| 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 | 42.3 | Very low | 51.3 | Low | 228 Ų | 228 | 124.7 Ų | 124.7 | 100% | 1.123 | 64% | 0.639 | S | S | * | * | 0 | 41.1 | 0 | -111.9 | -176.5 | 175.9 | 0 | 0 | 111.1 | |||||
| 2 | Y | 46 | Very low | 51.7 | Low | 198 Ų | 198 | 123.1 Ų | 123.1 | 78% | 0.776 | 63% | 0.631 | S | S | * | * | trans | -132.3 | 22.9 | -175.9 | -72.7 | -74.1 | 0 | 0 | 0 | 113.3 | P5 | Y2-P5 WeakPolarHBondContact O-CD 3.42Å; Y2-P5 WeakPolarHBondContact O-CG 3.22Å | ||
| 3 | D | 50.7 | Low | 52.3 | Low | 120 Ų | 120 | 122.5 Ų | 122.5 | 64% | 0.642 | 63% | 0.629 | S | S | * | * | trans | -85.4 | -16.7 | -179.3 | -65.3 | -82.8 | 0 | 0 | 0 | 113.9 | ||||
| 4 | L | 49.3 | Very low | 52.8 | Low | 145 Ų | 145 | 117.8 Ų | 117.8 | 76% | 0.759 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -68.5 | -39.6 | 179.6 | -153.9 | 71.9 | 0 | 0 | 0 | 115.1 | I6 N8 | L4-I6 PolarHBondContact O-N 3.07Å; L4-N8 WeakPolarHBondContact O-CB 3.33Å; L4-N8 PolarHBondContact O-N 3.23Å; L4-N8 VanDerWaalsContact O-N 3.07Å |
| 5 | P | 52.4 | Low | 53.4 | Low | 71 Ų | 71 | 118 Ų | 118 | 46% | 0.461 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -67.1 | -33.9 | -176.7 | 25.5 | -34.7 | 0 | 0 | 0 | 112.9 | Y2 N8 L9 | Y2-P5 WeakPolarHBondContact O-CD 3.42Å; Y2-P5 WeakPolarHBondContact O-CG 3.22Å; P5-N8 PolarHBondContact O-N 2.92Å; P5-L9 VanDerWaalsContact O-CB 3.26Å; P5-L9 WeakPolarHBondContact O-CB 3.18Å; P5-L9 PolarHBondContact O-N 3.44Å |
| 6 | I | 55.8 | Low | 53.6 | Low | 124 Ų | 124 | 115.4 Ų | 115.4 | 64% | 0.636 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -71.8 | -47.5 | -174.9 | -63.8 | 168.6 | 0 | 0 | 0 | 110.9 | L4 N8 L9 F10 | L4-I6 PolarHBondContact O-N 3.07Å; I6-N8 VanDerWaalsContact C-N 3.28Å; I6-N8 PolarHBondContact O-N 3.3Å; I6-L9 PolarHBondContact O-N 2.92Å; I6-F10 PolarHBondContact O-N 3.46Å |
| 7 | V | 52.2 | Low | 54.4 | Low | 96 Ų | 96 | 115.7 Ų | 115.7 | 58% | 0.582 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -63.1 | -41.3 | 175.7 | -177.6 | 0 | 0 | 0 | 0 | 109.7 | L9 F10 S11 | V7-L9 VanDerWaalsContact C-N 3.35Å; V7-L9 PolarHBondContact O-N 3.48Å; V7-F10 PolarHBondContact O-N 3.41Å; V7-S11 WeakPolarHBondContact O-CB 3.38Å; V7-S11 PolarHBondContact O-N 2.75Å; V7-S11 PolarHBondContact O-OG 3.27Å |
| 8 | N | 51.5 | Low | 55.1 | Low | 95 Ų | 95 | 116.4 Ų | 116.4 | 51% | 0.508 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -66.2 | -36.9 | 177.2 | -155.1 | 38.1 | 0 | 0 | 0 | 111.8 | L4 P5 I6 F10 S11 L12 | L4-N8 WeakPolarHBondContact O-CB 3.33Å; L4-N8 PolarHBondContact O-N 3.23Å; L4-N8 VanDerWaalsContact O-N 3.07Å; P5-N8 PolarHBondContact O-N 2.92Å; I6-N8 VanDerWaalsContact C-N 3.28Å; I6-N8 PolarHBondContact O-N 3.3Å; N8-F10 VanDerWaalsContact C-N 3.33Å; N8-S11 PolarHBondContact O-N 3.04Å; N8-L12 WeakPolarHBondContact O-CB 3.47Å; N8-L12 WeakPolarHBondContact O-CD1 3.13Å; N8-L12 WeakPolarHBondContact O-CG 3.5Å; N8-L12 PolarHBondContact O-N 2.69Å |
