 | Low | 68 Ų | 68 | 117.9 Ų | 117.9 | 48% | 0.476 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -66.5 | -32.7 | 174.2 | -59.7 | 0 | 0 | 0 | 0 | 112.3 | L164 W165 S171 Q172 | L164-S168 PolarHBondContact O-N 3.49Å; L164-S168 PolarHBondContact O-OG 3.18Å; W165-S168 PolarHBondContact O-N 3.45Å; S168-S171 VanDerWaalsContact CA-OG 3.31Å; S168-S171 WeakPolarHBondContact CA-OG 3.42Å; S168-S171 PolarHBondContact O-OG 2.86Å; S168-Q172 WeakPolarHBondContact O-CB 3.06Å; S168-Q172 PolarHBondContact O-N 2.99Å |
| 169 | R | 58.2 | Low | 65.9 | Low | 144 Ų | 144 | 121.1 Ų | 121.1 | 54% | 0.543 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -75.2 | -30 | 172.1 | -70.3 | -144.2 | -171.9 | -166 | -0.7 | 112.5 | W165 K166 Q167 S171 Q172 D173 | W165-R169 VanDerWaalsContact O-CB 3.29Å; W165-R169 WeakPolarHBondContact O-CB 3.36Å; W165-R169 WeakPolarHBondContact O-CG 3.11Å; W165-R169 PolarHBondContact O-N 3.24Å; K166-R169 PolarHBondContact O-N 3.31Å; Q167-R169 VanDerWaalsContact C-N 3.31Å; Q167-R169 PolarHBondContact O-N 3.44Å; R169-S171 VanDerWaalsContact C-N 3.33Å; R169-Q172 CarbonylContact O-C 3.4Å; R169-Q172 PolarHBondContact O-N 2.97Å; R169-D173 WeakPolarHBondContact O-CA 3.3Å; R169-D173 WeakPolarHBondContact O-CB 3.19Å; R169-D173 PolarHBondContact O-N 3.5Å; R169-D173 VanDerWaalsContact O-OD2 3.08Å |
| 170 | L | 55.8 | Low | 63.7 | Low | 121 Ų | 121 | 121.4 Ų | 121.4 | 63% | 0.634 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -65.1 | -39.4 | 169.8 | -78 | 158.5 | 0 | 0 | 0 | 111.5 | K166 Q167 | K166-L170 WeakPolarHBondContact O-CD1 3.15Å; K166-L170 WeakPolarHBondContact O-CG 3.17Å; K166-L170 PolarHBondContact O-N 3.42Å; Q167-L170 PolarHBondContact O-N 2.99Å |
| 171 | S | 53.2 | Low | 61.5 | Low | 73 Ų | 73 | 120.5 Ų | 120.5 | 51% | 0.51 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -73.8 | -28.1 | 172.6 | 52.9 | 0 | 0 | 0 | 0 | 113.6 | Q167 S168 R169 | Q167-S171 PolarHBondContact O-N 2.96Å; Q167-S171 VanDerWaalsContact O-N 3.07Å; Q167-S171 PolarHBondContact O-OG 3.27Å; S168-S171 VanDerWaalsContact CA-OG 3.31Å; S168-S171 WeakPolarHBondContact CA-OG 3.42Å; S168-S171 PolarHBondContact O-OG 2.86Å; R169-S171 VanDerWaalsContact C-N 3.33Å |
| 172 | Q | 54.7 | Low | 59.5 | Low | 89 Ų | 89 | 123.2 Ų | 123.2 | 42% | 0.416 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -89.3 | -29.4 | -179.5 | -165 | 171.8 | 26.9 | 0 | 0 | 111.9 | S168 R169 E174 E175 F176 | S168-Q172 WeakPolarHBondContact O-CB 3.06Å; S168-Q172 PolarHBondContact O-N 2.99Å; R169-Q172 CarbonylContact O-C 3.4Å; R169-Q172 PolarHBondContact O-N 2.97Å; Q172-E174 PolarHBondContact O-N 2.91Å; Q172-E175 CarbonylContact O-C 3.58Å; Q172-E175 WeakPolarHBondContact O-CA 3.1Å; Q172-E175 PolarHBondContact O-N 2.84Å; Q172-F176 HydrophobicContact CG-CB 4.32Å; Q172-F176 HydrophobicContact CG-CD2 3.54Å; Q172-F176 HydrophobicContact CG-CE2 4.26Å; Q172-F176 HydrophobicContact CG-CG 4.21Å; Q172-F176 WeakPolarHBondContact O-CA 3.31Å; Q172-F176 VanDerWaalsContact O-CB 3.23Å; Q172-F176 WeakPolarHBondContact O-CB 3.2Å; Q172-F176 PolarHBondContact O-N 2.91Å |
| 173 | D | 53.5 | Low | 57.9 | Low | 92 Ų | 92 | 121.5 Ų | 121.5 | 49% | 0.492 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -70.6 | -21.3 | 177.3 | -65.6 | -22.8 | 0 | 0 | 0 | 110.6 | R169 T177 | R169-D173 WeakPolarHBondContact O-CA 3.3Å; R169-D173 WeakPolarHBondContact O-CB 3.19Å; R169-D173 PolarHBondContact O-N 3.5Å; R169-D173 VanDerWaalsContact O-OD2 3.08Å; D173-T177 PolarHBondContact O-OG1 3.5Å |
| 174 | E | 53.3 | Low | 56.2 | Low | 166 Ų | 166 | 119.6 Ų | 119.6 | 78% | 0.776 | 61% | 0.609 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.9 | -23.2 | 165.5 | -68.9 | -171 | 161.7 | 0 | 0 | 113.2 | Q172 | Q172-E174 PolarHBondContact O-N 2.91Š|
| 175 | E | 51 | Low | 55.1 | Low | 148 Ų | 148 | 122.5 Ų | 122.5 | 69% | 0.692 | 63% | 0.625 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -104.3 | -18.1 | -179.6 | -155.2 | 175.6 | 146.5 | 0 | 0 | 113.7 | Q172 | Q172-E175 CarbonylContact O-C 3.58Å; Q172-E175 WeakPolarHBondContact O-CA 3.1Å; Q172-E175 PolarHBondContact O-N 2.84Å |
| 176 | F | 48.7 | Very low | 54 | Low | 102 Ų | 102 | 123 Ų | 123 | 45% | 0.447 | 63% | 0.631 | S | S | . | * | S | Bend | trans | -102.1 | -3.2 | -177.6 | -112.7 | -99.2 | 0 | 0 | 0 | 113.8 | Q172 L178 E179 | Q172-F176 HydrophobicContact CG-CB 4.32Å; Q172-F176 HydrophobicContact CG-CD2 3.54Å; Q172-F176 HydrophobicContact CG-CE2 4.26Å; Q172-F176 HydrophobicContact CG-CG 4.21Å; Q172-F176 WeakPolarHBondContact O-CA 3.31Å; Q172-F176 VanDerWaalsContact O-CB 3.23Å; Q172-F176 WeakPolarHBondContact O-CB 3.2Å; Q172-F176 PolarHBondContact O-N 2.91Å; F176-L178 PolarHBondContact O-N 3.32Å; F176-E179 HydrophobicContact CD1-CB 4.32Å; F176-E179 HydrophobicContact CE1-CB 4.32Å; F176-E179 WeakPolarHBondContact CE2-OE2 3.18Å; F176-E179 WeakPolarHBondContact CZ-OE2 3.15Å |
| 177 | T | 49.6 | Very low | 52.9 | Low | 117 Ų | 117 | 123 Ų | 123 | 72% | 0.718 | 64% | 0.635 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.6 | 3.8 | 164.8 | 37.3 | 0 | 0 | 0 | 0 | 112.9 | D173 | D173-T177 PolarHBondContact O-OG1 3.5Š|
| 178 | L | 49.3 | Very low | 52.2 | Low | 143 Ų | 143 | 123.9 Ų | 123.9 | 75% | 0.749 | 64% | 0.643 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -115.9 | 13.5 | 172.4 | -79.6 | 172.1 | 0 | 0 | 0 | 114.5 | F176 | F176-L178 PolarHBondContact O-N 3.32Š|
| 179 | E | 49.6 | Very low | 51.9 | Low | 126 Ų | 126 | 124.2 Ų | 124.2 | 59% | 0.589 | 65% | 0.645 | S | S | * | * | S | Bend | trans | -119.7 | 36 | -178.9 | -153.2 | -172.2 | 136 | 0 | 0 | 113 | F176 | F176-E179 HydrophobicContact CD1-CB 4.32Å; F176-E179 HydrophobicContact CE1-CB 4.32Å; F176-E179 WeakPolarHBondContact CE2-OE2 3.18Å; F176-E179 WeakPolarHBondContact CZ-OE2 3.15Å |
| 180 | N | 45.3 | Very low | 51.8 | Low | 164 Ų | 164 | 122.3 Ų | 122.3 | 88% | 0.877 | 65% | 0.646 | S | S | * | * | S | Bend | trans | -134.4 | 16.9 | 170.3 | -131.1 | 95.8 | 0 | 0 | 0 | 114.6 | ||
| 181 | S | 42.4 | Very low | 51.9 | Low | 70 Ų | 70 | 119.7 Ų | 119.7 | 49% | 0.49 | 64% | 0.637 | S | S | . | * | S | Bend | trans | -135.9 | 85 | 175.2 | 58.5 | 0 | 0 | 0 | 0 | 111.2 | L183 | S181-L183 PolarHBondContact O-N 2.78Š|
| 182 | N | 47.5 | Very low | 52.5 | Low | 170 Ų | 170 | 119.7 Ų | 119.7 | 91% | 0.909 | 64% | 0.637 | S | S | * | * | trans | 20.8 | 57.2 | 150.4 | -62 | -76.2 | 0 | 0 | 0 | 118.3 | ||||
| 183 | L | 53.3 | Low | 53.2 | Low | 126 Ų | 126 | 120 Ų | 120 | 66% | 0.66 | 64% | 0.638 | S | S | * | * | trans | -121.1 | 138.7 | 179.8 | -112.5 | 72.4 | 0 | 0 | 0 | 112 | S181 | S181-L183 PolarHBondContact O-N 2.78Š| ||
| 184 | P | 51.4 | Low | 54.2 | Low | 101 Ų | 101 | 120.2 Ų | 120.2 | 66% | 0.656 | 64% | 0.64 | S | S | * | * | trans | -75.2 | 142.9 | -162.3 | 29.4 | -33 | 0 | 0 | 0 | 113.3 | K186 M187 | P184-K186 PolarHBondContact O-N 3.33Å; P184-M187 PolarHBondContact O-N 3.47Å | ||
| 185 | D | 56.9 | Low | 55.2 | Low | 148 Ų | 148 | 116.6 Ų | 116.6 | 79% | 0.791 | 63% | 0.626 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -45.7 | -5.1 | -176.2 | -61.4 | -36 | 0 | 0 | 0 | 118 | ||
