| 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 | 64.2 | Low | 92.7 | Very high | 202 Ų | 202 | 79.4 Ų | 79.4 | 100% | 0.995 | 42% | 0.421 | S | S | * | . | 0 | 105.2 | 0 | -63.9 | -51.6 | -167.4 | 0 | 0 | 109.2 | L3 | M1-L3 PolarHBondContact O-N 3.46Š| |||
| 2 | D | 86.2 | Confident | 93.1 | Very high | 153 Ų | 153 | 74.6 Ų | 74.6 | 82% | 0.818 | 40% | 0.395 | S | S | * | . | trans | -96.6 | 75.2 | 176.8 | -169.1 | 21.6 | 0 | 0 | 0 | 109 | ||||
| 3 | L | 94.4 | Very high | 93.4 | Very high | 47 Ų | 47 | 77.6 Ų | 77.6 | 25% | 0.246 | 41% | 0.406 | C | S | . | . | trans | -82.1 | 132.3 | 177.2 | -63.9 | 177 | 0 | 0 | 0 | 108.6 | M1 C5 K6 Q45 | M1-L3 PolarHBondContact O-N 3.46Å; L3-C5 PolarHBondContact O-N 3.13Å; L3-K6 HydrophobicContact CB-CB 4.15Å; L3-K6 VanDerWaalsContact O-CB 3.31Å; L3-K6 WeakPolarHBondContact O-CB 3.39Å; L3-K6 PolarHBondContact O-N 2.85Å; L3-Q45 HydrophobicContact CB-CG 4.33Å; L3-Q45 HydrophobicContact CD1-CB 4.45Å; L3-Q45 HydrophobicContact CD1-CG 4.48Å; L3-Q45 HydrophobicContact CD2-CG 4.32Å | ||
| 4 | P | 96.2 | Very high | 93.8 | Very high | 42 Ų | 42 | 75.9 Ų | 75.9 | 27% | 0.273 | 40% | 0.404 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -60.1 | -30.5 | -167 | 21 | -32.8 | 0 | 0 | 0 | 113.9 | F40 I43 | P4-F40 HydrophobicContact CB-CD1 4.17Å; P4-F40 HydrophobicContact CB-CD2 3.74Å; P4-F40 HydrophobicContact CB-CE1 4.15Å; P4-F40 HydrophobicContact CB-CE2 3.72Å; P4-F40 HydrophobicContact CB-CG 3.97Å; P4-F40 HydrophobicContact CB-CZ 3.92Å; P4-F40 HydrophobicContact CG-CB 3.99Å; P4-F40 HydrophobicContact CG-CD1 3.94Å; P4-F40 HydrophobicContact CG-CD2 3.92Å; P4-F40 HydrophobicContact CG-CE1 4.38Å; P4-F40 HydrophobicContact CG-CE2 4.37Å; P4-F40 HydrophobicContact CG-CG 3.68Å; P4-I43 HydrophobicContact CG-CD1 4.2Å |
| 5 | C | 96.8 | Very high | 94.1 | Very high | 0 Ų | 0 | 71 Ų | 71 | 0% | 0 | 38% | 0.378 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -98.1 | -3.5 | -179.2 | -47.6 | 0 | 0 | 0 | 0 | 114.1 | L3 L8 A9 L33 C36 Q45 | L3-C5 PolarHBondContact O-N 3.13Å; C5-L8 PolarHBondContact O-N 3.33Å; C5-L8 VanDerWaalsContact O-N 3.15Å; C5-A9 PolarHBondContact O-N 3.35Å; C5-A9 VanDerWaalsContact O-N 3.07Å; C5-L33 HydrophobicContact CB-CD1 3.75Å; C5-C36 WeakPolarHBondContact CA-SG 3.43Å; C5-C36 HydrophobicContact CB-CB 3.89Å; C5-C36 WeakPolarHBondContact CB-SG 3.12Å; C5-C36 WeakPolarHBondContact SG-CB 3.31Å; C5-C36 CovalentContact SG-SG 2.04Å; C5-C36 PolarHBondContact SG-SG 3.07Å; C5-Q45 PolarHBondContact SG-NE2 2.9Å; C5-Q45 VanDerWaalsContact SG-NE2 3.43Å; C5-Q45 PolarHBondContact SG-OE1 3Å; C5-Q45 VanDerWaalsContact SG-OE1 3.39Å |
| 6 | K | 95.6 | Very high | 94.4 | Very high | 112 Ų | 112 | 68.3 Ų | 68.3 | 49% | 0.487 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -57.2 | -44.1 | 176.8 | 177.5 | -175.9 | 178.1 | -171.9 | 0 | 112.4 | L3 L8 A9 C10 | L3-K6 HydrophobicContact CB-CB 4.15Å; L3-K6 VanDerWaalsContact O-CB 3.31Å; L3-K6 WeakPolarHBondContact O-CB 3.39Å; L3-K6 PolarHBondContact O-N 2.85Å; K6-L8 PolarHBondContact O-N 2.78Å; K6-A9 PolarHBondContact O-N 2.88Å; K6-C10 PolarHBondContact O-N 3.31Å; K6-C10 PolarHBondContact O-SG 2.93Å; K6-C10 VanDerWaalsContact O-SG 3.41Å |
| 7 | P | 97.3 | Very high | 94.6 | Very high | 69 Ų | 69 | 70.9 Ų | 70.9 | 45% | 0.448 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -59.8 | -33.6 | 178 | -24.8 | 35.5 | 0 | 0 | 0 | 113.2 | C10 K11 | P7-C10 PolarHBondContact O-N 3.36Å; P7-K11 WeakPolarHBondContact O-CG 3.21Å; P7-K11 PolarHBondContact O-N 3.18Å; P7-K11 VanDerWaalsContact O-N 3.1Å |
| 8 | L | 97.6 | Very high | 94.8 | Very high | 36 Ų | 36 | 76.1 Ų | 76.1 | 19% | 0.188 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -73.8 | -40.8 | 178.8 | -60.9 | 174.6 | 0 | 0 | 0 | 111.6 | C5 K6 C10 K11 I12 S32 L33 C36 | C5-L8 PolarHBondContact O-N 3.33Å; C5-L8 VanDerWaalsContact O-N 3.15Å; K6-L8 PolarHBondContact O-N 2.78Å; L8-C10 VanDerWaalsContact C-N 3.28Å; L8-C10 PolarHBondContact O-N 3.38Å; L8-K11 HydrophobicContact CD2-CD 4.2Å; L8-K11 WeakPolarHBondContact O-CB 3.28Å; L8-K11 PolarHBondContact O-N 2.89Å; L8-I12 PolarHBondContact O-N 3.2Å; L8-I12 VanDerWaalsContact O-N 3.14Å; L8-S32 WeakPolarHBondContact CD1-O 3.43Å; L8-L33 HydrophobicContact CB-CB 4.37Å; L8-L33 HydrophobicContact CB-CD1 4.13Å; L8-C36 HydrophobicContact CD1-CB 3.34Å |
| 9 | A | 96.2 | Very high | 95 | Very high | 25 Ų | 25 | 74.2 Ų | 74.2 | 21% | 0.207 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -58.8 | -40.9 | 172 | 0 | 0 | 0 | 0 | 0 | 111.7 | C5 K6 K11 I12 Q13 L33 C47 | C5-A9 PolarHBondContact O-N 3.35Å; C5-A9 VanDerWaalsContact O-N 3.07Å; K6-A9 PolarHBondContact O-N 2.88Å; A9-K11 VanDerWaalsContact C-N 3.34Å; A9-K11 PolarHBondContact O-N 3.38Å; A9-I12 PolarHBondContact O-N 3.13Å; A9-Q13 PolarHBondContact O-N 3.04Å; A9-L33 HydrophobicContact CB-CD1 4.47Å; A9-L33 HydrophobicContact CB-CD2 4.48Å; A9-C47 HydrophobicContact CB-CB 3.95Å |