| 9 | L | 50.2 | Low | 55.5 | Low | 113 Ų | 113 | 116.3 Ų | 116.3 | 59% | 0.592 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -63.9 | -41.2 | 174.3 | -146.9 | 94.4 | 0 | 0 | 0 | 110.9 | P5 I6 V7 L13 | P5-L9 VanDerWaalsContact O-CB 3.26Å; P5-L9 WeakPolarHBondContact O-CB 3.18Å; P5-L9 PolarHBondContact O-N 3.44Å; I6-L9 PolarHBondContact O-N 2.92Å; V7-L9 VanDerWaalsContact C-N 3.35Å; V7-L9 PolarHBondContact O-N 3.48Å; L9-L13 HydrophobicContact CD2-CD1 4.42Å; L9-L13 WeakPolarHBondContact O-CB 3.13Å; L9-L13 WeakPolarHBondContact O-CG 3.26Å; L9-L13 PolarHBondContact O-N 3.39Å |
| 10 | F | 61.1 | Low | 56 | Low | 125 Ų | 125 | 115.8 Ų | 115.8 | 55% | 0.548 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -66.6 | -47.2 | 177.7 | -163.8 | -97.9 | 0 | 0 | 0 | 111.3 | I6 V7 N8 L12 L13 Q14 | I6-F10 PolarHBondContact O-N 3.46Å; V7-F10 PolarHBondContact O-N 3.41Å; N8-F10 VanDerWaalsContact C-N 3.33Å; F10-L12 PolarHBondContact O-N 3.44Å; F10-L13 PolarHBondContact O-N 2.82Å; F10-Q14 HydrophobicContact CD1-CG 4.2Å; F10-Q14 VanDerWaalsContact CD1-OE1 3.29Å; F10-Q14 VanDerWaalsContact CE1-CD 3.4Å; F10-Q14 HydrophobicContact CE1-CG 4.1Å; F10-Q14 WeakPolarHBondContact O-CB 3.48Å; F10-Q14 WeakPolarHBondContact O-CG 3.47Å; F10-Q14 PolarHBondContact O-N 2.86Å |
| 11 | S | 53.5 | Low | 56.4 | Low | 57 Ų | 57 | 113.4 Ų | 113.4 | 40% | 0.399 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -64.5 | -38.6 | 175.5 | -63.6 | 0 | 0 | 0 | 0 | 112.6 | V7 N8 Q14 L15 | V7-S11 WeakPolarHBondContact O-CB 3.38Å; V7-S11 PolarHBondContact O-N 2.75Å; V7-S11 PolarHBondContact O-OG 3.27Å; N8-S11 PolarHBondContact O-N 3.04Å; S11-Q14 PolarHBondContact O-N 3.24Å; S11-L15 PolarHBondContact O-N 3.27Å; S11-L15 VanDerWaalsContact O-N 3.09Å |
| 12 | L | 56.1 | Low | 57.9 | Low | 105 Ų | 105 | 107.7 Ų | 107.7 | 55% | 0.55 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -66.1 | -35 | 175.2 | -79.5 | 163.3 | 0 | 0 | 0 | 112.2 | N8 F10 P16 | N8-L12 WeakPolarHBondContact O-CB 3.47Å; N8-L12 WeakPolarHBondContact O-CD1 3.13Å; N8-L12 WeakPolarHBondContact O-CG 3.5Å; N8-L12 PolarHBondContact O-N 2.69Å; F10-L12 PolarHBondContact O-N 3.44Å; L12-P16 WeakPolarHBondContact O-CD 3.3Å |
| 13 | L | 59.1 | Low | 58.5 | Low | 115 Ų | 115 | 104.2 Ų | 104.2 | 60% | 0.602 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -76.2 | -29.9 | 173.8 | -78.6 | 165.7 | 0 | 0 | 0 | 112.5 | L9 F10 P16 | L9-L13 HydrophobicContact CD2-CD1 4.42Å; L9-L13 WeakPolarHBondContact O-CB 3.13Å; L9-L13 WeakPolarHBondContact O-CG 3.26Å; L9-L13 PolarHBondContact O-N 3.39Å; F10-L13 PolarHBondContact O-N 2.82Å; L13-P16 WeakPolarHBondContact O-CD 3.43Å; L13-P16 WeakPolarHBondContact O-CG 3.34Å |