| 186 | K | 55.4 | Low | 56.5 | Low | 168 Ų | 168 | 116.7 Ų | 116.7 | 73% | 0.73 | 62% | 0.62 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88 | -13.3 | -176.4 | -165.1 | 158.9 | 176.1 | 152 | 0 | 114.1 | P184 L190 | P184-K186 PolarHBondContact O-N 3.33Å; K186-L190 WeakPolarHBondContact O-CD1 3.11Å |
| 187 | M | 52.1 | Low | 58.1 | Low | 131 Ų | 131 | 117.4 Ų | 117.4 | 65% | 0.645 | 62% | 0.623 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.1 | -27.9 | 179.7 | -136.8 | 171.2 | 88.9 | 0 | 0 | 113.4 | P184 S189 L190 S191 | P184-M187 PolarHBondContact O-N 3.47Å; M187-S189 VanDerWaalsContact C-N 3.33Å; M187-S189 PolarHBondContact O-N 3.31Å; M187-L190 PolarHBondContact O-N 2.9Å; M187-S191 PolarHBondContact O-N 3.42Å |
| 188 | L | 55.5 | Low | 59.7 | Low | 134 Ų | 134 | 117.4 Ų | 117.4 | 70% | 0.702 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -65.5 | -33.4 | 176.6 | -75 | 169.2 | 0 | 0 | 0 | 112.8 | L190 S192 | L188-L190 VanDerWaalsContact C-N 3.35Å; L188-S192 PolarHBondContact O-N 3.48Å |
| 189 | S | 52.8 | Low | 61.3 | Low | 75 Ų | 75 | 113.1 Ų | 113.1 | 52% | 0.524 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -73.3 | -27.6 | 177.6 | 73.6 | 0 | 0 | 0 | 0 | 113.2 | M187 | M187-S189 VanDerWaalsContact C-N 3.33Å; M187-S189 PolarHBondContact O-N 3.31Å |
| 190 | L | 57.3 | Low | 63.1 | Low | 105 Ų | 105 | 113 Ų | 113 | 55% | 0.55 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -78 | -40.2 | 179.6 | -73.6 | 161.5 | 0 | 0 | 0 | 111 | K186 M187 L188 S192 E193 D194 | K186-L190 WeakPolarHBondContact O-CD1 3.11Å; M187-L190 PolarHBondContact O-N 2.9Å; L188-L190 VanDerWaalsContact C-N 3.35Å; L190-S192 VanDerWaalsContact C-N 3.31Å; L190-S192 PolarHBondContact O-N 3.35Å; L190-E193 PolarHBondContact O-N 3.28Å; L190-D194 PolarHBondContact O-N 2.75Å |
| 191 | S | 58.3 | Low | 65.1 | Low | 65 Ų | 65 | 108.3 Ų | 108.3 | 46% | 0.455 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -60.8 | -41.9 | 174.2 | -156.6 | 0 | 0 | 0 | 0 | 111.5 | M187 E193 D194 D195 | M187-S191 PolarHBondContact O-N 3.42Å; S191-E193 PolarHBondContact O-N 2.8Å; S191-E193 VanDerWaalsContact O-N 3.16Å; S191-D194 PolarHBondContact O-N 2.97Å; S191-D195 WeakPolarHBondContact O-CB 3.31Å; S191-D195 VanDerWaalsContact O-CG 3.22Å; S191-D195 PolarHBondContact O-N 3.32Å; S191-D195 VanDerWaalsContact O-OD2 3.08Å; S191-D195 PolarHBondContact OG-OD2 2.92Å |
| 192 | S | 64.2 | Low | 67.3 | Low | 74 Ų | 74 | 107 Ų | 107 | 52% | 0.517 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -59.1 | -30.7 | 178.7 | -177 | 0 | 0 | 0 | 0 | 113.6 | L188 L190 R196 | L188-S192 PolarHBondContact O-N 3.48Å; L190-S192 VanDerWaalsContact C-N 3.31Å; L190-S192 PolarHBondContact O-N 3.35Å; S192-R196 VanDerWaalsContact O-CB 3.28Å; S192-R196 WeakPolarHBondContact O-CB 3.01Å; S192-R196 PolarHBondContact O-N 2.8Å |
| 193 | E | 69.1 | Low | 69.3 | Low | 94 Ų | 94 | 105.6 Ų | 105.6 | 44% | 0.439 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -82.4 | -34.9 | -176.8 | -147.9 | 168.6 | 137.7 | 0 | 0 | 112.8 | L190 S191 R196 K197 | L190-E193 PolarHBondContact O-N 3.28Å; S191-E193 PolarHBondContact O-N 2.8Å; S191-E193 VanDerWaalsContact O-N 3.16Å; E193-R196 IonicContact OE1-NH2 3.64Å; E193-K197 WeakPolarHBondContact O-CG 3.31Å; E193-K197 PolarHBondContact O-N 3.41Å |
| 194 | D | 75.4 | Confident | 70.9 | Confident | 97 Ų | 97 | 105.1 Ų | 105.1 | 52% | 0.519 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -74.1 | -37.9 | 172.9 | -71 | -27.9 | 0 | 0 | 0 | 111.1 | L190 S191 R196 K197 L198 | L190-D194 PolarHBondContact O-N 2.75Å; S191-D194 PolarHBondContact O-N 2.97Å; D194-R196 VanDerWaalsContact C-N 3.31Å; D194-R196 PolarHBondContact O-N 3.28Å; D194-K197 PolarHBondContact O-N 2.82Å; D194-K197 IonicContact OD1-NZ 3.95Å; D194-L198 PolarHBondContact O-N 2.94Å |
| 195 | D | 73.8 | Confident | 72.8 | Confident | 90 Ų | 90 | 107.1 Ų | 107.1 | 48% | 0.481 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -64.1 | -36.4 | 172.2 | -68.3 | -31.4 | 0 | 0 | 0 | 111.6 | S191 K197 L198 A199 | S191-D195 WeakPolarHBondContact O-CB 3.31Å; S191-D195 VanDerWaalsContact O-CG 3.22Å; S191-D195 PolarHBondContact O-N 3.32Å; S191-D195 VanDerWaalsContact O-OD2 3.08Å; S191-D195 PolarHBondContact OG-OD2 2.92Å; D195-K197 VanDerWaalsContact C-N 3.35Å; D195-K197 PolarHBondContact O-N 3.39Å; D195-L198 PolarHBondContact O-N 3.45Å; D195-A199 VanDerWaalsContact O-CB 3.25Å; D195-A199 WeakPolarHBondContact O-CB 3.47Å; D195-A199 PolarHBondContact O-N 2.78Å |
| 196 | R | 79 | Confident | 74.5 | Confident | 150 Ų | 150 | 106 Ų | 106 | 57% | 0.566 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -63.1 | -41 | 174.5 | -169 | 177.5 | 74.5 | -145 | -1.4 | 111.6 | S192 E193 D194 Q200 | S192-R196 VanDerWaalsContact O-CB 3.28Å; S192-R196 WeakPolarHBondContact O-CB 3.01Å; S192-R196 PolarHBondContact O-N 2.8Å; E193-R196 IonicContact OE1-NH2 3.64Å; D194-R196 VanDerWaalsContact C-N 3.31Å; D194-R196 PolarHBondContact O-N 3.28Å; R196-Q200 WeakPolarHBondContact O-CB 3.49Å; R196-Q200 PolarHBondContact O-N 2.7Å |
| 197 | K | 82.6 | Confident | 76.2 | Confident | 117 Ų | 117 | 105.2 Ų | 105.2 | 51% | 0.509 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -67.4 | -40.9 | 174.9 | -69.9 | 172.1 | -171 | 160 | 0 | 111.1 | E193 D194 D195 Q200 S201 | E193-K197 WeakPolarHBondContact O-CG 3.31Å; E193-K197 PolarHBondContact O-N 3.41Å; D194-K197 PolarHBondContact O-N 2.82Å; D194-K197 IonicContact OD1-NZ 3.95Å; D195-K197 VanDerWaalsContact C-N 3.35Å; D195-K197 PolarHBondContact O-N 3.39Å; K197-Q200 PolarHBondContact O-N 3.1Å; K197-S201 WeakPolarHBondContact O-CB 3.5Å; K197-S201 PolarHBondContact O-N 2.79Å; K197-S201 PolarHBondContact O-OG 3.41Å |
| 198 | L | 81.8 | Confident | 78.1 | Confident | 117 Ų | 117 | 104.5 Ų | 104.5 | 61% | 0.613 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -64.8 | -47 | 177.8 | -132.3 | 75.5 | 0 | 0 | 0 | 111.1 | D194 D195 Q200 S201 A202 | D194-L198 PolarHBondContact O-N 2.94Å; D195-L198 PolarHBondContact O-N 3.45Å; L198-Q200 VanDerWaalsContact C-N 3.33Å; L198-Q200 PolarHBondContact O-N 3.18Å; L198-S201 WeakPolarHBondContact CA-OG 3.47Å; L198-S201 PolarHBondContact O-N 3.29Å; L198-S201 VanDerWaalsContact O-N 3.13Å; L198-S201 PolarHBondContact O-OG 3.4Å; L198-A202 WeakPolarHBondContact O-CB 3.18Å; L198-A202 PolarHBondContact O-N 3.25Å |
| 199 | A | 84.9 | Confident | 79.7 | Confident | 54 Ų | 54 | 102 Ų | 102 | 45% | 0.446 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -59.1 | -42 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | D195 A202 Q203 | D195-A199 VanDerWaalsContact O-CB 3.25Å; D195-A199 WeakPolarHBondContact O-CB 3.47Å; D195-A199 PolarHBondContact O-N 2.78Å; A199-A202 PolarHBondContact O-N 2.88Å; A199-Q203 WeakPolarHBondContact O-CG 3.1Å; A199-Q203 PolarHBondContact O-N 2.92Å |
| 200 | Q | 87 | Confident | 81.6 | Confident | 124 Ų | 124 | 104 Ų | 104 | 58% | 0.579 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -65.1 | -41.6 | 174.7 | -172.6 | -179.9 | 8 | 0 | 0 | 111.8 | R196 K197 L198 Q203 M204 | R196-Q200 WeakPolarHBondContact O-CB 3.49Å; R196-Q200 PolarHBondContact O-N 2.7Å; K197-Q200 PolarHBondContact O-N 3.1Å; L198-Q200 VanDerWaalsContact C-N 3.33Å; L198-Q200 PolarHBondContact O-N 3.18Å; Q200-Q203 PolarHBondContact O-N 2.79Å; Q200-M204 VanDerWaalsContact O-CG 3.3Å; Q200-M204 WeakPolarHBondContact O-CG 3.24Å; Q200-M204 PolarHBondContact O-N 3.5Å; Q200-M204 VanDerWaalsContact O-N 3.09Å |