| 10 | C | 97.3 | Very high | 95.2 | Very high | 65 Ų | 65 | 78 Ų | 78 | 44% | 0.439 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -63.4 | -36.8 | 173.8 | -67.1 | 0 | 0 | 0 | 0 | 112.7 | K6 P7 L8 I12 Q13 S14 | K6-C10 PolarHBondContact O-N 3.31Å; K6-C10 PolarHBondContact O-SG 2.93Å; K6-C10 VanDerWaalsContact O-SG 3.41Å; P7-C10 PolarHBondContact O-N 3.36Å; L8-C10 VanDerWaalsContact C-N 3.28Å; L8-C10 PolarHBondContact O-N 3.38Å; C10-I12 VanDerWaalsContact C-N 3.31Å; C10-I12 PolarHBondContact O-N 3.03Å; C10-Q13 WeakPolarHBondContact O-CB 3.28Å; C10-Q13 PolarHBondContact O-N 3.47Å; C10-S14 PolarHBondContact O-N 2.88Å; C10-S14 PolarHBondContact O-OG 3.02Å |
| 11 | K | 97.9 | Very high | 95.3 | Very high | 122 Ų | 122 | 81.5 Ų | 81.5 | 53% | 0.53 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -62.9 | -36.3 | 175.3 | -73.7 | 177.8 | -175.7 | -178.6 | 0 | 112.5 | P7 L8 A9 S14 C15 E29 | P7-K11 WeakPolarHBondContact O-CG 3.21Å; P7-K11 PolarHBondContact O-N 3.18Å; P7-K11 VanDerWaalsContact O-N 3.1Å; L8-K11 HydrophobicContact CD2-CD 4.2Å; L8-K11 WeakPolarHBondContact O-CB 3.28Å; L8-K11 PolarHBondContact O-N 2.89Å; A9-K11 VanDerWaalsContact C-N 3.34Å; A9-K11 PolarHBondContact O-N 3.38Å; K11-S14 PolarHBondContact O-N 3.17Å; K11-C15 WeakPolarHBondContact O-CB 3.42Å; K11-C15 PolarHBondContact O-N 3.39Å; K11-E29 HydrophobicContact CB-CG 4.26Å |
| 12 | I | 97.7 | Very high | 96.9 | Very high | 22 Ų | 22 | 74.3 Ų | 74.3 | 11% | 0.113 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -62.1 | -46.6 | 174.1 | -64.5 | 171.4 | 0 | 0 | 0 | 110.1 | L8 A9 C10 S14 C15 L16 E29 I30 L33 | L8-I12 PolarHBondContact O-N 3.2Å; L8-I12 VanDerWaalsContact O-N 3.14Å; A9-I12 PolarHBondContact O-N 3.13Å; C10-I12 VanDerWaalsContact C-N 3.31Å; C10-I12 PolarHBondContact O-N 3.03Å; I12-S14 VanDerWaalsContact C-N 3.33Å; I12-S14 PolarHBondContact O-N 2.92Å; I12-C15 WeakPolarHBondContact O-CA 3.3Å; I12-C15 WeakPolarHBondContact O-CB 3.39Å; I12-C15 PolarHBondContact O-N 3.31Å; I12-L16 HydrophobicContact CG2-CD1 4.09Å; I12-L16 HydrophobicContact CG2-CG 4.33Å; I12-L16 WeakPolarHBondContact O-CG 3.33Å; I12-L16 PolarHBondContact O-N 3.06Å; I12-E29 HydrophobicContact CG1-CB 3.7Å; I12-I30 HydrophobicContact CD1-CG1 4.1Å; I12-I30 HydrophobicContact CG1-CG1 4.44Å; I12-L33 HydrophobicContact CD1-CB 3.89Å; I12-L33 HydrophobicContact CD1-CD2 3.48Å; I12-L33 VanDerWaalsContact CD1-CD2 3.48Å; I12-L33 HydrophobicContact CD1-CG 4.31Å |
| 13 | Q | 97.3 | Very high | 97.3 | Very high | 114 Ų | 114 | 70.9 Ų | 70.9 | 53% | 0.533 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -57.8 | -46 | 176.9 | -64.6 | -61.9 | -30.2 | 0 | 0 | 111.7 | A9 C10 C15 L16 I17 | A9-Q13 PolarHBondContact O-N 3.04Å; C10-Q13 WeakPolarHBondContact O-CB 3.28Å; C10-Q13 PolarHBondContact O-N 3.47Å; Q13-C15 VanDerWaalsContact C-N 3.29Å; Q13-C15 PolarHBondContact O-N 3.39Å; Q13-L16 PolarHBondContact O-N 3.39Å; Q13-I17 WeakPolarHBondContact O-CG1 3.48Å; Q13-I17 PolarHBondContact O-N 2.88Å; Q13-I17 VanDerWaalsContact O-N 3.13Å |
| 14 | S | 98.2 | Very high | 97.5 | Very high | 54 Ų | 54 | 73.3 Ų | 73.3 | 38% | 0.378 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -64.3 | -33.3 | 175.1 | -53.8 | 0 | 0 | 0 | 0 | 113.1 | C10 K11 I12 R18 | C10-S14 PolarHBondContact O-N 2.88Å; C10-S14 PolarHBondContact O-OG 3.02Å; K11-S14 PolarHBondContact O-N 3.17Å; I12-S14 VanDerWaalsContact C-N 3.33Å; I12-S14 PolarHBondContact O-N 2.92Å; S14-R18 WeakPolarHBondContact O-CG 3.41Å; S14-R18 PolarHBondContact O-N 3.33Å; S14-R18 PolarHBondContact O-NH1 3.31Å |
| 15 | C | 98.7 | Very high | 97.5 | Very high | 2 Ų | 2 | 79 Ų | 79 | 1% | 0.014 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -66.8 | -46.4 | 175.7 | 179.5 | 0 | 0 | 0 | 0 | 111.5 | K11 I12 Q13 I17 R18 N19 C26 E29 | K11-C15 WeakPolarHBondContact O-CB 3.42Å; K11-C15 PolarHBondContact O-N 3.39Å; I12-C15 WeakPolarHBondContact O-CA 3.3Å; I12-C15 WeakPolarHBondContact O-CB 3.39Å; I12-C15 PolarHBondContact O-N 3.31Å; Q13-C15 VanDerWaalsContact C-N 3.29Å; Q13-C15 PolarHBondContact O-N 3.39Å; C15-I17 PolarHBondContact O-N 3.1Å; C15-R18 PolarHBondContact O-N 3.17Å; C15-N19 WeakPolarHBondContact O-CB 3.4Å; C15-N19 PolarHBondContact O-N 3.49Å; C15-N19 VanDerWaalsContact O-N 3.13Å; C15-N19 PolarHBondContact O-ND2 2.89Å; C15-N19 PolarHBondContact SG-ND2 2.96Å; C15-C26 HydrophobicContact CB-CB 3.89Å; C15-C26 WeakPolarHBondContact CB-SG 3.07Å; C15-C26 WeakPolarHBondContact SG-CA 3.06Å; C15-C26 WeakPolarHBondContact SG-CB 3.36Å; C15-C26 CovalentContact SG-SG 2.04Å; C15-C26 PolarHBondContact SG-SG 3.43Å; C15-E29 HydrophobicContact CB-CG 4.19Å |