| 14 | Q | 59.5 | Low | 58.8 | Low | 57 Ų | 57 | 103.4 Ų | 103.4 | 27% | 0.266 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -69 | -37 | 175.7 | -82.9 | 177.2 | -51.2 | 0 | 0 | 112.4 | F10 S11 Y17 Y18 | F10-Q14 HydrophobicContact CD1-CG 4.2Å; F10-Q14 VanDerWaalsContact CD1-OE1 3.29Å; F10-Q14 VanDerWaalsContact CE1-CD 3.4Å; F10-Q14 HydrophobicContact CE1-CG 4.1Å; F10-Q14 WeakPolarHBondContact O-CB 3.48Å; F10-Q14 WeakPolarHBondContact O-CG 3.47Å; F10-Q14 PolarHBondContact O-N 2.86Å; S11-Q14 PolarHBondContact O-N 3.24Å; Q14-Y17 CarbonylContact O-C 3.38Å; Q14-Y17 WeakPolarHBondContact O-CB 3.37Å; Q14-Y17 PolarHBondContact O-N 3.48Å; Q14-Y17 VanDerWaalsContact O-N 3.15Å; Q14-Y18 HydrophobicContact CB-CD2 3.96Å; Q14-Y18 HydrophobicContact CB-CE2 3.79Å; Q14-Y18 HydrophobicContact CG-CE2 4.13Å; Q14-Y18 WeakPolarHBondContact O-CD2 3.47Å; Q14-Y18 PolarHBondContact O-N 2.79Å |
| 15 | L | 62.1 | Low | 59.3 | Low | 121 Ų | 121 | 100.9 Ų | 100.9 | 63% | 0.634 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -56.2 | -53.5 | -179 | -167.2 | 77.8 | 0 | 0 | 0 | 113.7 | S11 Y17 Y18 L19 | S11-L15 PolarHBondContact O-N 3.27Å; S11-L15 VanDerWaalsContact O-N 3.09Å; L15-Y17 VanDerWaalsContact C-N 3.28Å; L15-Y17 PolarHBondContact O-N 2.84Å; L15-Y18 PolarHBondContact O-N 3.5Å; L15-L19 WeakPolarHBondContact O-CB 2.92Å; L15-L19 PolarHBondContact O-N 3.2Å |
| 16 | P | 55.6 | Low | 59.5 | Low | 76 Ų | 76 | 103.5 Ų | 103.5 | 49% | 0.494 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -66.8 | -31.5 | 176.3 | 27.7 | -34.5 | 0 | 0 | 0 | 111.5 | L12 L13 L19 L20 | L12-P16 WeakPolarHBondContact O-CD 3.3Å; L13-P16 WeakPolarHBondContact O-CD 3.43Å; L13-P16 WeakPolarHBondContact O-CG 3.34Å; P16-L19 PolarHBondContact O-N 3.29Å; P16-L20 WeakPolarHBondContact O-CB 3.39Å; P16-L20 PolarHBondContact O-N 3.09Å |
| 17 | Y | 67 | Low | 59.6 | Low | 121 Ų | 121 | 101.8 Ų | 101.8 | 48% | 0.475 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -62.4 | -47.8 | 174.3 | -179.1 | -98.9 | 0 | 0 | 0 | 111.4 | Q14 L15 L20 L21 | Q14-Y17 CarbonylContact O-C 3.38Å; Q14-Y17 WeakPolarHBondContact O-CB 3.37Å; Q14-Y17 PolarHBondContact O-N 3.48Å; Q14-Y17 VanDerWaalsContact O-N 3.15Å; L15-Y17 VanDerWaalsContact C-N 3.28Å; L15-Y17 PolarHBondContact O-N 2.84Å; Y17-L20 PolarHBondContact O-N 2.95Å; Y17-L21 HydrophobicContact CD1-CD1 4.32Å; Y17-L21 HydrophobicContact CE1-CD1 3.58Å; Y17-L21 HydrophobicContact CE2-CD1 4.26Å; Y17-L21 VanDerWaalsContact O-CB 3.3Å; Y17-L21 WeakPolarHBondContact O-CB 3.26Å; Y17-L21 PolarHBondContact O-N 2.89Å |
| 18 | Y | 67 | Low | 59.8 | Low | 128 Ų | 128 | 102.1 Ų | 102.1 | 50% | 0.502 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -66.6 | -40.1 | 176.9 | -75.7 | -65.7 | 0 | 0 | 0 | 112.3 | Q14 L15 L21 I22 | Q14-Y18 HydrophobicContact CB-CD2 3.96Å; Q14-Y18 HydrophobicContact CB-CE2 3.79Å; Q14-Y18 HydrophobicContact CG-CE2 4.13Å; Q14-Y18 WeakPolarHBondContact O-CD2 3.47Å; Q14-Y18 PolarHBondContact O-N 2.79Å; L15-Y18 PolarHBondContact O-N 3.5Å; Y18-L21 PolarHBondContact O-N 2.85Å; Y18-I22 WeakPolarHBondContact O-CB 3.32Å; Y18-I22 VanDerWaalsContact O-CG1 3.26Å; Y18-I22 WeakPolarHBondContact O-CG1 3.3Å; Y18-I22 PolarHBondContact O-N 3.24Å |