| 201 | S | 87.2 | Confident | 83.2 | Confident | 65 Ų | 65 | 104.8 Ų | 104.8 | 46% | 0.455 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -66.2 | -36.8 | 176.8 | 76 | 0 | 0 | 0 | 0 | 112.5 | K197 L198 M204 Y205 | K197-S201 WeakPolarHBondContact O-CB 3.5Å; K197-S201 PolarHBondContact O-N 2.79Å; K197-S201 PolarHBondContact O-OG 3.41Å; L198-S201 WeakPolarHBondContact CA-OG 3.47Å; L198-S201 PolarHBondContact O-N 3.29Å; L198-S201 VanDerWaalsContact O-N 3.13Å; L198-S201 PolarHBondContact O-OG 3.4Å; S201-M204 PolarHBondContact O-N 3.32Å; S201-Y205 WeakPolarHBondContact O-CB 3.47Å; S201-Y205 PolarHBondContact O-N 3.44Å |
| 202 | A | 87.7 | Confident | 84.7 | Confident | 43 Ų | 43 | 108.3 Ų | 108.3 | 36% | 0.355 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -66.9 | -41.7 | 176 | 0 | 0 | 0 | 0 | 0 | 111.7 | L198 A199 M204 Y205 H206 | L198-A202 WeakPolarHBondContact O-CB 3.18Å; L198-A202 PolarHBondContact O-N 3.25Å; A199-A202 PolarHBondContact O-N 2.88Å; A202-M204 VanDerWaalsContact C-N 3.33Å; A202-M204 PolarHBondContact O-N 2.71Å; A202-Y205 PolarHBondContact O-N 2.85Å; A202-H206 PolarHBondContact O-CD2 2.86Å; A202-H206 PolarHBondContact O-N 3.27Å |
| 203 | Q | 88.9 | Confident | 85.9 | Confident | 140 Ų | 140 | 109.8 Ų | 109.8 | 65% | 0.654 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -60.2 | -43.8 | 173.4 | -74.8 | 178.9 | 7.8 | 0 | 0 | 111.8 | A199 Q200 H206 Y207 | A199-Q203 WeakPolarHBondContact O-CG 3.1Å; A199-Q203 PolarHBondContact O-N 2.92Å; Q200-Q203 PolarHBondContact O-N 2.79Å; Q203-H206 PolarHBondContact O-N 3.05Å; Q203-Y207 PolarHBondContact O-N 2.73Å; Q203-Y207 VanDerWaalsContact O-N 3.07Å |
| 204 | M | 87.8 | Confident | 86.4 | Confident | 116 Ų | 116 | 111.1 Ų | 111.1 | 57% | 0.571 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -63.1 | -41.7 | 176.3 | -71.9 | -90.8 | -84.4 | 0 | 0 | 111.6 | Q200 S201 A202 Y207 Q208 | Q200-M204 VanDerWaalsContact O-CG 3.3Å; Q200-M204 WeakPolarHBondContact O-CG 3.24Å; Q200-M204 PolarHBondContact O-N 3.5Å; Q200-M204 VanDerWaalsContact O-N 3.09Å; S201-M204 PolarHBondContact O-N 3.32Å; A202-M204 VanDerWaalsContact C-N 3.33Å; A202-M204 PolarHBondContact O-N 2.71Å; M204-Y207 PolarHBondContact O-N 2.97Å; M204-Q208 WeakPolarHBondContact O-CG 3.16Å; M204-Q208 PolarHBondContact O-N 3.32Å |
| 205 | Y | 92 | Very high | 86.6 | Confident | 142 Ų | 142 | 110.3 Ų | 110.3 | 56% | 0.557 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -61.1 | -47.2 | 176.3 | 177.1 | -99 | 0 | 0 | 0 | 111.8 | S201 A202 Y207 Q208 H209 | S201-Y205 WeakPolarHBondContact O-CB 3.47Å; S201-Y205 PolarHBondContact O-N 3.44Å; A202-Y205 PolarHBondContact O-N 2.85Å; Y205-Y207 VanDerWaalsContact C-N 3.32Å; Y205-Y207 PolarHBondContact O-N 3.28Å; Y205-Q208 PolarHBondContact O-N 3.08Å; Y205-H209 WeakPolarHBondContact O-CB 3.49Å; Y205-H209 PolarHBondContact O-N 3.12Å |
| 206 | H | 91.3 | Very high | 86.8 | Confident | 126 Ų | 126 | 108.5 Ų | 108.5 | 58% | 0.583 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -60 | -41.8 | 177.4 | -73.4 | -57.5 | 0 | 0 | 0 | 112.2 | A202 Q203 H209 Q210 | A202-H206 PolarHBondContact O-CD2 2.86Å; A202-H206 PolarHBondContact O-N 3.27Å; Q203-H206 PolarHBondContact O-N 3.05Å; H206-H209 PolarHBondContact O-N 3.46Å; H206-Q210 WeakPolarHBondContact O-CB 3.19Å; H206-Q210 PolarHBondContact O-N 3.34Å |
| 207 | Y | 91.2 | Very high | 86.7 | Confident | 151 Ų | 151 | 107.2 Ų | 107.2 | 59% | 0.592 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -63.1 | -45.1 | 175.6 | 178.1 | -102.1 | 0 | 0 | 0 | 112.4 | Q203 M204 Y205 H209 Q210 K211 | Q203-Y207 PolarHBondContact O-N 2.73Å; Q203-Y207 VanDerWaalsContact O-N 3.07Å; M204-Y207 PolarHBondContact O-N 2.97Å; Y205-Y207 VanDerWaalsContact C-N 3.32Å; Y205-Y207 PolarHBondContact O-N 3.28Å; Y207-H209 PolarHBondContact O-N 3.21Å; Y207-Q210 PolarHBondContact O-N 3.32Å; Y207-K211 WeakPolarHBondContact O-CB 3.35Å; Y207-K211 PolarHBondContact O-N 2.8Å |
| 208 | Q | 91.7 | Very high | 86.2 | Confident | 115 Ų | 115 | 107 Ų | 107 | 54% | 0.537 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -62.7 | -43.2 | 177.7 | -74.9 | -179.7 | -23.4 | 0 | 0 | 112 | M204 Y205 K211 Q212 | M204-Q208 WeakPolarHBondContact O-CG 3.16Å; M204-Q208 PolarHBondContact O-N 3.32Å; Y205-Q208 PolarHBondContact O-N 3.08Å; Q208-K211 PolarHBondContact O-N 3.05Å; Q208-Q212 WeakPolarHBondContact O-CG 3.43Å; Q208-Q212 PolarHBondContact O-N 2.9Å |
| 209 | H | 90.8 | Very high | 85.3 | Confident | 82 Ų | 82 | 108.2 Ų | 108.2 | 38% | 0.38 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -63.1 | -46.6 | 177.5 | -175.8 | -98.6 | 0 | 0 | 0 | 111.5 | Y205 H206 Y207 K211 Q212 Q213 | Y205-H209 WeakPolarHBondContact O-CB 3.49Å; Y205-H209 PolarHBondContact O-N 3.12Å; H206-H209 PolarHBondContact O-N 3.46Å; Y207-H209 PolarHBondContact O-N 3.21Å; H209-K211 VanDerWaalsContact C-N 3.32Å; H209-K211 PolarHBondContact O-N 3.41Å; H209-Q212 PolarHBondContact O-N 3.41Å; H209-Q213 PolarHBondContact CE1-NE2 3.2Å; H209-Q213 WeakPolarHBondContact O-CG 3.39Å; H209-Q213 PolarHBondContact O-N 3.45Å |
| 210 | Q | 90.9 | Very high | 84.1 | Confident | 116 Ų | 116 | 109.9 Ų | 109.9 | 54% | 0.542 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -61.3 | -40.1 | 175.7 | -172.7 | 178.8 | 13.8 | 0 | 0 | 111.9 | H206 Y207 Q212 Q213 M214 | H206-Q210 WeakPolarHBondContact O-CB 3.19Å; H206-Q210 PolarHBondContact O-N 3.34Å; Y207-Q210 PolarHBondContact O-N 3.32Å; Q210-Q212 PolarHBondContact O-N 2.86Å; Q210-Q213 PolarHBondContact O-N 3.18Å; Q210-M214 PolarHBondContact O-N 2.89Å |
| 211 | K | 92 | Very high | 82.7 | Confident | 122 Ų | 122 | 107.7 Ų | 107.7 | 53% | 0.53 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -62.4 | -41.6 | 176.4 | -172.9 | -178.2 | 178.9 | -176.5 | 0 | 111.8 | Y207 Q208 H209 M214 L215 | Y207-K211 WeakPolarHBondContact O-CB 3.35Å; Y207-K211 PolarHBondContact O-N 2.8Å; Q208-K211 PolarHBondContact O-N 3.05Å; H209-K211 VanDerWaalsContact C-N 3.32Å; H209-K211 PolarHBondContact O-N 3.41Å; K211-M214 PolarHBondContact O-N 3.37Å; K211-L215 WeakPolarHBondContact O-CB 3.21Å; K211-L215 PolarHBondContact O-N 3.48Å |
| 212 | Q | 90 | Very high | 81 | Confident | 139 Ų | 139 | 109 Ų | 109 | 65% | 0.65 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -64.8 | -41.1 | 176.3 | -73.6 | 178.5 | -2.8 | 0 | 0 | 111.8 | Q208 H209 Q210 L215 A216 | Q208-Q212 WeakPolarHBondContact O-CG 3.43Å; Q208-Q212 PolarHBondContact O-N 2.9Å; H209-Q212 PolarHBondContact O-N 3.41Å; Q210-Q212 PolarHBondContact O-N 2.86Å; Q212-L215 PolarHBondContact O-N 3.45Å; Q212-A216 WeakPolarHBondContact O-CB 3.45Å; Q212-A216 PolarHBondContact O-N 3.09Å |
| 213 | Q | 88.3 | Confident | 79.2 | Confident | 105 Ų | 105 | 113.7 Ų | 113.7 | 49% | 0.491 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -61.7 | -43.8 | 174.9 | -70.8 | -176.2 | -15.5 | 0 | 0 | 112 | H209 Q210 A216 L217 | H209-Q213 PolarHBondContact CE1-NE2 3.2Å; H209-Q213 WeakPolarHBondContact O-CG 3.39Å; H209-Q213 PolarHBondContact O-N 3.45Å; Q210-Q213 PolarHBondContact O-N 3.18Å; Q213-A216 PolarHBondContact O-N 2.84Å; Q213-L217 WeakPolarHBondContact O-CB 3.48Å; Q213-L217 PolarHBondContact O-N 2.95Å |