| 16 | L | 98.6 | Very high | 97.6 | Very high | 28 Ų | 28 | 79 Ų | 79 | 15% | 0.147 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -59.3 | -48.5 | 179 | -69.4 | 170.6 | 0 | 0 | 0 | 111.1 | I12 Q13 R18 N19 D20 F21 V23 | I12-L16 HydrophobicContact CG2-CD1 4.09Å; I12-L16 HydrophobicContact CG2-CG 4.33Å; I12-L16 WeakPolarHBondContact O-CG 3.33Å; I12-L16 PolarHBondContact O-N 3.06Å; Q13-L16 PolarHBondContact O-N 3.39Å; L16-R18 VanDerWaalsContact C-N 3.25Å; L16-R18 PolarHBondContact O-N 3.08Å; L16-N19 CarbonylContact O-C 3.51Å; L16-N19 PolarHBondContact O-N 3Å; L16-D20 PolarHBondContact O-N 3.31Å; L16-F21 HydrophobicContact CB-CD1 4.17Å; L16-F21 WeakPolarHBondContact O-CA 3.39Å; L16-F21 PolarHBondContact O-N 3.32Å; L16-V23 HydrophobicContact CD2-CB 4.25Å |
| 17 | I | 98.4 | Very high | 97.7 | Very high | 113 Ų | 113 | 77.8 Ų | 77.8 | 58% | 0.579 | 40% | 0.399 | S | S | * | . | H | α-helix | trans | -58.3 | -39 | 179 | -67.3 | 165.7 | 0 | 0 | 0 | 111.5 | Q13 C15 N19 | Q13-I17 WeakPolarHBondContact O-CG1 3.48Å; Q13-I17 PolarHBondContact O-N 2.88Å; Q13-I17 VanDerWaalsContact O-N 3.13Å; C15-I17 PolarHBondContact O-N 3.1Å; I17-N19 VanDerWaalsContact C-N 3.3Å; I17-N19 PolarHBondContact O-N 3.44Å |
| 18 | R | 98.3 | Very high | 97.7 | Very high | 164 Ų | 164 | 82.9 Ų | 82.9 | 62% | 0.619 | 41% | 0.409 | S | S | * | . | H | α-helix | trans | -75.4 | -16.9 | 179.3 | -73.8 | -170.2 | -53 | -97.7 | -2.4 | 114.4 | S14 C15 L16 | S14-R18 WeakPolarHBondContact O-CG 3.41Å; S14-R18 PolarHBondContact O-N 3.33Å; S14-R18 PolarHBondContact O-NH1 3.31Å; C15-R18 PolarHBondContact O-N 3.17Å; L16-R18 VanDerWaalsContact C-N 3.25Å; L16-R18 PolarHBondContact O-N 3.08Å |
| 19 | N | 98.3 | Very high | 97.7 | Very high | 40 Ų | 40 | 82.3 Ų | 82.3 | 21% | 0.214 | 41% | 0.406 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -119.4 | 28.9 | -172.1 | -71.7 | -72.6 | 0 | 0 | 0 | 111.6 | C15 L16 I17 F21 D22 R25 | C15-N19 WeakPolarHBondContact O-CB 3.4Å; C15-N19 PolarHBondContact O-N 3.49Å; C15-N19 VanDerWaalsContact O-N 3.13Å; C15-N19 PolarHBondContact O-ND2 2.89Å; C15-N19 PolarHBondContact SG-ND2 2.96Å; L16-N19 CarbonylContact O-C 3.51Å; L16-N19 PolarHBondContact O-N 3Å; I17-N19 VanDerWaalsContact C-N 3.3Å; I17-N19 PolarHBondContact O-N 3.44Å; N19-F21 PolarHBondContact O-N 3.4Å; N19-F21 VanDerWaalsContact O-N 3.09Å; N19-D22 WeakPolarHBondContact O-CB 3.38Å; N19-D22 PolarHBondContact O-N 2.83Å; N19-R25 HydrophobicContact CB-CB 4.02Å; N19-R25 WeakPolarHBondContact OD1-CD 3.43Å |
| 20 | D | 97.8 | Very high | 97.8 | Very high | 150 Ų | 150 | 83.5 Ų | 83.5 | 80% | 0.802 | 41% | 0.408 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 51.4 | 36.7 | -179.4 | -57.4 | -50.9 | 0 | 0 | 0 | 113.3 | L16 D22 | L16-D20 PolarHBondContact O-N 3.31Å; D20-D22 PolarHBondContact O-N 3.09Å |
| 21 | F | 97.3 | Very high | 97.7 | Very high | 152 Ų | 152 | 83.6 Ų | 83.6 | 67% | 0.667 | 41% | 0.407 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 63.5 | 15.7 | -176.3 | -54.3 | -89.6 | 0 | 0 | 0 | 115.4 | L16 N19 V23 | L16-F21 HydrophobicContact CB-CD1 4.17Å; L16-F21 WeakPolarHBondContact O-CA 3.39Å; L16-F21 PolarHBondContact O-N 3.32Å; N19-F21 PolarHBondContact O-N 3.4Å; N19-F21 VanDerWaalsContact O-N 3.09Å; F21-V23 PolarHBondContact O-N 3.48Å |
| 22 | D | 97.7 | Very high | 97.7 | Very high | 51 Ų | 51 | 79.7 Ų | 79.7 | 27% | 0.273 | 40% | 0.395 | S | S | . | . | trans | -71.7 | 97 | 172.1 | -177 | -2.1 | 0 | 0 | 0 | 110.9 | N19 D20 T24 R25 | N19-D22 WeakPolarHBondContact O-CB 3.38Å; N19-D22 PolarHBondContact O-N 2.83Å; D20-D22 PolarHBondContact O-N 3.09Å; D22-T24 PolarHBondContact O-N 2.91Å; D22-T24 WeakPolarHBondContact OD1-CB 3.36Å; D22-T24 PolarHBondContact OD1-N 3.23Å; D22-T24 PolarHBondContact OD1-OG1 3.14Å; D22-T24 PolarHBondContact OD2-OG1 3.05Å; D22-R25 HydrophobicContact CB-CG 4.29Å; D22-R25 PolarHBondContact O-N 2.95Å; D22-R25 VanDerWaalsContact OD2-CD 3.31Å; D22-R25 WeakPolarHBondContact OD2-CD 3.49Å; D22-R25 WeakPolarHBondContact OD2-CG 3.32Å; D22-R25 IonicContact OD2-NE 3Å; D22-R25 PolarHBondContact OD2-NE 3.28Å | ||
| 23 | V | 95.8 | Very high | 97.6 | Very high | 81 Ų | 81 | 79.4 Ų | 79.4 | 49% | 0.491 | 39% | 0.393 | S | S | . | . | G | 310 helix | trans | -61.3 | -25.9 | 179.9 | 70.1 | 0 | 0 | 0 | 0 | 113 | L16 F21 R25 C26 I30 | L16-V23 HydrophobicContact CD2-CB 4.25Å; F21-V23 PolarHBondContact O-N 3.48Å; V23-R25 PolarHBondContact O-N 2.04Å; V23-C26 PolarHBondContact O-N 3.3Å; V23-I30 HydrophobicContact CG2-CD1 3.64Å |
| 24 | T | 97.5 | Very high | 97.4 | Very high | 97 Ų | 97 | 75.7 Ų | 75.7 | 60% | 0.595 | 38% | 0.377 | S | S | * | . | G | 310 helix | trans | -66.4 | -21.9 | -179.4 | 74.8 | 0 | 0 | 0 | 0 | 111.9 | D22 T27 | D22-T24 PolarHBondContact O-N 2.91Å; D22-T24 WeakPolarHBondContact OD1-CB 3.36Å; D22-T24 PolarHBondContact OD1-N 3.23Å; D22-T24 PolarHBondContact OD1-OG1 3.14Å; D22-T24 PolarHBondContact OD2-OG1 3.05Å; T24-T27 VanDerWaalsContact O-CG2 3.31Å; T24-T27 WeakPolarHBondContact O-CG2 3.01Å |