| 19 | L | 64.2 | Low | 59.8 | Low | 114 Ų | 114 | 102 Ų | 102 | 60% | 0.597 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -65.3 | -43 | 178 | -151.2 | 114 | 0 | 0 | 0 | 111.2 | L15 P16 L21 I22 E23 | L15-L19 WeakPolarHBondContact O-CB 2.92Å; L15-L19 PolarHBondContact O-N 3.2Å; P16-L19 PolarHBondContact O-N 3.29Å; L19-L21 VanDerWaalsContact C-N 3.33Å; L19-L21 PolarHBondContact O-N 3.44Å; L19-I22 PolarHBondContact O-N 3.46Å; L19-E23 PolarHBondContact O-N 3.28Å |
| 20 | L | 65.5 | Low | 60 | Low | 107 Ų | 107 | 102.7 Ų | 102.7 | 56% | 0.56 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -62.3 | -40.7 | 172.5 | -170.9 | 85.4 | 0 | 0 | 0 | 111.2 | P16 Y17 I22 E23 L24 | P16-L20 WeakPolarHBondContact O-CB 3.39Å; P16-L20 PolarHBondContact O-N 3.09Å; Y17-L20 PolarHBondContact O-N 2.95Å; L20-I22 VanDerWaalsContact C-N 3.33Å; L20-E23 PolarHBondContact O-N 3.44Å; L20-L24 HydrophobicContact CD2-CD1 4.35Å; L20-L24 HydrophobicContact CG-CD1 4.18Å; L20-L24 WeakPolarHBondContact O-CB 3.49Å; L20-L24 WeakPolarHBondContact O-CG 3.28Å; L20-L24 PolarHBondContact O-N 3.49Å |
| 21 | L | 62.9 | Low | 59.5 | Low | 65 Ų | 65 | 104.1 Ų | 104.1 | 34% | 0.34 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -65.4 | -38.8 | 177.4 | -143.7 | 119.7 | 0 | 0 | 0 | 111.1 | Y17 Y18 L19 L24 L25 | Y17-L21 HydrophobicContact CD1-CD1 4.32Å; Y17-L21 HydrophobicContact CE1-CD1 3.58Å; Y17-L21 HydrophobicContact CE2-CD1 4.26Å; Y17-L21 VanDerWaalsContact O-CB 3.3Å; Y17-L21 WeakPolarHBondContact O-CB 3.26Å; Y17-L21 PolarHBondContact O-N 2.89Å; Y18-L21 PolarHBondContact O-N 2.85Å; L19-L21 VanDerWaalsContact C-N 3.33Å; L19-L21 PolarHBondContact O-N 3.44Å; L21-L24 PolarHBondContact O-N 2.83Å; L21-L25 HydrophobicContact CD2-CD1 4.06Å; L21-L25 HydrophobicContact CD2-CG 4.46Å; L21-L25 WeakPolarHBondContact O-CB 3.44Å; L21-L25 VanDerWaalsContact O-CG 3.23Å; L21-L25 WeakPolarHBondContact O-CG 3.23Å; L21-L25 PolarHBondContact O-N 2.85Å |
| 22 | I | 73.7 | Confident | 59.2 | Low | 109 Ų | 109 | 107.4 Ų | 107.4 | 56% | 0.559 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -64.9 | -47.2 | 174.6 | -71.1 | 164.4 | 0 | 0 | 0 | 110.4 | Y18 L19 L20 L24 L25 N26 | Y18-I22 WeakPolarHBondContact O-CB 3.32Å; Y18-I22 VanDerWaalsContact O-CG1 3.26Å; Y18-I22 WeakPolarHBondContact O-CG1 3.3Å; Y18-I22 PolarHBondContact O-N 3.24Å; L19-I22 PolarHBondContact O-N 3.46Å; L20-I22 VanDerWaalsContact C-N 3.33Å; I22-L24 VanDerWaalsContact C-N 3.33Å; I22-L24 PolarHBondContact O-N 2.72Å; I22-L25 PolarHBondContact O-N 3.47Å; I22-N26 WeakPolarHBondContact O-CB 3.17Å; I22-N26 PolarHBondContact O-N 2.74Å |
| 23 | E | 58.7 | Low | 58.8 | Low | 125 Ų | 125 | 111 Ų | 111 | 58% | 0.584 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -59.5 | -43.4 | 175.2 | -72.9 | -118.6 | 119.1 | 0 | 0 | 111.6 | L19 L20 N26 L27 | L19-E23 PolarHBondContact O-N 3.28Å; L20-E23 PolarHBondContact O-N 3.44Å; E23-N26 PolarHBondContact O-N 3.39Å; E23-L27 WeakPolarHBondContact O-CB 3.34Å; E23-L27 WeakPolarHBondContact O-CG 3.11Å; E23-L27 PolarHBondContact O-N 3.19Å |