| 214 | M | 80.2 | Confident | 77.4 | Confident | 123 Ų | 123 | 111.5 Ų | 111.5 | 61% | 0.606 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -62.4 | -44.7 | 177.1 | -176.4 | 179.1 | -70.6 | 0 | 0 | 111.7 | Q210 K211 A216 L217 E218 | Q210-M214 PolarHBondContact O-N 2.89Å; K211-M214 PolarHBondContact O-N 3.37Å; M214-A216 VanDerWaalsContact C-N 3.3Å; M214-A216 PolarHBondContact O-N 2.95Å; M214-L217 PolarHBondContact O-N 3.5Å; M214-E218 WeakPolarHBondContact O-CB 3.23Å; M214-E218 PolarHBondContact O-N 2.88Å |
| 215 | L | 80.2 | Confident | 75.4 | Confident | 79 Ų | 79 | 115.7 Ų | 115.7 | 41% | 0.414 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -69.5 | -29.8 | -179.8 | -161.5 | 138.1 | 0 | 0 | 0 | 112.2 | K211 Q212 K219 | K211-L215 WeakPolarHBondContact O-CB 3.21Å; K211-L215 PolarHBondContact O-N 3.48Å; Q212-L215 PolarHBondContact O-N 3.45Å; L215-K219 HydrophobicContact CD2-CD 4.21Å; L215-K219 WeakPolarHBondContact O-CG 3.29Å; L215-K219 PolarHBondContact O-N 3.43Å |
| 216 | A | 77.7 | Confident | 73.2 | Confident | 53 Ų | 53 | 115.3 Ų | 115.3 | 44% | 0.438 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -70 | -43.7 | 170.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | Q212 Q213 M214 K219 V220 | Q212-A216 WeakPolarHBondContact O-CB 3.45Å; Q212-A216 PolarHBondContact O-N 3.09Å; Q213-A216 PolarHBondContact O-N 2.84Å; M214-A216 VanDerWaalsContact C-N 3.3Å; M214-A216 PolarHBondContact O-N 2.95Å; A216-K219 PolarHBondContact O-N 3.07Å; A216-V220 WeakPolarHBondContact O-CG2 3.48Å; A216-V220 PolarHBondContact O-N 3.44Å; A216-V220 VanDerWaalsContact O-N 3.07Å |
| 217 | L | 77 | Confident | 71.1 | Confident | 123 Ų | 123 | 113.4 Ų | 113.4 | 64% | 0.644 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -64.7 | -37.4 | 175.3 | -88.2 | 160 | 0 | 0 | 0 | 112.5 | Q213 M214 V220 N221 | Q213-L217 WeakPolarHBondContact O-CB 3.48Å; Q213-L217 PolarHBondContact O-N 2.95Å; M214-L217 PolarHBondContact O-N 3.5Å; L217-V220 PolarHBondContact O-N 2.71Å; L217-N221 WeakPolarHBondContact O-CB 3.49Å; L217-N221 PolarHBondContact O-N 3.31Å |
| 218 | E | 72 | Confident | 68.8 | Low | 111 Ų | 111 | 113.1 Ų | 113.1 | 52% | 0.519 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -63.5 | -45 | 175.9 | -173.2 | 175.3 | -169.8 | 0 | 0 | 111.1 | M214 V220 N221 D222 | M214-E218 WeakPolarHBondContact O-CB 3.23Å; M214-E218 PolarHBondContact O-N 2.88Å; E218-V220 VanDerWaalsContact C-N 3.31Å; E218-V220 PolarHBondContact O-N 3.16Å; E218-N221 PolarHBondContact O-N 2.96Å; E218-N221 VanDerWaalsContact O-N 3.17Å; E218-D222 PolarHBondContact O-N 3.11Å |
| 219 | K | 62.5 | Low | 66.6 | Low | 144 Ų | 144 | 116.7 Ų | 116.7 | 63% | 0.626 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -62.2 | -36 | 174.4 | -75 | 176.6 | 177 | 179.5 | 0 | 113.1 | L215 A216 H223 | L215-K219 HydrophobicContact CD2-CD 4.21Å; L215-K219 WeakPolarHBondContact O-CG 3.29Å; L215-K219 PolarHBondContact O-N 3.43Å; A216-K219 PolarHBondContact O-N 3.07Å; K219-H223 PolarHBondContact O-N 2.89Å |
| 220 | V | 60.1 | Low | 64.5 | Low | 89 Ų | 89 | 120.1 Ų | 120.1 | 54% | 0.539 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -70.9 | -39.4 | 175.2 | 174.5 | 0 | 0 | 0 | 0 | 110.6 | A216 L217 E218 H223 T224 | A216-V220 WeakPolarHBondContact O-CG2 3.48Å; A216-V220 PolarHBondContact O-N 3.44Å; A216-V220 VanDerWaalsContact O-N 3.07Å; L217-V220 PolarHBondContact O-N 2.71Å; E218-V220 VanDerWaalsContact C-N 3.31Å; E218-V220 PolarHBondContact O-N 3.16Å; V220-H223 PolarHBondContact O-N 3.09Å; V220-T224 WeakPolarHBondContact O-CB 3.02Å; V220-T224 PolarHBondContact O-N 2.85Å; V220-T224 PolarHBondContact O-OG1 3.36Å |
| 221 | N | 57.6 | Low | 62.1 | Low | 78 Ų | 78 | 121.6 Ų | 121.6 | 42% | 0.417 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -69.9 | -34.3 | 179.1 | -175.9 | 63.6 | 0 | 0 | 0 | 112.7 | L217 E218 H223 T224 R225 | L217-N221 WeakPolarHBondContact O-CB 3.49Å; L217-N221 PolarHBondContact O-N 3.31Å; E218-N221 PolarHBondContact O-N 2.96Å; E218-N221 VanDerWaalsContact O-N 3.17Å; N221-H223 VanDerWaalsContact C-N 3.35Å; N221-T224 PolarHBondContact O-N 3.01Å; N221-R225 PolarHBondContact O-N 3Å |
| 222 | D | 52.2 | Low | 60 | Low | 93 Ų | 93 | 120.1 Ų | 120.1 | 50% | 0.497 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -69.5 | -31.4 | 174.2 | -77.8 | -16.3 | 0 | 0 | 0 | 112.4 | E218 I226 | E218-D222 PolarHBondContact O-N 3.11Å; D222-I226 WeakPolarHBondContact O-CD1 3.47Å |
| 223 | H | 49.2 | Very low | 57.9 | Low | 141 Ų | 141 | 121 Ų | 121 | 65% | 0.653 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -81 | -24.6 | 175.1 | -132.4 | 37.4 | 0 | 0 | 0 | 113.5 | K219 V220 N221 R225 S227 | K219-H223 PolarHBondContact O-N 2.89Å; V220-H223 PolarHBondContact O-N 3.09Å; N221-H223 VanDerWaalsContact C-N 3.35Å; H223-R225 VanDerWaalsContact C-N 3.33Å; H223-S227 PolarHBondContact O-OG 3.29Å |
| 224 | T | 50.2 | Low | 56.1 | Low | 93 Ų | 93 | 122.4 Ų | 122.4 | 57% | 0.571 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -78.3 | -17.1 | 179.6 | -51.3 | 0 | 0 | 0 | 0 | 112.6 | V220 N221 | V220-T224 WeakPolarHBondContact O-CB 3.02Å; V220-T224 PolarHBondContact O-N 2.85Å; V220-T224 PolarHBondContact O-OG1 3.36Å; N221-T224 PolarHBondContact O-N 3.01Å |
| 225 | R | 45.9 | Very low | 54.8 | Low | 205 Ų | 205 | 124.3 Ų | 124.3 | 77% | 0.774 | 65% | 0.648 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.7 | -4.1 | 177.5 | -72.1 | -175.8 | 170.4 | -173.5 | -3.2 | 115.1 | N221 H223 | N221-R225 PolarHBondContact O-N 3Å; H223-R225 VanDerWaalsContact C-N 3.33Å |
| 226 | I | 46.8 | Very low | 53.4 | Low | 133 Ų | 133 | 126.3 Ų | 126.3 | 68% | 0.682 | 66% | 0.663 | S | S | * | * | S | Bend | trans | -117.8 | -0.6 | -174.7 | -53.3 | 173.3 | 0 | 0 | 0 | 111.4 | D222 D228 | D222-I226 WeakPolarHBondContact O-CD1 3.47Å; I226-D228 PolarHBondContact O-N 3.01Å |
| 227 | S | 46.3 | Very low | 52.4 | Low | 86 Ų | 86 | 131.3 Ų | 131.3 | 60% | 0.601 | 68% | 0.683 | S | S | * | * | S | Bend | trans | -89.1 | 9 | -171.8 | -66.7 | 0 | 0 | 0 | 0 | 115.9 | H223 | H223-S227 PolarHBondContact O-OG 3.29Š|
| 228 | D | 42.5 | Very low | 51 | Low | 146 Ų | 146 | 132.5 Ų | 132.5 | 78% | 0.781 | 69% | 0.69 | S | S | * | * | S | Bend | trans | -121.4 | 59.2 | 178.7 | -68.2 | -37.8 | 0 | 0 | 0 | 110.6 | I226 | I226-D228 PolarHBondContact O-N 3.01Š|
| 229 | E | 46.2 | Very low | 50.4 | Low | 190 Ų | 190 | 130.2 Ų | 130.2 | 89% | 0.888 | 70% | 0.696 | S | S | * | * | S | Bend | trans | -178 | 119.9 | 156.3 | -101.5 | 154.4 | -154.3 | 0 | 0 | 111.5 | ||
| 230 | D | 45.7 | Very low | 50.1 | Low | 154 Ų | 154 | 130.7 Ų | 130.7 | 82% | 0.824 | 71% | 0.706 | S | S | * | * | trans | 88.1 | 111.1 | 148.6 | -135.1 | 14 | 0 | 0 | 0 | 120.3 | ||||
| 231 | D | 40.6 | Very low | 49.9 | Very low | 146 Ų | 146 | 135.7 Ų | 135.7 | 78% | 0.781 | 72% | 0.72 | S | S | * | * | trans | -88.3 | 111 | 172.8 | -178.9 | 25.3 | 0 | 0 | 0 | 107.4 | ||||