| 25 | R | 98.1 | Very high | 97.3 | Very high | 161 Ų | 161 | 78.6 Ų | 78.6 | 61% | 0.608 | 38% | 0.384 | S | S | * | . | G | 310 helix | trans | -84.8 | -7.5 | 175.3 | -64 | 175.5 | -178.3 | -104.3 | -0.2 | 114 | N19 D22 V23 | N19-R25 HydrophobicContact CB-CB 4.02Å; N19-R25 WeakPolarHBondContact OD1-CD 3.43Å; D22-R25 HydrophobicContact CB-CG 4.29Å; D22-R25 PolarHBondContact O-N 2.95Å; D22-R25 VanDerWaalsContact OD2-CD 3.31Å; D22-R25 WeakPolarHBondContact OD2-CD 3.49Å; D22-R25 WeakPolarHBondContact OD2-CG 3.32Å; D22-R25 IonicContact OD2-NE 3Å; D22-R25 PolarHBondContact OD2-NE 3.28Å; V23-R25 PolarHBondContact O-N 2.04Å |
| 26 | C | 98.3 | Very high | 97.2 | Very high | 0 Ų | 0 | 79 Ų | 79 | 0% | 0 | 39% | 0.387 | C | S | . | . | G | 310 helix | trans | -109.3 | 18.1 | -177.2 | -59.3 | 0 | 0 | 0 | 0 | 113.2 | C15 V23 R28 E29 I30 | C15-C26 HydrophobicContact CB-CB 3.89Å; C15-C26 WeakPolarHBondContact CB-SG 3.07Å; C15-C26 WeakPolarHBondContact SG-CA 3.06Å; C15-C26 WeakPolarHBondContact SG-CB 3.36Å; C15-C26 CovalentContact SG-SG 2.04Å; C15-C26 PolarHBondContact SG-SG 3.43Å; V23-C26 PolarHBondContact O-N 3.3Å; C26-R28 VanDerWaalsContact C-N 3.29Å; C26-R28 PolarHBondContact O-N 2.92Å; C26-E29 PolarHBondContact O-N 2.91Å; C26-I30 VanDerWaalsContact O-CG1 3.31Å; C26-I30 WeakPolarHBondContact O-CG1 3.14Å; C26-I30 PolarHBondContact O-N 2.85Å |
| 27 | T | 97.5 | Very high | 97 | Very high | 87 Ų | 87 | 78.2 Ų | 78.2 | 53% | 0.534 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -55.2 | -42.3 | -178.1 | 45.9 | 0 | 0 | 0 | 0 | 112.3 | T24 I30 T31 | T24-T27 VanDerWaalsContact O-CG2 3.31Å; T24-T27 WeakPolarHBondContact O-CG2 3.01Å; T27-I30 PolarHBondContact O-N 3.39Å; T27-T31 WeakPolarHBondContact O-CB 3.09Å; T27-T31 PolarHBondContact O-N 3.34Å; T27-T31 PolarHBondContact O-OG1 3.27Å |
| 28 | R | 97.8 | Very high | 96.7 | Very high | 177 Ų | 177 | 78.5 Ų | 78.5 | 67% | 0.668 | 38% | 0.383 | S | S | * | . | H | α-helix | trans | -62.4 | -45.6 | 178.2 | -175.1 | -174.8 | 65.8 | -178.4 | -1.7 | 112.7 | C26 I30 T31 S32 | C26-R28 VanDerWaalsContact C-N 3.29Å; C26-R28 PolarHBondContact O-N 2.92Å; R28-I30 VanDerWaalsContact C-N 3.32Å; R28-T31 PolarHBondContact O-N 2.99Å; R28-S32 PolarHBondContact O-N 3.35Å; R28-S32 PolarHBondContact O-OG 2.05Å |
| 29 | E | 98.1 | Very high | 96.5 | Very high | 24 Ų | 24 | 77.9 Ų | 77.9 | 11% | 0.112 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -65.9 | -38.3 | 178.5 | -70.9 | 68.8 | -156.9 | 0 | 0 | 110.9 | K11 I12 C15 C26 S32 L33 | K11-E29 HydrophobicContact CB-CG 4.26Å; I12-E29 HydrophobicContact CG1-CB 3.7Å; C15-E29 HydrophobicContact CB-CG 4.19Å; C26-E29 PolarHBondContact O-N 2.91Å; E29-S32 PolarHBondContact O-N 3.41Å; E29-L33 PolarHBondContact O-N 3.49Å; E29-L33 VanDerWaalsContact O-N 3.09Å |
| 30 | I | 96.6 | Very high | 96.3 | Very high | 50 Ų | 50 | 78.6 Ų | 78.6 | 26% | 0.256 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -62.2 | -54.7 | 173 | -67.3 | 164.5 | 0 | 0 | 0 | 109.7 | I12 V23 C26 T27 R28 S32 L33 I34 | I12-I30 HydrophobicContact CD1-CG1 4.1Å; I12-I30 HydrophobicContact CG1-CG1 4.44Å; V23-I30 HydrophobicContact CG2-CD1 3.64Å; C26-I30 VanDerWaalsContact O-CG1 3.31Å; C26-I30 WeakPolarHBondContact O-CG1 3.14Å; C26-I30 PolarHBondContact O-N 2.85Å; T27-I30 PolarHBondContact O-N 3.39Å; R28-I30 VanDerWaalsContact C-N 3.32Å; I30-S32 PolarHBondContact O-N 3.26Å; I30-L33 CarbonylContact O-C 3.6Å; I30-L33 WeakPolarHBondContact O-CA 3.33Å; I30-L33 WeakPolarHBondContact O-CB 3.31Å; I30-L33 PolarHBondContact O-N 3.1Å; I30-I34 HydrophobicContact CG2-CD1 4.12Å; I30-I34 HydrophobicContact CG2-CG1 4.21Å; I30-I34 WeakPolarHBondContact O-CG1 3.31Å; I30-I34 PolarHBondContact O-N 3.17Å |
| 31 | T | 95.9 | Very high | 96 | Very high | 67 Ų | 67 | 81.2 Ų | 81.2 | 41% | 0.411 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -51.7 | -44.2 | 177.2 | -60.8 | 0 | 0 | 0 | 0 | 111.7 | T27 R28 L33 I34 E35 | T27-T31 WeakPolarHBondContact O-CB 3.09Å; T27-T31 PolarHBondContact O-N 3.34Å; T27-T31 PolarHBondContact O-OG1 3.27Å; R28-T31 PolarHBondContact O-N 2.99Å; T31-L33 VanDerWaalsContact C-N 3.33Å; T31-L33 PolarHBondContact O-N 3.01Å; T31-I34 WeakPolarHBondContact O-CB 3.38Å; T31-I34 PolarHBondContact O-N 3.1Å; T31-I34 VanDerWaalsContact O-N 3.14Å; T31-E35 HydrophobicContact CG2-CG 4.49Å; T31-E35 WeakPolarHBondContact O-CG 3.36Å; T31-E35 PolarHBondContact O-N 3.24Å |
| 32 | S | 97.1 | Very high | 95.6 | Very high | 40 Ų | 40 | 81 Ų | 81 | 28% | 0.28 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -61.1 | -41.1 | 176.8 | -58.7 | 0 | 0 | 0 | 0 | 112.1 | L8 R28 E29 I30 C36 | L8-S32 WeakPolarHBondContact CD1-O 3.43Å; R28-S32 PolarHBondContact O-N 3.35Å; R28-S32 PolarHBondContact O-OG 2.05Å; E29-S32 PolarHBondContact O-N 3.41Å; I30-S32 PolarHBondContact O-N 3.26Å; S32-C36 WeakPolarHBondContact O-CB 3.4Å; S32-C36 PolarHBondContact O-N 3.15Å |