| 24 | L | 56.6 | Low | 58.5 | Low | 102 Ų | 102 | 114.8 Ų | 114.8 | 53% | 0.534 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -64.7 | -38.6 | 175.5 | -80.2 | 167.2 | 0 | 0 | 0 | 112.8 | L20 L21 I22 K28 | L20-L24 HydrophobicContact CD2-CD1 4.35Å; L20-L24 HydrophobicContact CG-CD1 4.18Å; L20-L24 WeakPolarHBondContact O-CB 3.49Å; L20-L24 WeakPolarHBondContact O-CG 3.28Å; L20-L24 PolarHBondContact O-N 3.49Å; L21-L24 PolarHBondContact O-N 2.83Å; I22-L24 VanDerWaalsContact C-N 3.33Å; I22-L24 PolarHBondContact O-N 2.72Å; L24-K28 WeakPolarHBondContact O-CB 3.37Å; L24-K28 PolarHBondContact O-N 3.34Å |
| 25 | L | 60.2 | Low | 57.7 | Low | 92 Ų | 92 | 119.4 Ų | 119.4 | 48% | 0.482 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -69.5 | -35.1 | 174.9 | -75.5 | 178.1 | 0 | 0 | 0 | 111.7 | L21 I22 K28 P29 | L21-L25 HydrophobicContact CD2-CD1 4.06Å; L21-L25 HydrophobicContact CD2-CG 4.46Å; L21-L25 WeakPolarHBondContact O-CB 3.44Å; L21-L25 VanDerWaalsContact O-CG 3.23Å; L21-L25 WeakPolarHBondContact O-CG 3.23Å; L21-L25 PolarHBondContact O-N 2.85Å; I22-L25 PolarHBondContact O-N 3.47Å; L25-K28 HydrophobicContact CD2-CD 3.94Å; L25-K28 WeakPolarHBondContact O-CB 3.41Å; L25-K28 PolarHBondContact O-N 3.42Å; L25-P29 WeakPolarHBondContact O-CD 3.12Å |
| 26 | N | 57.1 | Low | 57.1 | Low | 127 Ų | 127 | 117.4 Ų | 117.4 | 68% | 0.679 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -75.1 | -30.4 | 177.7 | -148 | 6.9 | 0 | 0 | 0 | 111.9 | I22 E23 P29 | I22-N26 WeakPolarHBondContact O-CB 3.17Å; I22-N26 PolarHBondContact O-N 2.74Å; E23-N26 PolarHBondContact O-N 3.39Å; N26-P29 WeakPolarHBondContact O-CD 3.28Å; N26-P29 WeakPolarHBondContact O-CG 3.33Å |
| 27 | L | 57.1 | Low | 56.8 | Low | 88 Ų | 88 | 119 Ų | 119 | 46% | 0.461 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -80.9 | -19.8 | 171 | -75.7 | 165.5 | 0 | 0 | 0 | 113.3 | E23 I30 Y31 | E23-L27 WeakPolarHBondContact O-CB 3.34Å; E23-L27 WeakPolarHBondContact O-CG 3.11Å; E23-L27 PolarHBondContact O-N 3.19Å; L27-I30 PolarHBondContact O-N 3.15Å; L27-Y31 PolarHBondContact O-N 2.88Å |
| 28 | K | 57.3 | Low | 56.2 | Low | 102 Ų | 102 | 122 Ų | 122 | 44% | 0.443 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -50.7 | -47.2 | -179.9 | -114.5 | -171.9 | -167.7 | 168.7 | 0 | 113.2 | L24 L25 I30 Y31 F32 | L24-K28 WeakPolarHBondContact O-CB 3.37Å; L24-K28 PolarHBondContact O-N 3.34Å; L25-K28 HydrophobicContact CD2-CD 3.94Å; L25-K28 WeakPolarHBondContact O-CB 3.41Å; L25-K28 PolarHBondContact O-N 3.42Å; K28-I30 PolarHBondContact O-N 2.8Å; K28-I30 VanDerWaalsContact O-N 3.08Å; K28-Y31 PolarHBondContact O-N 3.36Å; K28-Y31 VanDerWaalsContact O-N 3.14Å; K28-F32 HydrophobicContact CD-CD2 4.1Å; K28-F32 HydrophobicContact CD-CE2 4.38Å; K28-F32 HydrophobicContact CG-CD2 4.07Å; K28-F32 WeakPolarHBondContact O-CA 3.43Å; K28-F32 WeakPolarHBondContact O-CB 3.08Å; K28-F32 PolarHBondContact O-N 2.93Å |
| 29 | P | 52.3 | Low | 55.6 | Low | 94 Ų | 94 | 119 Ų | 119 | 61% | 0.61 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -56.2 | -33 | 180 | 20.1 | -32.4 | 0 | 0 | 0 | 113 | L25 N26 | L25-P29 WeakPolarHBondContact O-CD 3.12Å; N26-P29 WeakPolarHBondContact O-CD 3.28Å; N26-P29 WeakPolarHBondContact O-CG 3.33Å |