| 232 | S | 48 | Very low | 50.6 | Low | 91 Ų | 91 | 137.9 Ų | 137.9 | 64% | 0.636 | 74% | 0.737 | S | S | * | * | trans | -172.5 | 109.2 | 154.7 | 33.1 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 233 | E | 46.7 | Very low | 51.6 | Low | 159 Ų | 159 | 139.1 Ų | 139.1 | 74% | 0.743 | 75% | 0.748 | S | S | * | * | 42.7 | 131 | 128.4 | -43.7 | -73 | 174.6 | 0 | 0 | 120.7 | |||||
| 234 | D | 49.6 | Very low | 52.7 | Low | 133 Ų | 133 | 141.5 Ų | 141.5 | 71% | 0.711 | 75% | 0.752 | S | S | * | * | trans | 67.6 | 104.1 | 146.9 | -58 | -31.7 | 0 | 0 | 0 | 119.6 | ||||
| 235 | D | 54 | Low | 54 | Low | 163 Ų | 163 | 145.2 Ų | 145.2 | 87% | 0.872 | 76% | 0.763 | S | S | * | * | -178 | 142.4 | 102.2 | -98.3 | -35.7 | 0 | 0 | 0 | 113.3 | |||||
| 236 | V | 50 | Low | 55.1 | Low | 121 Ų | 121 | 140 Ų | 140 | 73% | 0.733 | 76% | 0.757 | S | S | * | * | trans | -66.9 | 134.7 | -173.8 | -174.3 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 237 | D | 56.9 | Low | 56.5 | Low | 159 Ų | 159 | 139 Ų | 139 | 85% | 0.85 | 76% | 0.759 | S | S | * | * | trans | -147.7 | 115.4 | 143.6 | -162.7 | 30.7 | 0 | 0 | 0 | 111.3 | G239 | D237-G239 PolarHBondContact O-N 3.2Š| ||
| 238 | D | 48.7 | Very low | 57.2 | Low | 148 Ų | 148 | 138 Ų | 138 | 79% | 0.791 | 76% | 0.763 | S | S | * | * | trans | -65.7 | 107.8 | 176.3 | -80.4 | -51.3 | 0 | 0 | 0 | 109.9 | ||||
| 239 | G | 59.6 | Low | 58.1 | Low | 63 Ų | 63 | 139.3 Ų | 139.3 | 65% | 0.649 | 77% | 0.769 | S | S | * | * | trans | -132.7 | 77.8 | -178.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | D237 F241 | D237-G239 PolarHBondContact O-N 3.2Å; G239-F241 PolarHBondContact O-N 3.35Å | ||
| 240 | D | 54.8 | Low | 58.8 | Low | 154 Ų | 154 | 134.5 Ų | 134.5 | 82% | 0.824 | 76% | 0.761 | S | S | * | * | trans | 24.9 | 67.4 | 151 | -62.8 | -18.1 | 0 | 0 | 0 | 117.1 | T242 | D240-T242 VanDerWaalsContact C-N 3.29Å; D240-T242 PolarHBondContact O-N 2.98Å | ||
| 241 | F | 57.4 | Low | 59.6 | Low | 193 Ų | 193 | 135.1 Ų | 135.1 | 85% | 0.846 | 76% | 0.764 | S | S | * | * | trans | -77.1 | 87.5 | 169.5 | -157.1 | -95.3 | 0 | 0 | 0 | 109.5 | G239 V243 | G239-F241 PolarHBondContact O-N 3.35Å; F241-V243 PolarHBondContact O-N 3.4Å | ||
| 242 | T | 72 | Confident | 60.5 | Low | 124 Ų | 124 | 134.6 Ų | 134.6 | 76% | 0.761 | 77% | 0.767 | S | S | * | * | trans | -56.8 | 100.9 | 173 | 53.9 | 0 | 0 | 0 | 0 | 110.4 | D240 Y244 | D240-T242 VanDerWaalsContact C-N 3.29Å; D240-T242 PolarHBondContact O-N 2.98Å; T242-Y244 PolarHBondContact O-N 3.17Å; T242-Y244 VanDerWaalsContact O-N 3.1Å | ||
| 243 | V | 71.6 | Confident | 61.6 | Low | 120 Ų | 120 | 132.7 Ų | 132.7 | 73% | 0.727 | 76% | 0.761 | S | S | * | * | trans | -68.7 | 104.5 | 168.6 | 177.5 | 0 | 0 | 0 | 0 | 106.8 | F241 E245 | F241-V243 PolarHBondContact O-N 3.4Å; V243-E245 VanDerWaalsContact C-N 3.31Å; V243-E245 PolarHBondContact O-N 3.42Å | ||
| 244 | Y | 72.7 | Confident | 62.9 | Low | 190 Ų | 190 | 133.5 Ų | 133.5 | 75% | 0.745 | 77% | 0.765 | S | S | * | * | trans | -74.5 | 91.7 | 168.5 | -171.3 | -101 | 0 | 0 | 0 | 108.4 | T242 C246 | T242-Y244 PolarHBondContact O-N 3.17Å; T242-Y244 VanDerWaalsContact O-N 3.1Å; Y244-C246 VanDerWaalsContact CD1-SG 3.57Å; Y244-C246 HydrophobicContact CE1-CB 4.46Å; Y244-C246 VanDerWaalsContact CE1-SG 3.53Å; Y244-C246 PolarHBondContact O-N 2.97Å; Y244-C246 VanDerWaalsContact O-N 3.16Å | ||
| 245 | E | 77 | Confident | 64.1 | Low | 172 Ų | 172 | 134 Ų | 134 | 80% | 0.804 | 77% | 0.766 | S | S | * | * | trans | -73.7 | 100.6 | 170.5 | -163.4 | 171.7 | -162 | 0 | 0 | 108 | V243 P247 | V243-E245 VanDerWaalsContact C-N 3.31Å; V243-E245 PolarHBondContact O-N 3.42Å; E245-P247 WeakPolarHBondContact O-CD 3.36Å | ||
| 246 | C | 69.7 | Low | 65 | Low | 95 Ų | 95 | 133.9 Ų | 133.9 | 64% | 0.642 | 76% | 0.76 | S | S | * | * | trans | -58.6 | 122.1 | 176.9 | -71.4 | 0 | 0 | 0 | 0 | 109.7 | Y244 G248 | Y244-C246 VanDerWaalsContact CD1-SG 3.57Å; Y244-C246 HydrophobicContact CE1-CB 4.46Å; Y244-C246 VanDerWaalsContact CE1-SG 3.53Å; Y244-C246 PolarHBondContact O-N 2.97Å; Y244-C246 VanDerWaalsContact O-N 3.16Å; C246-G248 PolarHBondContact O-N 2.92Å | ||
| 247 | P | 75.6 | Confident | 66.2 | Low | 111 Ų | 111 | 134 Ų | 134 | 72% | 0.721 | 76% | 0.761 | S | S | * | * | trans | -67.3 | 118.2 | 178.8 | 25.4 | -31.3 | 0 | 0 | 0 | 110.4 | E245 | E245-P247 WeakPolarHBondContact O-CD 3.36Š| ||
| 248 | G | 62.4 | Low | 67.1 | Low | 67 Ų | 67 | 132.5 Ų | 132.5 | 69% | 0.691 | 75% | 0.749 | S | S | * | * | trans | 51.4 | 95.6 | 152.1 | 0 | 0 | 0 | 0 | 0 | 116.6 | C246 A250 | C246-G248 PolarHBondContact O-N 2.92Å; G248-A250 PolarHBondContact O-N 3.18Å | ||
| 249 | L | 60.1 | Low | 68.4 | Low | 173 Ų | 173 | 128.8 Ų | 128.8 | 91% | 0.906 | 73% | 0.729 | S | S | * | * | trans | -47.1 | 117.6 | 148.3 | -83.9 | 147.4 | 0 | 0 | 0 | 107.6 | N251 | L249-N251 PolarHBondContact O-N 3.41Š| ||
| 250 | A | 61.1 | Low | 69.4 | Low | 88 Ų | 88 | 131.6 Ų | 131.6 | 73% | 0.727 | 74% | 0.736 | S | S | * | * | trans | -48.2 | 136.3 | 174.9 | 0 | 0 | 0 | 0 | 0 | 109.1 | G248 T252 | G248-A250 PolarHBondContact O-N 3.18Å; A250-T252 PolarHBondContact O-N 2.99Å | ||
| 251 | N | 63.7 | Low | 70.2 | Confident | 167 Ų | 167 | 132.9 Ų | 132.9 | 89% | 0.893 | 74% | 0.735 | S | S | * | * | trans | -40.1 | 116.2 | -179.8 | -84.7 | 6.3 | 0 | 0 | 0 | 110.2 | L249 G253 | L249-N251 PolarHBondContact O-N 3.41Å; N251-G253 PolarHBondContact O-N 3.37Å | ||
| 252 | T | 59.8 | Low | 70.7 | Confident | 136 Ų | 136 | 130.8 Ų | 130.8 | 83% | 0.834 | 73% | 0.725 | S | S | * | * | trans | -70.5 | 68 | 169.9 | -26.7 | 0 | 0 | 0 | 0 | 107.9 | A250 E254 | A250-T252 PolarHBondContact O-N 2.99Å; T252-E254 PolarHBondContact O-N 3.12Å | ||
| 253 | G | 70 | Confident | 70.7 | Confident | 50 Ų | 50 | 131.4 Ų | 131.4 | 52% | 0.515 | 72% | 0.724 | S | S | . | * | trans | -58.3 | 132.9 | 158.6 | 0 | 0 | 0 | 0 | 0 | 106.4 | N251 I255 | N251-G253 PolarHBondContact O-N 3.37Å; G253-I255 VanDerWaalsContact C-N 3.27Å; G253-I255 PolarHBondContact O-N 3.26Å | ||
| 254 | E | 73.3 | Confident | 70.2 | Confident | 177 Ų | 177 | 129.3 Ų | 129.3 | 83% | 0.827 | 72% | 0.715 | S | S | * | * | trans | -41.8 | 88.5 | 172.8 | 56.6 | -157.2 | 165.6 | 0 | 0 | 111.2 | T252 E256 | T252-E254 PolarHBondContact O-N 3.12Å; E254-E256 VanDerWaalsContact C-N 3.28Å; E254-E256 PolarHBondContact O-N 3.1Å; E254-E256 VanDerWaalsContact O-N 3.09Å | ||
| 255 | I | 75.5 | Confident | 69.5 | Low | 143 Ų | 143 | 126.4 Ų | 126.4 | 73% | 0.733 | 71% | 0.712 | S | S | * | * | trans | -85.5 | 84.8 | 175.6 | -169.1 | 164 | 0 | 0 | 0 | 106.1 | G253 V257 | G253-I255 VanDerWaalsContact C-N 3.27Å; G253-I255 PolarHBondContact O-N 3.26Å; I255-V257 HydrophobicContact CG1-CG2 4.29Å; I255-V257 PolarHBondContact O-N 3.3Å | ||
| 256 | E | 73.7 | Confident | 68.5 | Low | 160 Ų | 160 | 125.7 Ų | 125.7 | 75% | 0.748 | 71% | 0.714 | S | S | * | * | trans | -65.2 | 102 | 166 | -69.2 | -176.3 | 166.3 | 0 | 0 | 107.4 | E254 E258 | E254-E256 VanDerWaalsContact C-N 3.28Å; E254-E256 PolarHBondContact O-N 3.1Å; E254-E256 VanDerWaalsContact O-N 3.09Å; E256-E258 PolarHBondContact O-N 2.95Å | ||