| 33 | L | 96 | Very high | 95.4 | Very high | 15 Ų | 15 | 81.6 Ų | 81.6 | 8% | 0.079 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -65.1 | -40.2 | 174.9 | -179.3 | 62.4 | 0 | 0 | 0 | 111.5 | C5 L8 A9 I12 E29 I30 T31 C36 C37 C47 | C5-L33 HydrophobicContact CB-CD1 3.75Å; L8-L33 HydrophobicContact CB-CB 4.37Å; L8-L33 HydrophobicContact CB-CD1 4.13Å; A9-L33 HydrophobicContact CB-CD1 4.47Å; A9-L33 HydrophobicContact CB-CD2 4.48Å; I12-L33 HydrophobicContact CD1-CB 3.89Å; I12-L33 HydrophobicContact CD1-CD2 3.48Å; I12-L33 VanDerWaalsContact CD1-CD2 3.48Å; I12-L33 HydrophobicContact CD1-CG 4.31Å; E29-L33 PolarHBondContact O-N 3.49Å; E29-L33 VanDerWaalsContact O-N 3.09Å; I30-L33 CarbonylContact O-C 3.6Å; I30-L33 WeakPolarHBondContact O-CA 3.33Å; I30-L33 WeakPolarHBondContact O-CB 3.31Å; I30-L33 PolarHBondContact O-N 3.1Å; T31-L33 VanDerWaalsContact C-N 3.33Å; T31-L33 PolarHBondContact O-N 3.01Å; L33-C36 WeakPolarHBondContact O-CB 3.33Å; L33-C36 PolarHBondContact O-N 3.14Å; L33-C37 PolarHBondContact O-N 3.24Å; L33-C37 PolarHBondContact O-SG 2.97Å; L33-C37 VanDerWaalsContact O-SG 3.35Å; L33-C47 HydrophobicContact CD1-CB 4.43Å |
| 34 | I | 94 | Very high | 95.1 | Very high | 36 Ų | 36 | 86 Ų | 86 | 19% | 0.185 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -57.2 | -54.2 | 175.7 | -48.1 | -154.9 | 0 | 0 | 0 | 110.3 | I30 T31 C36 C37 Q38 W51 | I30-I34 HydrophobicContact CG2-CD1 4.12Å; I30-I34 HydrophobicContact CG2-CG1 4.21Å; I30-I34 WeakPolarHBondContact O-CG1 3.31Å; I30-I34 PolarHBondContact O-N 3.17Å; T31-I34 WeakPolarHBondContact O-CB 3.38Å; T31-I34 PolarHBondContact O-N 3.1Å; T31-I34 VanDerWaalsContact O-N 3.14Å; I34-C36 PolarHBondContact O-N 3.38Å; I34-C37 PolarHBondContact O-N 3.2Å; I34-C37 VanDerWaalsContact O-N 3.13Å; I34-Q38 HydrophobicContact CG2-CG 4.42Å; I34-Q38 WeakPolarHBondContact O-CG 3.33Å; I34-Q38 PolarHBondContact O-N 3.49Å; I34-W51 HydrophobicContact CB-CH2 3.89Å; I34-W51 HydrophobicContact CB-CZ3 3.82Å; I34-W51 HydrophobicContact CD1-CH2 3.43Å; I34-W51 VanDerWaalsContact CD1-CH2 3.43Å; I34-W51 HydrophobicContact CD1-CZ3 3.63Å; I34-W51 HydrophobicContact CG1-CH2 3.22Å; I34-W51 HydrophobicContact CG1-CZ2 4.17Å; I34-W51 HydrophobicContact CG1-CZ3 3.58Å; I34-W51 HydrophobicContact CG2-CE3 4.17Å; I34-W51 HydrophobicContact CG2-CH2 4.08Å; I34-W51 HydrophobicContact CG2-CZ3 3.47Å; I34-W51 VanDerWaalsContact CG2-CZ3 3.47Å |
| 35 | E | 95.2 | Very high | 94.9 | Very high | 115 Ų | 115 | 81.4 Ų | 81.4 | 54% | 0.537 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -59.2 | -38.1 | -179.4 | -70.8 | 174.3 | 175.9 | 0 | 0 | 111.3 | T31 Q38 K39 | T31-E35 HydrophobicContact CG2-CG 4.49Å; T31-E35 WeakPolarHBondContact O-CG 3.36Å; T31-E35 PolarHBondContact O-N 3.24Å; E35-Q38 PolarHBondContact O-N 2.96Å; E35-K39 VanDerWaalsContact O-CB 3.3Å; E35-K39 WeakPolarHBondContact O-CB 3Å; E35-K39 PolarHBondContact O-N 3.2Å |
| 36 | C | 96.6 | Very high | 94.7 | Very high | 12 Ų | 12 | 78 Ų | 78 | 8% | 0.081 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -64.8 | -48.3 | 174.7 | -172.7 | 0 | 0 | 0 | 0 | 112.3 | C5 L8 S32 L33 I34 Q38 K39 F40 | C5-C36 WeakPolarHBondContact CA-SG 3.43Å; C5-C36 HydrophobicContact CB-CB 3.89Å; C5-C36 WeakPolarHBondContact CB-SG 3.12Å; C5-C36 WeakPolarHBondContact SG-CB 3.31Å; C5-C36 CovalentContact SG-SG 2.04Å; C5-C36 PolarHBondContact SG-SG 3.07Å; L8-C36 HydrophobicContact CD1-CB 3.34Å; S32-C36 WeakPolarHBondContact O-CB 3.4Å; S32-C36 PolarHBondContact O-N 3.15Å; L33-C36 WeakPolarHBondContact O-CB 3.33Å; L33-C36 PolarHBondContact O-N 3.14Å; I34-C36 PolarHBondContact O-N 3.38Å; C36-Q38 VanDerWaalsContact C-N 3.28Å; C36-Q38 PolarHBondContact O-N 2.6Å; C36-K39 PolarHBondContact O-N 3.02Å; C36-K39 VanDerWaalsContact O-N 3.17Å; C36-F40 WeakPolarHBondContact O-CD2 3.4Å; C36-F40 PolarHBondContact O-N 3.34Å |
| 37 | C | 94.6 | Very high | 94.4 | Very high | 10 Ų | 10 | 79.8 Ų | 79.8 | 7% | 0.068 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -61.5 | -37.8 | 177.7 | -66.9 | 0 | 0 | 0 | 0 | 111.4 | L33 I34 F40 R41 C48 W51 | L33-C37 PolarHBondContact O-N 3.24Å; L33-C37 PolarHBondContact O-SG 2.97Å; L33-C37 VanDerWaalsContact O-SG 3.35Å; I34-C37 PolarHBondContact O-N 3.2Å; I34-C37 VanDerWaalsContact O-N 3.13Å; C37-F40 CarbonylContact O-C 3.53Å; C37-R41 WeakPolarHBondContact O-CA 3.48Å; C37-R41 PolarHBondContact O-N 3.25Å; C37-C48 VanDerWaalsContact CA-SG 3.54Å; C37-C48 HydrophobicContact CB-CB 3.75Å; C37-C48 WeakPolarHBondContact CB-SG 3.33Å; C37-C48 VanDerWaalsContact SG-CA 3.56Å; C37-C48 WeakPolarHBondContact SG-CB 3.48Å; C37-C48 CovalentContact SG-SG 2.05Å; C37-C48 PolarHBondContact SG-SG 3.06Å; C37-W51 HydrophobicContact CB-CD2 4.4Å; C37-W51 HydrophobicContact CB-CG 4.45Å |
| 38 | Q | 92.5 | Very high | 94.2 | Very high | 119 Ų | 119 | 76.5 Ų | 76.5 | 56% | 0.556 | 36% | 0.363 | S | S | * | . | H | α-helix | trans | -63.7 | -43.9 | 173.6 | -72.1 | 177.2 | -15.4 | 0 | 0 | 112.4 | I34 E35 C36 | I34-Q38 HydrophobicContact CG2-CG 4.42Å; I34-Q38 WeakPolarHBondContact O-CG 3.33Å; I34-Q38 PolarHBondContact O-N 3.49Å; E35-Q38 PolarHBondContact O-N 2.96Å; C36-Q38 VanDerWaalsContact C-N 3.28Å; C36-Q38 PolarHBondContact O-N 2.6Å |