| 30 | I | 54.2 | Low | 55.4 | Low | 127 Ų | 127 | 116.5 Ų | 116.5 | 65% | 0.651 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -81 | -38.9 | 179.2 | -59 | 170.7 | 0 | 0 | 0 | 111.2 | L27 K28 | L27-I30 PolarHBondContact O-N 3.15Å; K28-I30 PolarHBondContact O-N 2.8Å; K28-I30 VanDerWaalsContact O-N 3.08Å |
| 31 | Y | 49 | Very low | 55.1 | Low | 154 Ų | 154 | 117.8 Ų | 117.8 | 60% | 0.604 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -90.2 | -22.7 | -175.7 | -120.1 | -87.4 | 0 | 0 | 0 | 115.1 | L27 K28 Q33 Y34 Y35 | L27-Y31 PolarHBondContact O-N 2.88Å; K28-Y31 PolarHBondContact O-N 3.36Å; K28-Y31 VanDerWaalsContact O-N 3.14Å; Y31-Q33 PolarHBondContact O-N 3.29Å; Y31-Y34 PolarHBondContact O-N 3.49Å; Y31-Y35 HydrophobicContact CE1-CD2 4.2Å; Y31-Y35 PolarHBondContact O-N 2.78Å |
| 32 | F | 47.6 | Very low | 55.2 | Low | 127 Ų | 127 | 121 Ų | 121 | 56% | 0.557 | 60% | 0.598 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.7 | -28.8 | -178.5 | -150.3 | -99.5 | 0 | 0 | 0 | 111.2 | K28 Y34 | K28-F32 HydrophobicContact CD-CD2 4.1Å; K28-F32 HydrophobicContact CD-CE2 4.38Å; K28-F32 HydrophobicContact CG-CD2 4.07Å; K28-F32 WeakPolarHBondContact O-CA 3.43Å; K28-F32 WeakPolarHBondContact O-CB 3.08Å; K28-F32 PolarHBondContact O-N 2.93Å; F32-Y34 VanDerWaalsContact C-N 3.28Å; F32-Y34 PolarHBondContact O-N 3.38Å |
| 33 | Q | 48.4 | Very low | 54.5 | Low | 181 Ų | 181 | 119.5 Ų | 119.5 | 85% | 0.846 | 59% | 0.594 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73 | -21 | 174.3 | -137.3 | 174.2 | 7.4 | 0 | 0 | 112.7 | Y31 | Y31-Q33 PolarHBondContact O-N 3.29Š|
| 34 | Y | 52.3 | Low | 54.6 | Low | 194 Ų | 194 | 117.7 Ų | 117.7 | 76% | 0.761 | 59% | 0.591 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101 | -23.3 | -170.6 | -127.7 | -87.3 | 0 | 0 | 0 | 115.6 | Y31 F32 | Y31-Y34 PolarHBondContact O-N 3.49Å; F32-Y34 VanDerWaalsContact C-N 3.28Å; F32-Y34 PolarHBondContact O-N 3.38Å |
| 35 | Y | 43.9 | Very low | 54.6 | Low | 154 Ų | 154 | 117.3 Ų | 117.3 | 60% | 0.604 | 59% | 0.589 | S | S | * | * | S | Bend | trans | -136.1 | 28.2 | -174.2 | -95.8 | -90.6 | 0 | 0 | 0 | 115.6 | Y31 T37 | Y31-Y35 HydrophobicContact CE1-CD2 4.2Å; Y31-Y35 PolarHBondContact O-N 2.78Å; Y35-T37 VanDerWaalsContact C-N 3.31Å; Y35-T37 PolarHBondContact O-N 3.46Å |
| 36 | S | 47.8 | Very low | 54.5 | Low | 78 Ų | 78 | 117.7 Ų | 117.7 | 55% | 0.545 | 59% | 0.591 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -49.2 | -6.5 | -161.4 | -167.2 | 0 | 0 | 0 | 0 | 121.1 | ||
| 37 | T | 51.2 | Low | 54.7 | Low | 111 Ų | 111 | 115.8 Ų | 115.8 | 68% | 0.681 | 58% | 0.581 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -141.9 | -38.2 | 178.5 | 53.8 | 0 | 0 | 0 | 0 | 116.3 | Y35 S39 | Y35-T37 VanDerWaalsContact C-N 3.31Å; Y35-T37 PolarHBondContact O-N 3.46Å; T37-S39 VanDerWaalsContact C-N 3.33Å; T37-S39 PolarHBondContact O-N 2.87Å |