| 257 | V | 74 | Confident | 67.4 | Low | 124 Ų | 124 | 128.4 Ų | 128.4 | 75% | 0.752 | 72% | 0.722 | S | S | * | * | trans | -80.6 | 91.6 | 170.2 | -178.3 | 0 | 0 | 0 | 0 | 106.6 | I255 N259 | I255-V257 HydrophobicContact CG1-CG2 4.29Å; I255-V257 PolarHBondContact O-N 3.3Å; V257-N259 PolarHBondContact O-N 3.32Å | ||
| 258 | E | 77.3 | Confident | 66 | Low | 127 Ų | 127 | 132 Ų | 132 | 59% | 0.593 | 73% | 0.726 | S | S | * | * | trans | -69.9 | 126.4 | 168.2 | -71.4 | -155.3 | 149 | 0 | 0 | 109.4 | E256 S264 | E256-E258 PolarHBondContact O-N 2.95Å; E258-S264 VanDerWaalsContact CD-OG 3.29Å; E258-S264 WeakPolarHBondContact OE1-CB 3.4Å; E258-S264 PolarHBondContact OE1-OG 3.42Å | ||
| 259 | N | 75.1 | Confident | 65.2 | Low | 71 Ų | 71 | 137.4 Ų | 137.4 | 38% | 0.38 | 73% | 0.731 | S | S | . | * | trans | -81.2 | 124.5 | 174.1 | 166.5 | 1.8 | 0 | 0 | 0 | 108.2 | V257 F261 F262 | V257-N259 PolarHBondContact O-N 3.32Å; N259-F261 PolarHBondContact O-N 2.92Å; N259-F261 VanDerWaalsContact OD1-CD2 3.32Å; N259-F261 WeakPolarHBondContact OD1-CD2 3.39Å; N259-F261 PolarHBondContact OD1-N 3.39Å; N259-F262 HydrophobicContact CB-CD2 3.8Å; N259-F262 HydrophobicContact CB-CE2 4.2Å; N259-F262 VanDerWaalsContact ND2-CE2 3.27Å; N259-F262 WeakPolarHBondContact ND2-CE2 3.49Å; N259-F262 PolarHBondContact O-N 2.96Å | ||
| 260 | P | 80.1 | Confident | 64.4 | Low | 122 Ų | 122 | 135.6 Ų | 135.6 | 79% | 0.792 | 72% | 0.722 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.2 | -5 | -175.7 | 25.4 | -34.7 | 0 | 0 | 0 | 115 | ||
| 261 | F | 72 | Confident | 63.6 | Low | 181 Ų | 181 | 138.2 Ų | 138.2 | 79% | 0.794 | 72% | 0.724 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.3 | -5.3 | 172 | -69 | -72 | 0 | 0 | 0 | 114.4 | N259 | N259-F261 PolarHBondContact O-N 2.92Å; N259-F261 VanDerWaalsContact OD1-CD2 3.32Å; N259-F261 WeakPolarHBondContact OD1-CD2 3.39Å; N259-F261 PolarHBondContact OD1-N 3.39Å |
| 262 | F | 69 | Low | 62.6 | Low | 148 Ų | 148 | 136.4 Ų | 136.4 | 65% | 0.649 | 71% | 0.714 | S | S | * | * | S | Bend | trans | -112.5 | 108.8 | 175.4 | -61.7 | -73.3 | 0 | 0 | 0 | 109.4 | N259 S264 | N259-F262 HydrophobicContact CB-CD2 3.8Å; N259-F262 HydrophobicContact CB-CE2 4.2Å; N259-F262 VanDerWaalsContact ND2-CE2 3.27Å; N259-F262 WeakPolarHBondContact ND2-CE2 3.49Å; N259-F262 PolarHBondContact O-N 2.96Å; F262-S264 PolarHBondContact O-N 2.76Å; F262-S264 VanDerWaalsContact O-N 3.15Å |
| 263 | D | 70.7 | Confident | 62.2 | Low | 138 Ų | 138 | 138 Ų | 138 | 74% | 0.738 | 72% | 0.717 | S | S | * | * | trans | -66.7 | 111.7 | 167.4 | -64.5 | -43 | 0 | 0 | 0 | 108.4 | D265 | D263-D265 HydrophobicContact CB-CB 4.49Å; D263-D265 PolarHBondContact O-N 3.22Å | ||
| 264 | S | 61.7 | Low | 61.2 | Low | 75 Ų | 75 | 142.2 Ų | 142.2 | 52% | 0.524 | 73% | 0.728 | S | S | . | * | trans | -71.8 | 43.9 | 170.8 | -61.9 | 0 | 0 | 0 | 0 | 111.8 | E258 F262 | E258-S264 VanDerWaalsContact CD-OG 3.29Å; E258-S264 WeakPolarHBondContact OE1-CB 3.4Å; E258-S264 PolarHBondContact OE1-OG 3.42Å; F262-S264 PolarHBondContact O-N 2.76Å; F262-S264 VanDerWaalsContact O-N 3.15Å | ||
| 265 | D | 58.5 | Low | 59.9 | Low | 129 Ų | 129 | 140.7 Ų | 140.7 | 69% | 0.69 | 73% | 0.726 | S | S | * | * | trans | -108.7 | 62.1 | -177.4 | -80.6 | -25.1 | 0 | 0 | 0 | 111 | D263 | D263-D265 HydrophobicContact CB-CB 4.49Å; D263-D265 PolarHBondContact O-N 3.22Å | ||
| 266 | N | 54.4 | Low | 58.6 | Low | 158 Ų | 158 | 140.4 Ų | 140.4 | 85% | 0.845 | 73% | 0.726 | S | S | * | * | S | Bend | trans | -113.9 | 36.7 | 162.9 | -80.1 | -52.9 | 0 | 0 | 0 | 111.6 | ||
| 267 | N | 47.1 | Very low | 57.1 | Low | 151 Ų | 151 | 140.2 Ų | 140.2 | 81% | 0.807 | 73% | 0.73 | S | S | * | * | S | Bend | trans | -166.1 | 66.3 | 161 | -134 | -36.9 | 0 | 0 | 0 | 114.6 | ||
| 268 | K | 46.7 | Very low | 55.5 | Low | 187 Ų | 187 | 138.4 Ų | 138.4 | 81% | 0.813 | 74% | 0.736 | S | S | * | * | trans | -157.8 | 109.5 | 158.4 | -112.9 | 154.1 | -170.7 | 169.8 | 0 | 113.2 | ||||
| 269 | K | 45.8 | Very low | 53.8 | Low | 180 Ų | 180 | 135.7 Ų | 135.7 | 78% | 0.783 | 74% | 0.743 | S | S | * | * | trans | 56.6 | 106 | 140.1 | -86.1 | 174.3 | 167.5 | 174.1 | 0 | 117.9 | ||||
| 270 | N | 42.5 | Very low | 52.6 | Low | 136 Ų | 136 | 141.3 Ų | 141.3 | 73% | 0.727 | 77% | 0.767 | S | S | * | * | 39.3 | 100.3 | 105.5 | -51.8 | -6 | 0 | 0 | 0 | 116.4 | |||||
| 271 | N | 44.1 | Very low | 51.1 | Low | 143 Ų | 143 | 145.3 Ų | 145.3 | 77% | 0.765 | 77% | 0.772 | S | S | * | * | 149.3 | 132.1 | 114.7 | -82.2 | -45.2 | 0 | 0 | 0 | 110.3 | |||||
| 272 | N | 43.8 | Very low | 49.7 | Very low | 129 Ų | 129 | 141 Ų | 141 | 69% | 0.69 | 77% | 0.77 | S | S | * | * | trans | 49.9 | 104.8 | 150.9 | -68.2 | -21.2 | 0 | 0 | 0 | 116.8 | ||||
| 273 | D | 51.2 | Low | 48.8 | Very low | 168 Ų | 168 | 141.3 Ų | 141.3 | 90% | 0.898 | 78% | 0.777 | S | S | * | * | -153.9 | 124.9 | 118.7 | -88.9 | -30.7 | 0 | 0 | 0 | 110.4 | |||||
| 274 | N | 49.3 | Very low | 47.4 | Very low | 140 Ų | 140 | 141.7 Ų | 141.7 | 75% | 0.749 | 78% | 0.779 | S | S | * | * | trans | -77.9 | 129.6 | 177.1 | -62.7 | -56.6 | 0 | 0 | 0 | 109 | ||||
| 275 | N | 46.2 | Very low | 46.8 | Very low | 145 Ų | 145 | 143 Ų | 143 | 78% | 0.775 | 79% | 0.785 | S | S | * | * | trans | 175 | 101 | 131.8 | -88.4 | -27.2 | 0 | 0 | 0 | 112.2 | ||||
| 276 | N | 48.1 | Very low | 46.2 | Very low | 136 Ų | 136 | 142.1 Ų | 142.1 | 73% | 0.727 | 79% | 0.788 | S | S | * | * | 39.1 | 116.8 | 124.8 | -65.2 | -16.4 | 0 | 0 | 0 | 120.9 | |||||
| 277 | N | 42.2 | Very low | 45.4 | Very low | 156 Ų | 156 | 138.5 Ų | 138.5 | 83% | 0.834 | 79% | 0.788 | S | S | * | * | trans | 109.2 | 112 | 130 | -64.2 | -19.8 | 0 | 0 | 0 | 119.4 | ||||
| 278 | G | 40.2 | Very low | 45.3 | Very low | 86 Ų | 86 | 136.8 Ų | 136.8 | 89% | 0.887 | 79% | 0.788 | S | S | * | * | trans | 95.7 | 115.1 | 158 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 279 | G | 40.7 | Very low | 45.6 | Very low | 71 Ų | 71 | 133.1 Ų | 133.1 | 73% | 0.732 | 79% | 0.786 | S | S | * | * | cis | 131.5 | 78.2 | 27.9 | 0 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 280 | E | 51.1 | Low | 45.7 | Very low | 189 Ų | 189 | 128.1 Ų | 128.1 | 88% | 0.883 | 79% | 0.786 | S | S | * | * | trans | 42 | 108.6 | 144.9 | -54.7 | 177.1 | 171.7 | 0 | 0 | 120.1 | ||||
| 281 | K | 47.5 | Very low | 46 | Very low | 205 Ų | 205 | 130.3 Ų | 130.3 | 89% | 0.891 | 79% | 0.792 | S | S | * | * | -178.5 | 97.2 | 115.4 | -100.7 | -172.4 | -173.2 | -166.7 | 0 | 110.3 | |||||
| 282 | A | 43.4 | Very low | 46.2 | Very low | 92 Ų | 92 | 131.6 Ų | 131.6 | 76% | 0.76 | 80% | 0.798 | S | S | * | * | trans | -78.8 | 123.4 | 158.2 | 0 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 283 | L | 49.4 | Very low | 46.4 | Very low | 154 Ų | 154 | 132.6 Ų | 132.6 | 81% | 0.806 | 80% | 0.802 | S | S | * | * | trans | -107.8 | 94.3 | 162.2 | -147.8 | 88.3 | 0 | 0 | 0 | 107.3 | T285 | L283-T285 HydrophobicContact CD2-CG2 4.24Å; L283-T285 HydrophobicContact CG-CG2 4.35Å | ||
| 284 | N | 41.2 | Very low | 45.9 | Very low | 145 Ų | 145 | 127.5 Ų | 127.5 | 78% | 0.775 | 79% | 0.788 | S | S | * | * | trans | -88.6 | 103 | 166.8 | 50.6 | -13.1 | 0 | 0 | 0 | 108 | ||||