| 39 | K | 95 | Very high | 93.7 | Very high | 151 Ų | 151 | 73.5 Ų | 73.5 | 66% | 0.657 | 36% | 0.357 | S | S | * | . | H | α-helix | trans | -65.4 | -40.9 | 178.8 | -177.8 | 174 | 180 | 175.3 | 0 | 112.3 | E35 C36 | E35-K39 VanDerWaalsContact O-CB 3.3Å; E35-K39 WeakPolarHBondContact O-CB 3Å; E35-K39 PolarHBondContact O-N 3.2Å; C36-K39 PolarHBondContact O-N 3.02Å; C36-K39 VanDerWaalsContact O-N 3.17Å |
| 40 | F | 93.9 | Very high | 92.7 | Very high | 55 Ų | 55 | 74.5 Ų | 74.5 | 24% | 0.241 | 37% | 0.374 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -105.4 | 29.9 | -176.4 | -62.9 | -75.7 | 0 | 0 | 0 | 113.3 | P4 C36 C37 H42 I43 | P4-F40 HydrophobicContact CB-CD1 4.17Å; P4-F40 HydrophobicContact CB-CD2 3.74Å; P4-F40 HydrophobicContact CB-CE1 4.15Å; P4-F40 HydrophobicContact CB-CE2 3.72Å; P4-F40 HydrophobicContact CB-CG 3.97Å; P4-F40 HydrophobicContact CB-CZ 3.92Å; P4-F40 HydrophobicContact CG-CB 3.99Å; P4-F40 HydrophobicContact CG-CD1 3.94Å; P4-F40 HydrophobicContact CG-CD2 3.92Å; P4-F40 HydrophobicContact CG-CE1 4.38Å; P4-F40 HydrophobicContact CG-CE2 4.37Å; P4-F40 HydrophobicContact CG-CG 3.68Å; C36-F40 WeakPolarHBondContact O-CD2 3.4Å; C36-F40 PolarHBondContact O-N 3.34Å; C37-F40 CarbonylContact O-C 3.53Å; F40-H42 PolarHBondContact O-N 3.16Å; F40-I43 HydrophobicContact CB-CD1 4.4Å; F40-I43 HydrophobicContact CD1-CD1 3.87Å; F40-I43 PolarHBondContact O-N 2.86Å |
| 41 | R | 90.3 | Very high | 91.4 | Very high | 206 Ų | 206 | 75.4 Ų | 75.4 | 78% | 0.777 | 37% | 0.374 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -52.6 | -23.1 | -178.7 | 68.1 | 175.7 | -175.5 | -98.6 | 2.9 | 115.8 | C37 I43 | C37-R41 WeakPolarHBondContact O-CA 3.48Å; C37-R41 PolarHBondContact O-N 3.25Å; R41-I43 VanDerWaalsContact C-N 3.32Å |
| 42 | H | 90.2 | Very high | 90 | Very high | 148 Ų | 148 | 78.5 Ų | 78.5 | 69% | 0.685 | 39% | 0.388 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.2 | -6.3 | 179.7 | 59.5 | -82.1 | 0 | 0 | 0 | 113 | F40 | F40-H42 PolarHBondContact O-N 3.16Š|
| 43 | I | 92 | Very high | 88.5 | Confident | 62 Ų | 62 | 81.8 Ų | 81.8 | 32% | 0.318 | 40% | 0.403 | S | S | . | . | S | Bend | trans | -108.5 | 117.4 | 178.5 | -54.9 | -178 | 0 | 0 | 0 | 107.3 | P4 F40 R41 Q45 | P4-I43 HydrophobicContact CG-CD1 4.2Å; F40-I43 HydrophobicContact CB-CD1 4.4Å; F40-I43 HydrophobicContact CD1-CD1 3.87Å; F40-I43 PolarHBondContact O-N 2.86Å; R41-I43 VanDerWaalsContact C-N 3.32Å; I43-Q45 HydrophobicContact CG2-CG 4.03Å; I43-Q45 PolarHBondContact O-N 3.23Å |
| 44 | K | 91.1 | Very high | 87 | Confident | 173 Ų | 173 | 86.2 Ų | 86.2 | 75% | 0.752 | 42% | 0.419 | S | S | * | . | trans | -68.2 | 125.2 | 174.9 | -174 | 175 | 179.4 | 177.6 | 0 | 109.9 | E49 | K44-E49 WeakPolarHBondContact CE-OE1 3.31Å; K44-E49 IonicContact NZ-OE1 3.93Å | ||
| 45 | Q | 92.8 | Very high | 85.4 | Confident | 2 Ų | 2 | 90.3 Ų | 90.3 | 1% | 0.009 | 44% | 0.435 | C | S | . | . | trans | -138.9 | 132 | -178.7 | -60.2 | 176.7 | -109.8 | 0 | 0 | 109.8 | L3 C5 I43 C47 C48 E49 | L3-Q45 HydrophobicContact CB-CG 4.33Å; L3-Q45 HydrophobicContact CD1-CB 4.45Å; L3-Q45 HydrophobicContact CD1-CG 4.48Å; L3-Q45 HydrophobicContact CD2-CG 4.32Å; C5-Q45 PolarHBondContact SG-NE2 2.9Å; C5-Q45 VanDerWaalsContact SG-NE2 3.43Å; C5-Q45 PolarHBondContact SG-OE1 3Å; C5-Q45 VanDerWaalsContact SG-OE1 3.39Å; I43-Q45 HydrophobicContact CG2-CG 4.03Å; I43-Q45 PolarHBondContact O-N 3.23Å; Q45-C47 PolarHBondContact O-N 3.38Å; Q45-C47 VanDerWaalsContact O-N 3.16Å; Q45-C48 HydrophobicContact CB-CB 4.13Å; Q45-C48 CarbonylContact O-C 3.5Å; Q45-C48 WeakPolarHBondContact O-CA 3.41Å; Q45-C48 PolarHBondContact O-N 2.82Å; Q45-E49 PolarHBondContact O-N 3.39Å | ||
| 46 | P | 92.8 | Very high | 83.6 | Confident | 89 Ų | 89 | 90.6 Ų | 90.6 | 58% | 0.578 | 44% | 0.437 | S | S | * | . | G | 310 helix | trans | -56.1 | -34.6 | -179.8 | -28.2 | 35.9 | 0 | 0 | 0 | 114.3 | C48 E49 | P46-C48 PolarHBondContact O-N 3.34Å; P46-E49 PolarHBondContact O-N 3.03Å |
| 47 | C | 92.9 | Very high | 81.8 | Confident | 37 Ų | 37 | 95.2 Ų | 95.2 | 25% | 0.25 | 46% | 0.457 | C | S | . | . | G | 310 helix | trans | -71.8 | -15.2 | 176.7 | 62.4 | 0 | 0 | 0 | 0 | 114.1 | A9 L33 Q45 W51 | A9-C47 HydrophobicContact CB-CB 3.95Å; L33-C47 HydrophobicContact CD1-CB 4.43Å; Q45-C47 PolarHBondContact O-N 3.38Å; Q45-C47 VanDerWaalsContact O-N 3.16Å; C47-W51 PolarHBondContact O-NE1 3.48Å |