| 38 | K | 52.6 | Low | 54.7 | Low | 183 Ų | 183 | 115.7 Ų | 115.7 | 80% | 0.796 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -70.6 | -28 | -175.8 | -67 | -175.1 | 179.9 | 179.2 | 0 | 113.3 | ||
| 39 | S | 56 | Low | 54.5 | Low | 65 Ų | 65 | 116.8 Ų | 116.8 | 46% | 0.455 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -80.6 | -30.7 | -177.3 | -162.8 | 0 | 0 | 0 | 0 | 113.6 | T37 H41 F42 V43 | T37-S39 VanDerWaalsContact C-N 3.33Å; T37-S39 PolarHBondContact O-N 2.87Å; S39-H41 VanDerWaalsContact C-N 3.29Å; S39-H41 PolarHBondContact O-N 3.39Å; S39-F42 PolarHBondContact O-N 3.11Å; S39-V43 PolarHBondContact O-N 2.85Å |
| 40 | A | 58.7 | Low | 54.2 | Low | 62 Ų | 62 | 115.7 Ų | 115.7 | 51% | 0.512 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -64 | -37.9 | -180 | 0 | 0 | 0 | 0 | 0 | 111.4 | F42 V43 V44 | A40-F42 VanDerWaalsContact C-N 3.3Å; A40-F42 PolarHBondContact O-N 2.93Å; A40-V43 PolarHBondContact O-N 3.49Å; A40-V44 WeakPolarHBondContact O-CG2 3.48Å; A40-V44 PolarHBondContact O-N 2.84Å; A40-V44 VanDerWaalsContact O-N 3.09Å |
| 41 | H | 59.5 | Low | 54.2 | Low | 133 Ų | 133 | 114.3 Ų | 114.3 | 62% | 0.616 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -59.5 | -40.3 | 175.7 | -171.8 | -107.6 | 0 | 0 | 0 | 112.3 | S39 L45 | S39-H41 VanDerWaalsContact C-N 3.29Å; S39-H41 PolarHBondContact O-N 3.39Å; H41-L45 WeakPolarHBondContact O-CG 3.14Å; H41-L45 PolarHBondContact O-N 2.89Å; H41-L45 VanDerWaalsContact O-N 3.13Å |
| 42 | F | 64.5 | Low | 54.3 | Low | 134 Ų | 134 | 112.3 Ų | 112.3 | 59% | 0.588 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -67.9 | -40.4 | 178.1 | -173.1 | -106.2 | 0 | 0 | 0 | 112.4 | S39 A40 V44 L45 L46 | S39-F42 PolarHBondContact O-N 3.11Å; A40-F42 VanDerWaalsContact C-N 3.3Å; A40-F42 PolarHBondContact O-N 2.93Å; F42-V44 PolarHBondContact O-N 3.5Å; F42-L45 PolarHBondContact O-N 3.24Å; F42-L46 HydrophobicContact CD1-CD1 3.88Å; F42-L46 HydrophobicContact CE1-CD1 3.31Å; F42-L46 HydrophobicContact CZ-CD1 3.7Å; F42-L46 WeakPolarHBondContact O-CB 3.43Å; F42-L46 PolarHBondContact O-N 3.48Å |
| 43 | V | 59.4 | Low | 54.5 | Low | 76 Ų | 76 | 111.2 Ų | 111.2 | 46% | 0.461 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -65.2 | -39.4 | 178 | 177.6 | 0 | 0 | 0 | 0 | 111.7 | S39 A40 L46 L47 | S39-V43 PolarHBondContact O-N 2.85Å; A40-V43 PolarHBondContact O-N 3.49Å; V43-L46 PolarHBondContact O-N 2.94Å; V43-L47 HydrophobicContact CG1-CD1 4.37Å; V43-L47 WeakPolarHBondContact O-CG 3.36Å; V43-L47 PolarHBondContact O-N 3.28Å |
| 44 | V | 61.1 | Low | 54.6 | Low | 87 Ų | 87 | 105.7 Ų | 105.7 | 53% | 0.527 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -65.3 | -43.6 | 176 | 175.4 | 0 | 0 | 0 | 0 | 111.1 | A40 F42 L46 L47 V48 | A40-V44 WeakPolarHBondContact O-CG2 3.48Å; A40-V44 PolarHBondContact O-N 2.84Å; A40-V44 VanDerWaalsContact O-N 3.09Å; F42-V44 PolarHBondContact O-N 3.5Å; V44-L46 VanDerWaalsContact C-N 3.3Å; V44-L46 PolarHBondContact O-N 3.18Å; V44-L47 WeakPolarHBondContact O-CB 3.3Å; V44-L47 PolarHBondContact O-N 3.42Å; V44-V48 WeakPolarHBondContact O-CG2 3.29Å; V44-V48 PolarHBondContact O-N 3.3Å |