| 285 | T | 48.7 | Very low | 45.7 | Very low | 104 Ų | 104 | 127.2 Ų | 127.2 | 64% | 0.638 | 80% | 0.796 | S | S | * | * | trans | -118.2 | 101.9 | 164.7 | 58.4 | 0 | 0 | 0 | 0 | 108.2 | L283 | L283-T285 HydrophobicContact CD2-CG2 4.24Å; L283-T285 HydrophobicContact CG-CG2 4.35Å | ||
| 286 | S | 46.2 | Very low | 45.9 | Very low | 110 Ų | 110 | 125.1 Ų | 125.1 | 77% | 0.769 | 79% | 0.793 | S | S | * | * | trans | 20.5 | 110.6 | 133.8 | 48.4 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 287 | G | 37.1 | Very low | 46 | Very low | 82 Ų | 82 | 126.6 Ų | 126.6 | 85% | 0.845 | 80% | 0.8 | S | S | * | * | 68.4 | 64.4 | 74.1 | 0 | 0 | 0 | 0 | 0 | 110.2 | |||||
| 288 | S | 46.2 | Very low | 46.3 | Very low | 115 Ų | 115 | 127.2 Ų | 127.2 | 80% | 0.804 | 80% | 0.803 | S | S | * | * | trans | -106.6 | 101.6 | 169.9 | -171.8 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 289 | S | 51.9 | Low | 46.7 | Very low | 109 Ų | 109 | 131 Ų | 131 | 76% | 0.762 | 80% | 0.803 | S | S | * | * | trans | -41.2 | 131.4 | 168.5 | 35.1 | 0 | 0 | 0 | 0 | 112.5 | E291 | S289-E291 PolarHBondContact O-N 2.77Š| ||
| 290 | G | 47.9 | Very low | 47.2 | Very low | 76 Ų | 76 | 136.1 Ų | 136.1 | 78% | 0.784 | 81% | 0.808 | S | S | * | * | trans | -63.7 | 119.1 | 168.4 | 0 | 0 | 0 | 0 | 0 | 110.2 | L292 | G290-L292 PolarHBondContact O-N 3.46Š| ||
| 291 | E | 50.4 | Low | 47 | Very low | 181 Ų | 181 | 134.8 Ų | 134.8 | 85% | 0.846 | 80% | 0.801 | S | S | * | * | trans | -81.1 | 109.7 | 168.8 | -165 | 172.2 | 161.5 | 0 | 0 | 107.7 | S289 I293 | S289-E291 PolarHBondContact O-N 2.77Å; E291-I293 PolarHBondContact O-N 3.21Å | ||
| 292 | L | 48.5 | Very low | 46.8 | Very low | 171 Ų | 171 | 133.4 Ų | 133.4 | 90% | 0.895 | 80% | 0.802 | S | S | * | * | trans | -65.8 | 97.1 | 167.5 | -73.9 | 162.7 | 0 | 0 | 0 | 107.7 | G290 G294 | G290-L292 PolarHBondContact O-N 3.46Å; L292-G294 PolarHBondContact O-N 3.27Å; L292-G294 VanDerWaalsContact O-N 3.14Å | ||
| 293 | I | 47.5 | Very low | 46.8 | Very low | 150 Ų | 150 | 135.5 Ų | 135.5 | 77% | 0.769 | 80% | 0.798 | S | S | * | * | trans | -71.3 | 107.1 | 165 | -62.9 | 174.9 | 0 | 0 | 0 | 106.4 | E291 | E291-I293 PolarHBondContact O-N 3.21Š| ||
| 294 | G | 40.1 | Very low | 46.3 | Very low | 60 Ų | 60 | 134.9 Ų | 134.9 | 62% | 0.619 | 80% | 0.796 | S | S | * | * | trans | -61.2 | 135.3 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | L292 S296 | L292-G294 PolarHBondContact O-N 3.27Å; L292-G294 VanDerWaalsContact O-N 3.14Å; G294-S296 VanDerWaalsContact C-N 3.34Å; G294-S296 PolarHBondContact O-N 3.26Å | ||
| 295 | C | 45 | Very low | 46.2 | Very low | 135 Ų | 135 | 134.3 Ų | 134.3 | 91% | 0.912 | 80% | 0.802 | S | S | * | * | S | Bend | trans | -71.1 | 85.2 | 173.9 | -58.2 | 0 | 0 | 0 | 0 | 109.8 | ||
| 296 | S | 50.1 | Low | 46.2 | Very low | 101 Ų | 101 | 135.9 Ų | 135.9 | 71% | 0.706 | 81% | 0.811 | S | S | * | * | trans | -157.3 | 73.5 | 170.9 | -59.7 | 0 | 0 | 0 | 0 | 109 | G294 | G294-S296 VanDerWaalsContact C-N 3.34Å; G294-S296 PolarHBondContact O-N 3.26Å | ||
| 297 | D | 51.7 | Low | 45.8 | Very low | 166 Ų | 166 | 136.8 Ų | 136.8 | 89% | 0.888 | 81% | 0.808 | S | S | * | * | trans | -167.6 | 19.6 | 169.5 | -92.4 | -23.8 | 0 | 0 | 0 | 114.5 | ||||
| 298 | L | 48.1 | Very low | 46 | Very low | 170 Ų | 170 | 140.8 Ų | 140.8 | 89% | 0.89 | 81% | 0.81 | S | S | * | * | trans | -128.6 | 57.4 | 179.9 | -76.7 | 168.2 | 0 | 0 | 0 | 112.4 | ||||
| 299 | D | 47.3 | Very low | 45.5 | Very low | 165 Ų | 165 | 139 Ų | 139 | 88% | 0.882 | 81% | 0.81 | S | S | * | * | trans | -108.8 | 74.3 | 162 | -79.2 | -38.3 | 0 | 0 | 0 | 109.4 | ||||
| 300 | E | 51.3 | Low | 44.9 | Very low | 178 Ų | 178 | 142.1 Ų | 142.1 | 83% | 0.832 | 81% | 0.81 | S | S | * | * | S | Bend | trans | -169.7 | 138.5 | 155 | -121.7 | 174 | 166 | 0 | 0 | 109.2 | ||
| 301 | H | 47.1 | Very low | 44.5 | Very low | 162 Ų | 162 | 142.1 Ų | 142.1 | 75% | 0.75 | 80% | 0.802 | S | S | * | * | trans | 86.1 | 46.6 | -176.3 | -72.9 | -81.1 | 0 | 0 | 0 | 118.7 | I303 | H301-I303 VanDerWaalsContact C-N 3.34Š| ||
| 302 | I | 43.9 | Very low | 44 | Very low | 176 Ų | 176 | 139.9 Ų | 139.9 | 90% | 0.903 | 80% | 0.796 | S | S | * | * | trans | -97.6 | 64.5 | 146.3 | -53.4 | 179.6 | 0 | 0 | 0 | 108.6 | ||||
| 303 | I | 43 | Very low | 43.8 | Very low | 135 Ų | 135 | 138.3 Ų | 138.3 | 69% | 0.692 | 79% | 0.788 | S | S | * | * | trans | -147.9 | 109.6 | 162.7 | -53.2 | 178.8 | 0 | 0 | 0 | 103.4 | H301 | H301-I303 VanDerWaalsContact C-N 3.34Š| ||
| 304 | D | 38.9 | Very low | 43.4 | Very low | 142 Ų | 142 | 141.1 Ų | 141.1 | 76% | 0.759 | 80% | 0.795 | S | S | * | * | S | Bend | trans | 157.1 | 10.6 | 156 | -78.2 | -10.9 | 0 | 0 | 0 | 116.5 | ||
| 305 | C | 40.3 | Very low | 43.5 | Very low | 133 Ų | 133 | 143 Ų | 143 | 90% | 0.899 | 80% | 0.799 | S | S | * | * | trans | -109 | 7.6 | -180 | -64.2 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 306 | V | 47.2 | Very low | 43.1 | Very low | 137 Ų | 137 | 144 Ų | 144 | 83% | 0.83 | 80% | 0.795 | S | S | * | * | S | Bend | trans | -85.6 | -11.2 | -178.5 | 173.8 | 0 | 0 | 0 | 0 | 113.7 | ||
| 307 | N | 39.5 | Very low | 42.5 | Very low | 129 Ų | 129 | 147.5 Ų | 147.5 | 69% | 0.69 | 81% | 0.805 | S | S | * | * | S | Bend | trans | -126.9 | 96.3 | -176.7 | -62.6 | -43.7 | 0 | 0 | 0 | 109.5 | ||
| 308 | N | 41.4 | Very low | 41.7 | Very low | 166 Ų | 166 | 145.8 Ų | 145.8 | 89% | 0.888 | 80% | 0.801 | S | S | * | * | trans | 167.9 | 100.7 | 139.3 | -78.3 | -28.2 | 0 | 0 | 0 | 112 | ||||
| 309 | G | 33.9 | Very low | 41.2 | Very low | 78 Ų | 78 | 143.9 Ų | 143.9 | 80% | 0.804 | 80% | 0.796 | S | S | * | * | trans | 36.9 | 102.9 | 140.2 | 0 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 310 | F | 39.1 | Very low | 40.6 | Very low | 174 Ų | 174 | 143.2 Ų | 143.2 | 76% | 0.763 | 79% | 0.793 | S | S | * | * | trans | -141.1 | 59.3 | 147 | -154.3 | -96.2 | 0 | 0 | 0 | 110.2 | ||||
| 311 | A | 40.1 | Very low | 39.8 | Very low | 76 Ų | 76 | 140.4 Ų | 140.4 | 63% | 0.628 | 79% | 0.788 | S | S | * | * | trans | -79.6 | 143.8 | 131.6 | 0 | 0 | 0 | 0 | 0 | 103.4 | ||||
| 312 | D | 39.3 | Very low | 39.2 | Very low | 134 Ų | 134 | 138.9 Ų | 138.9 | 72% | 0.717 | 79% | 0.79 | S | S | * | * | cis | -169.5 | 105.9 | 36.5 | 2.9 | -75.5 | 0 | 0 | 0 | 104.1 | ||||
| 313 | D | 45.1 | Very low | 38.9 | Very low | 137 Ų | 137 | 137.3 Ų | 137.3 | 73% | 0.733 | 79% | 0.789 | S | S | * | * | trans | -161.6 | 21.4 | 175.3 | -103 | -20.3 | 0 | 0 | 0 | 115 | ||||
| 314 | F | 39.8 | Very low | 38.7 | Very low | 210 Ų | 210 | 136.1 Ų | 136.1 | 92% | 0.921 | 79% | 0.793 | S | S | * | * | trans | -115.1 | 68.7 | 173.1 | -86.7 | -85.6 | 0 | 0 | 0 | 111 | ||||
| 315 | S | 41.3 | Very low | 38.7 | Very low | 100 Ų | 100 | 133.1 Ų | 133.1 | 70% | 0.699 | 80% | 0.796 | S | S | * | * | trans | -139.3 | 37.7 | 175 | 61.7 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 316 | N | 37.2 | Very low | 38.3 | Very low | 154 Ų | 154 | 135.5 Ų | 135.5 | 82% | 0.824 | 79% | 0.793 | S | S | * | * | trans | -154.7 | 67.6 | 169.3 | -82.6 | -46.6 | 0 | 0 | 0 | 111.7 | ||||