| 48 | C | 92.8 | Very high | 80.3 | Confident | 19 Ų | 19 | 97.7 Ų | 97.7 | 13% | 0.128 | 47% | 0.469 | C | S | . | . | G | 310 helix | trans | -107.7 | 6.3 | 179.2 | -57 | 0 | 0 | 0 | 0 | 112 | C37 Q45 P46 W51 | C37-C48 VanDerWaalsContact CA-SG 3.54Å; C37-C48 HydrophobicContact CB-CB 3.75Å; C37-C48 WeakPolarHBondContact CB-SG 3.33Å; C37-C48 VanDerWaalsContact SG-CA 3.56Å; C37-C48 WeakPolarHBondContact SG-CB 3.48Å; C37-C48 CovalentContact SG-SG 2.05Å; C37-C48 PolarHBondContact SG-SG 3.06Å; Q45-C48 HydrophobicContact CB-CB 4.13Å; Q45-C48 CarbonylContact O-C 3.5Å; Q45-C48 WeakPolarHBondContact O-CA 3.41Å; Q45-C48 PolarHBondContact O-N 2.82Å; P46-C48 PolarHBondContact O-N 3.34Å; C48-W51 PolarHBondContact O-N 3.42Å |
| 49 | E | 87.7 | Confident | 78.9 | Confident | 113 Ų | 113 | 95.2 Ų | 95.2 | 53% | 0.528 | 46% | 0.46 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -70.9 | 135.1 | 174.7 | -70 | 179.3 | -179 | 0 | 0 | 110.1 | K44 Q45 P46 | K44-E49 WeakPolarHBondContact CE-OE1 3.31Å; K44-E49 IonicContact NZ-OE1 3.93Å; Q45-E49 PolarHBondContact O-N 3.39Å; P46-E49 PolarHBondContact O-N 3.03Å |
| 50 | G | 76.9 | Confident | 77.3 | Confident | 46 Ų | 46 | 90.7 Ų | 90.7 | 47% | 0.474 | 44% | 0.443 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 91.7 | -12.9 | -176.2 | 0 | 0 | 0 | 0 | 0 | 115.4 | D52 N53 | G50-D52 VanDerWaalsContact C-N 3.3Å; G50-D52 PolarHBondContact O-N 2.88Å; G50-N53 PolarHBondContact O-N 3.27Å |
| 51 | W | 68.4 | Low | 75.7 | Confident | 69 Ų | 69 | 93.6 Ų | 93.6 | 26% | 0.261 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -68.5 | -27.5 | 177.6 | -71.6 | 72.9 | 0 | 0 | 0 | 113.6 | I34 C37 C47 C48 N53 Y54 K55 | I34-W51 HydrophobicContact CB-CH2 3.89Å; I34-W51 HydrophobicContact CB-CZ3 3.82Å; I34-W51 HydrophobicContact CD1-CH2 3.43Å; I34-W51 VanDerWaalsContact CD1-CH2 3.43Å; I34-W51 HydrophobicContact CD1-CZ3 3.63Å; I34-W51 HydrophobicContact CG1-CH2 3.22Å; I34-W51 HydrophobicContact CG1-CZ2 4.17Å; I34-W51 HydrophobicContact CG1-CZ3 3.58Å; I34-W51 HydrophobicContact CG2-CE3 4.17Å; I34-W51 HydrophobicContact CG2-CH2 4.08Å; I34-W51 HydrophobicContact CG2-CZ3 3.47Å; I34-W51 VanDerWaalsContact CG2-CZ3 3.47Å; C37-W51 HydrophobicContact CB-CD2 4.4Å; C37-W51 HydrophobicContact CB-CG 4.45Å; C47-W51 PolarHBondContact O-NE1 3.48Å; C48-W51 PolarHBondContact O-N 3.42Å; W51-N53 PolarHBondContact O-N 3.27Å; W51-Y54 HydrophobicContact CE3-CD1 4.18Å; W51-Y54 HydrophobicContact CZ3-CD1 4.06Å; W51-Y54 HydrophobicContact CZ3-CE1 4.38Å; W51-Y54 PolarHBondContact O-N 3.04Å; W51-Y54 VanDerWaalsContact O-N 3.1Å; W51-K55 PolarHBondContact O-N 3.46Å |
| 52 | D | 66.8 | Low | 74.2 | Confident | 132 Ų | 132 | 89.1 Ų | 89.1 | 71% | 0.706 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -57.1 | -34.5 | 175 | -65.2 | -32.2 | 0 | 0 | 0 | 111.4 | G50 H56 | G50-D52 VanDerWaalsContact C-N 3.3Å; G50-D52 PolarHBondContact O-N 2.88Å; D52-H56 PolarHBondContact O-N 3.44Å |
| 53 | N | 66.2 | Low | 72.7 | Confident | 109 Ų | 109 | 89.7 Ų | 89.7 | 58% | 0.583 | 45% | 0.453 | S | S | * | . | H | α-helix | trans | -75.9 | -39.6 | 176.3 | -61.9 | -29.2 | 0 | 0 | 0 | 111.8 | G50 W51 K55 H56 E57 | G50-N53 PolarHBondContact O-N 3.27Å; W51-N53 PolarHBondContact O-N 3.27Å; N53-K55 VanDerWaalsContact C-N 3.32Å; N53-K55 PolarHBondContact O-N 3.07Å; N53-H56 WeakPolarHBondContact O-CB 3.17Å; N53-H56 PolarHBondContact O-N 2.91Å; N53-H56 VanDerWaalsContact O-N 3.1Å; N53-E57 PolarHBondContact O-N 3.38Å |
| 54 | Y | 63.9 | Low | 70.9 | Confident | 108 Ų | 108 | 92.3 Ų | 92.3 | 42% | 0.424 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -61.8 | -38.7 | 178.4 | -176.6 | -107.8 | 0 | 0 | 0 | 112.4 | W51 E57 L58 | W51-Y54 HydrophobicContact CE3-CD1 4.18Å; W51-Y54 HydrophobicContact CZ3-CD1 4.06Å; W51-Y54 HydrophobicContact CZ3-CE1 4.38Å; W51-Y54 PolarHBondContact O-N 3.04Å; W51-Y54 VanDerWaalsContact O-N 3.1Å; Y54-E57 PolarHBondContact O-N 3.38Å; Y54-L58 HydrophobicContact CD1-CD1 3.85Å; Y54-L58 HydrophobicContact CD1-CG 4.43Å; Y54-L58 HydrophobicContact CE1-CD1 3.26Å; Y54-L58 HydrophobicContact CE1-CG 3.99Å; Y54-L58 HydrophobicContact CE2-CG 4.46Å; Y54-L58 PolarHBondContact O-N 3.39Å |
| 55 | K | 60.5 | Low | 68.9 | Low | 122 Ų | 122 | 94 Ų | 94 | 53% | 0.53 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -65.2 | -40.7 | 173.1 | -177.6 | 171.1 | 167.3 | 48.8 | 0 | 111.8 | W51 N53 E57 L58 D59 | W51-K55 PolarHBondContact O-N 3.46Å; N53-K55 VanDerWaalsContact C-N 3.32Å; N53-K55 PolarHBondContact O-N 3.07Å; K55-E57 VanDerWaalsContact C-N 3.25Å; K55-E57 PolarHBondContact O-N 3.23Å; K55-L58 PolarHBondContact O-N 3.21Å; K55-D59 VanDerWaalsContact CE-OD2 3.28Å; K55-D59 WeakPolarHBondContact CE-OD2 3.42Å; K55-D59 WeakPolarHBondContact CG-OD2 3.02Å; K55-D59 VanDerWaalsContact NZ-CG 3.32Å; K55-D59 IonicContact NZ-OD1 2.78Å; K55-D59 PolarHBondContact NZ-OD1 3.27Å; K55-D59 IonicContact NZ-OD2 2.91Å; K55-D59 PolarHBondContact NZ-OD2 3.27Å; K55-D59 VanDerWaalsContact O-CB 3.28Å; K55-D59 WeakPolarHBondContact O-CB 3.4Å; K55-D59 VanDerWaalsContact O-CG 3.26Å; K55-D59 PolarHBondContact O-N 3.35Å |
| 56 | H | 57.5 | Low | 67.7 | Low | 121 Ų | 121 | 98.6 Ų | 98.6 | 56% | 0.56 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -59.9 | -39.2 | 175.7 | -172.1 | -116 | 0 | 0 | 0 | 111.1 | D52 N53 N60 | D52-H56 PolarHBondContact O-N 3.44Å; N53-H56 WeakPolarHBondContact O-CB 3.17Å; N53-H56 PolarHBondContact O-N 2.91Å; N53-H56 VanDerWaalsContact O-N 3.1Å; H56-N60 PolarHBondContact CD2-ND2 3.25Å; H56-N60 PolarHBondContact CE1-ND2 3.06Å; H56-N60 PolarHBondContact ND1-ND2 3.48Å; H56-N60 PolarHBondContact NE2-ND2 3.13Å; H56-N60 VanDerWaalsContact NE2-ND2 3.17Å; H56-N60 WeakPolarHBondContact O-CB 3.38Å; H56-N60 PolarHBondContact O-N 3.41Å; H56-N60 PolarHBondContact O-ND2 3.04Å |
| 57 | E | 59.8 | Low | 66.4 | Low | 109 Ų | 109 | 99.1 Ų | 99.1 | 51% | 0.509 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -67.4 | -45.1 | 175.8 | -70.5 | 172.1 | -166.3 | 0 | 0 | 112.9 | N53 Y54 K55 N60 Q61 | N53-E57 PolarHBondContact O-N 3.38Å; Y54-E57 PolarHBondContact O-N 3.38Å; K55-E57 VanDerWaalsContact C-N 3.25Å; K55-E57 PolarHBondContact O-N 3.23Å; E57-N60 PolarHBondContact O-N 3.03Å; E57-Q61 WeakPolarHBondContact O-CG 3.45Å; E57-Q61 PolarHBondContact O-N 3.27Å |
| 58 | L | 61.7 | Low | 64.9 | Low | 62 Ų | 62 | 102.6 Ų | 102.6 | 33% | 0.325 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -66.7 | -43.2 | 177.3 | -74 | 176.9 | 0 | 0 | 0 | 113 | Y54 K55 N60 Q61 T62 | Y54-L58 HydrophobicContact CD1-CD1 3.85Å; Y54-L58 HydrophobicContact CD1-CG 4.43Å; Y54-L58 HydrophobicContact CE1-CD1 3.26Å; Y54-L58 HydrophobicContact CE1-CG 3.99Å; Y54-L58 HydrophobicContact CE2-CG 4.46Å; Y54-L58 PolarHBondContact O-N 3.39Å; K55-L58 PolarHBondContact O-N 3.21Å; L58-N60 PolarHBondContact O-N 3.47Å; L58-Q61 PolarHBondContact O-N 2.04Å; L58-T62 PolarHBondContact O-N 2.89Å; L58-T62 PolarHBondContact O-OG1 3.09Å |
| 59 | D | 63.8 | Low | 63.3 | Low | 66 Ų | 66 | 107.5 Ų | 107.5 | 35% | 0.353 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -64.8 | -30.5 | 176.7 | -70.4 | -9.9 | 0 | 0 | 0 | 110.5 | K55 K63 | K55-D59 VanDerWaalsContact CE-OD2 3.28Å; K55-D59 WeakPolarHBondContact CE-OD2 3.42Å; K55-D59 WeakPolarHBondContact CG-OD2 3.02Å; K55-D59 VanDerWaalsContact NZ-CG 3.32Å; K55-D59 IonicContact NZ-OD1 2.78Å; K55-D59 PolarHBondContact NZ-OD1 3.27Å; K55-D59 IonicContact NZ-OD2 2.91Å; K55-D59 PolarHBondContact NZ-OD2 3.27Å; K55-D59 VanDerWaalsContact O-CB 3.28Å; K55-D59 WeakPolarHBondContact O-CB 3.4Å; K55-D59 VanDerWaalsContact O-CG 3.26Å; K55-D59 PolarHBondContact O-N 3.35Å; D59-K63 WeakPolarHBondContact O-CG 3.36Å |
| 60 | N | 61.2 | Low | 61.8 | Low | 57 Ų | 57 | 107.1 Ų | 107.1 | 31% | 0.305 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -80.1 | -34.5 | 175.6 | -72.4 | -30.2 | 0 | 0 | 0 | 113.1 | H56 E57 L58 T62 K63 T64 | H56-N60 PolarHBondContact CD2-ND2 3.25Å; H56-N60 PolarHBondContact CE1-ND2 3.06Å; H56-N60 PolarHBondContact ND1-ND2 3.48Å; H56-N60 PolarHBondContact NE2-ND2 3.13Å; H56-N60 VanDerWaalsContact NE2-ND2 3.17Å; H56-N60 WeakPolarHBondContact O-CB 3.38Å; H56-N60 PolarHBondContact O-N 3.41Å; H56-N60 PolarHBondContact O-ND2 3.04Å; E57-N60 PolarHBondContact O-N 3.03Å; L58-N60 PolarHBondContact O-N 3.47Å; N60-T62 PolarHBondContact O-N 3.21Å; N60-K63 PolarHBondContact O-N 2.84Å; N60-K63 VanDerWaalsContact O-N 3.13Å; N60-T64 PolarHBondContact O-OG1 2.87Å |
| 61 | Q | 61.1 | Low | 60.8 | Low | 116 Ų | 116 | 111.2 Ų | 111.2 | 54% | 0.542 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -60 | -35.8 | 171.8 | -75.8 | 173 | 28.6 | 0 | 0 | 111.8 | E57 L58 K63 T64 | E57-Q61 WeakPolarHBondContact O-CG 3.45Å; E57-Q61 PolarHBondContact O-N 3.27Å; L58-Q61 PolarHBondContact O-N 2.04Å; Q61-K63 VanDerWaalsContact C-N 3.3Å; Q61-K63 PolarHBondContact O-N 3.34Å; Q61-T64 PolarHBondContact O-OG1 3.13Å |
| 62 | T | 57.3 | Low | 60.2 | Low | 111 Ų | 111 | 114.2 Ų | 114.2 | 68% | 0.681 | 58% | 0.575 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.4 | -16.7 | 178.5 | -41.7 | 0 | 0 | 0 | 0 | 113.1 | L58 N60 | L58-T62 PolarHBondContact O-N 2.89Å; L58-T62 PolarHBondContact O-OG1 3.09Å; N60-T62 PolarHBondContact O-N 3.21Å |
| 63 | K | 59.2 | Low | 59.7 | Low | 160 Ų | 160 | 112.8 Ų | 112.8 | 70% | 0.696 | 57% | 0.565 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.2 | -12.5 | 178 | -73.8 | 173.6 | -171.4 | 168.7 | 0 | 113.8 | D59 N60 Q61 | D59-K63 WeakPolarHBondContact O-CG 3.36Å; N60-K63 PolarHBondContact O-N 2.84Å; N60-K63 VanDerWaalsContact O-N 3.13Å; Q61-K63 VanDerWaalsContact C-N 3.3Å; Q61-K63 PolarHBondContact O-N 3.34Å |
| 64 | T | 53.6 | Low | 59.2 | Low | 118 Ų | 118 | 113.2 Ų | 113.2 | 72% | 0.724 | 56% | 0.563 | S | S | * | * | trans | -104.9 | 4 | -178.8 | 32.4 | 0 | 0 | 0 | 0 | 114.5 | N60 Q61 | N60-T64 PolarHBondContact O-OG1 2.87Å; Q61-T64 PolarHBondContact O-OG1 3.13Å | ||
| 65 | N | 50.6 | Low | 58.7 | Low | 208 Ų | 208 | 113.6 Ų | 113.6 | 100% | 1.112 | 58% | 0.576 | S | S | * | * | trans | -115.2 | 0 | 173.3 | -73.1 | -14 | 0 | 0 | 0 | 112 |
Retrieved 65 of 65 residues in 103.9 ms
(Link to these results)