| 317 | L | 37.1 | Very low | 37.8 | Very low | 176 Ų | 176 | 133.7 Ų | 133.7 | 92% | 0.921 | 79% | 0.793 | S | S | * | * | trans | -150.5 | 82.5 | 154.2 | -151.5 | 64.5 | 0 | 0 | 0 | 110 | ||||
| 318 | T | 35.4 | Very low | 37.5 | Very low | 130 Ų | 130 | 132.6 Ų | 132.6 | 80% | 0.798 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -67.6 | 136.4 | 172.9 | -63 | 0 | 0 | 0 | 0 | 110.5 | ||
| 319 | T | 36.5 | Very low | 37.1 | Very low | 129 Ų | 129 | 132.4 Ų | 132.4 | 79% | 0.791 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -59.4 | 136.4 | -176.8 | 30.7 | 0 | 0 | 0 | 0 | 115.3 | ||
| 320 | N | 36.3 | Very low | 37.2 | Very low | 151 Ų | 151 | 134.1 Ų | 134.1 | 81% | 0.807 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -101 | 123.2 | 161.7 | -81.6 | -16.5 | 0 | 0 | 0 | 110.5 | ||
| 321 | T | 33.7 | Very low | 37 | Very low | 120 Ų | 120 | 132.6 Ų | 132.6 | 74% | 0.736 | 79% | 0.79 | S | S | * | * | trans | 67 | 103.5 | 137.4 | 62 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 322 | T | 33.5 | Very low | 37.1 | Very low | 129 Ų | 129 | 134.6 Ų | 134.6 | 79% | 0.791 | 79% | 0.794 | S | S | * | * | 54.8 | 106.1 | 117.1 | -42.9 | 0 | 0 | 0 | 0 | 119.7 | |||||
| 323 | T | 38.4 | Very low | 37 | Very low | 144 Ų | 144 | 133.9 Ų | 133.9 | 88% | 0.883 | 80% | 0.795 | S | S | * | * | trans | -137.3 | 113.6 | 143.7 | -55.5 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 324 | S | 38.3 | Very low | 36.6 | Very low | 109 Ų | 109 | 133 Ų | 133 | 76% | 0.762 | 79% | 0.794 | S | S | * | * | trans | -70.7 | 140.1 | 164.6 | 51.5 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 325 | G | 39.7 | Very low | 36.4 | Very low | 80 Ų | 80 | 128.4 Ų | 128.4 | 83% | 0.825 | 78% | 0.784 | S | S | * | * | trans | 160.8 | 79.3 | 170.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 326 | E | 32.3 | Very low | 36.3 | Very low | 182 Ų | 182 | 130 Ų | 130 | 85% | 0.85 | 79% | 0.789 | S | S | * | * | trans | -60.6 | 129.3 | 176.4 | -172.8 | -178 | 163.5 | 0 | 0 | 113.2 | ||||
| 327 | A | 35.2 | Very low | 36.3 | Very low | 99 Ų | 99 | 128.7 Ų | 128.7 | 82% | 0.818 | 79% | 0.787 | S | S | * | * | trans | -155.2 | 88.2 | 155.3 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 328 | T | 34.3 | Very low | 36.5 | Very low | 107 Ų | 107 | 126.1 Ų | 126.1 | 66% | 0.656 | 78% | 0.78 | S | S | * | * | trans | -52.4 | 129.9 | 163.5 | -57.3 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 329 | L | 33.1 | Very low | 36.6 | Very low | 161 Ų | 161 | 125.8 Ų | 125.8 | 84% | 0.843 | 78% | 0.779 | S | S | * | * | -169.6 | 125.3 | 119.5 | -115.6 | 98 | 0 | 0 | 0 | 112.4 | |||||
| 330 | T | 34.6 | Very low | 36.9 | Very low | 114 Ų | 114 | 124.5 Ų | 124.5 | 70% | 0.699 | 77% | 0.772 | S | S | * | * | trans | -38.7 | 126.5 | 170.1 | -40.5 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 331 | T | 36.3 | Very low | 37 | Very low | 143 Ų | 143 | 125 Ų | 125 | 88% | 0.877 | 77% | 0.773 | S | S | * | * | trans | -101.9 | 106.9 | 162.3 | -61 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 332 | T | 41.6 | Very low | 37.1 | Very low | 117 Ų | 117 | 128.1 Ų | 128.1 | 72% | 0.718 | 78% | 0.779 | S | S | * | * | trans | -108.3 | 133.6 | 166.6 | -53.5 | 0 | 0 | 0 | 0 | 109 | ||||
| 333 | T | 38.1 | Very low | 37.5 | Very low | 119 Ų | 119 | 127 Ų | 127 | 73% | 0.73 | 78% | 0.777 | S | S | * | * | trans | -44 | 146.7 | 176.1 | 3.9 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 334 | T | 35.6 | Very low | 37.9 | Very low | 118 Ų | 118 | 127.1 Ų | 127.1 | 72% | 0.724 | 77% | 0.767 | S | S | * | * | trans | 89.5 | 107.7 | 133.1 | -54.4 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 335 | T | 35.7 | Very low | 38.1 | Very low | 115 Ų | 115 | 129.9 Ų | 129.9 | 71% | 0.706 | 77% | 0.766 | S | S | * | * | 95.3 | 128.7 | 127.5 | -64.1 | 0 | 0 | 0 | 0 | 121.7 | |||||
| 336 | T | 38.8 | Very low | 38.4 | Very low | 133 Ų | 133 | 130.5 Ų | 130.5 | 82% | 0.816 | 76% | 0.758 | S | S | * | * | trans | 81.2 | 106.8 | 154.7 | 16.6 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 337 | V | 38.4 | Very low | 39.1 | Very low | 126 Ų | 126 | 131.1 Ų | 131.1 | 76% | 0.764 | 76% | 0.76 | S | S | * | * | trans | -52.1 | 148 | 150.7 | -177.9 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 338 | P | 40 | Very low | 39.6 | Very low | 122 Ų | 122 | 131.3 Ų | 131.3 | 79% | 0.792 | 76% | 0.762 | S | S | * | * | -152 | 158.4 | 57.3 | 38 | -14.3 | 0 | 0 | 0 | 120 | |||||
| 339 | T | 39.1 | Very low | 40.3 | Very low | 124 Ų | 124 | 130.9 Ų | 130.9 | 76% | 0.761 | 77% | 0.77 | S | S | * | * | trans | -69.8 | -178.9 | 158.6 | -1.1 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 340 | P | 41 | Very low | 41.3 | Very low | 102 Ų | 102 | 128.7 Ų | 128.7 | 66% | 0.662 | 77% | 0.768 | S | S | * | * | cis | -131.1 | -173.4 | -22.2 | 28.3 | -5.3 | 0 | 0 | 0 | 111.9 | ||||
| 341 | I | 40.3 | Very low | 41.9 | Very low | 161 Ų | 161 | 136.2 Ų | 136.2 | 83% | 0.826 | 79% | 0.791 | S | S | * | * | trans | 156.2 | 141 | 130.7 | -73.2 | 154.4 | 0 | 0 | 0 | 111.4 | ||||
| 342 | Q | 35.8 | Very low | 42.2 | Very low | 185 Ų | 185 | 135.9 Ų | 135.9 | 86% | 0.864 | 79% | 0.786 | S | S | * | * | trans | -57.6 | 157.2 | -175.2 | -50.2 | -180 | 12.9 | 0 | 0 | 116.2 | ||||
| 343 | S | 41.1 | Very low | 42.2 | Very low | 106 Ų | 106 | 136.8 Ų | 136.8 | 74% | 0.741 | 79% | 0.79 | S | S | * | * | trans | 157.6 | 101 | 140.5 | 176.2 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 344 | E | 45.7 | Very low | 42.5 | Very low | 146 Ų | 146 | 137.8 Ų | 137.8 | 68% | 0.682 | 79% | 0.793 | S | S | * | * | 88.6 | 122.7 | 91.8 | -147.9 | -168.7 | 136.5 | 0 | 0 | 113.9 | |||||
| 345 | K | 44.3 | Very low | 42.9 | Very low | 167 Ų | 167 | 139 Ų | 139 | 73% | 0.726 | 80% | 0.797 | S | S | * | * | trans | 86.4 | 124.4 | 142.4 | -104.1 | -177.4 | -171.7 | 132.5 | 0 | 123.2 | ||||
| 346 | S | 45.2 | Very low | 43.3 | Very low | 94 Ų | 94 | 140.5 Ų | 140.5 | 66% | 0.657 | 80% | 0.803 | S | S | * | * | 99.2 | 96.5 | 127.1 | -68.6 | 0 | 0 | 0 | 0 | 119.9 | |||||
| 347 | Q | 47 | Very low | 43.6 | Very low | 194 Ų | 194 | 141 Ų | 141 | 91% | 0.907 | 80% | 0.802 | S | S | * | * | 28.6 | 131 | 119.7 | -75.8 | -179.1 | -9.7 | 0 | 0 | 121 | |||||
| 348 | A | 45.2 | Very low | 44 | Very low | 104 Ų | 104 | 142.1 Ų | 142.1 | 86% | 0.86 | 81% | 0.805 | S | S | * | * | trans | 143.5 | 136.4 | 135.9 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 349 | A | 49.9 | Very low | 44.3 | Very low | 98 Ų | 98 | 143.6 Ų | 143.6 | 81% | 0.81 | 81% | 0.806 | S | S | * | * | cis | -171.5 | 169 | 3.3 | 0 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 350 | S | 53.3 | Low | 44.7 | Very low | 114 Ų | 114 | 145.3 Ų | 145.3 | 80% | 0.797 | 81% | 0.81 | S | S | * | * | trans | 94.7 | 84.6 | 153.4 | -152.7 | 0 | 0 | 0 | 0 | 119 | ||||
| 351 | K | 47.9 | Very low | 45.1 | Very low | 272 Ų | 272 | 149.2 Ų | 149.2 | 100% | 1.183 | 82% | 0.823 | S | S | * | * | -172.2 | 0 | 96.6 | -105.8 | -178.5 | -179 | 179.4 | 0 | 111.5 |
Retrieved 351 of 351 residues in 48.6 ms
(Link to these results)