| 45 | L | 56.9 | Low | 54.7 | Low | 94 Ų | 94 | 101.2 Ų | 101.2 | 49% | 0.492 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -60 | -41.6 | 174.5 | -77.6 | 169 | 0 | 0 | 0 | 111.9 | H41 F42 L47 V48 H49 | H41-L45 WeakPolarHBondContact O-CG 3.14Å; H41-L45 PolarHBondContact O-N 2.89Å; H41-L45 VanDerWaalsContact O-N 3.13Å; F42-L45 PolarHBondContact O-N 3.24Å; L45-L47 VanDerWaalsContact C-N 3.33Å; L45-L47 PolarHBondContact O-N 2.95Å; L45-V48 PolarHBondContact O-N 3.22Å; L45-H49 WeakPolarHBondContact O-CB 3.34Å; L45-H49 PolarHBondContact O-N 3.48Å |
| 46 | L | 58.1 | Low | 55 | Low | 100 Ų | 100 | 99 Ų | 99 | 52% | 0.524 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -62.4 | -40.5 | 175.7 | -124.6 | 137.5 | 0 | 0 | 0 | 111.6 | F42 V43 V44 C50 | F42-L46 HydrophobicContact CD1-CD1 3.88Å; F42-L46 HydrophobicContact CE1-CD1 3.31Å; F42-L46 HydrophobicContact CZ-CD1 3.7Å; F42-L46 WeakPolarHBondContact O-CB 3.43Å; F42-L46 PolarHBondContact O-N 3.48Å; V43-L46 PolarHBondContact O-N 2.94Å; V44-L46 VanDerWaalsContact C-N 3.3Å; V44-L46 PolarHBondContact O-N 3.18Å; L46-C50 WeakPolarHBondContact O-CB 3.42Å; L46-C50 PolarHBondContact O-N 2.92Å |
| 47 | L | 60.1 | Low | 55.1 | Low | 88 Ų | 88 | 100.7 Ų | 100.7 | 46% | 0.461 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -65.5 | -40.6 | 174.9 | -78.3 | 168 | 0 | 0 | 0 | 112.6 | V43 V44 L45 C50 N51 | V43-L47 HydrophobicContact CG1-CD1 4.37Å; V43-L47 WeakPolarHBondContact O-CG 3.36Å; V43-L47 PolarHBondContact O-N 3.28Å; V44-L47 WeakPolarHBondContact O-CB 3.3Å; V44-L47 PolarHBondContact O-N 3.42Å; L45-L47 VanDerWaalsContact C-N 3.33Å; L45-L47 PolarHBondContact O-N 2.95Å; L47-C50 PolarHBondContact O-N 2.9Å; L47-N51 WeakPolarHBondContact O-CB 3.49Å; L47-N51 PolarHBondContact O-N 2.83Å |
| 48 | V | 58.3 | Low | 54.9 | Low | 86 Ų | 86 | 97.7 Ų | 97.7 | 52% | 0.521 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -65.6 | -48.2 | 176.7 | 172.2 | 0 | 0 | 0 | 0 | 110.5 | V44 L45 C50 N51 E52 | V44-V48 WeakPolarHBondContact O-CG2 3.29Å; V44-V48 PolarHBondContact O-N 3.3Å; L45-V48 PolarHBondContact O-N 3.22Å; V48-C50 VanDerWaalsContact C-N 3.28Å; V48-C50 PolarHBondContact O-N 2.85Å; V48-N51 PolarHBondContact O-N 3.43Å; V48-E52 PolarHBondContact O-N 2.87Å |
| 49 | H | 52.1 | Low | 54.6 | Low | 125 Ų | 125 | 97.3 Ų | 97.3 | 58% | 0.579 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -65.5 | -34 | 179.2 | -161 | -81.4 | 0 | 0 | 0 | 111.8 | L45 H53 | L45-H49 WeakPolarHBondContact O-CB 3.34Å; L45-H49 PolarHBondContact O-N 3.48Å; H49-H53 PolarHBondContact O-N 3.39Å; H49-H53 VanDerWaalsContact O-N 3.11Å |
| 50 | C | 47.3 | Very low | 54.1 | Low | 71 Ų | 71 | 103.2 Ų | 103.2 | 48% | 0.48 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -69.5 | -41.5 | 174.5 | -156.1 | 0 | 0 | 0 | 0 | 111.4 | L46 L47 V48 E52 H53 V54 | L46-C50 WeakPolarHBondContact O-CB 3.42Å; L46-C50 PolarHBondContact O-N 2.92Å; L47-C50 PolarHBondContact O-N 2.9Å; V48-C50 VanDerWaalsContact C-N 3.28Å; V48-C50 PolarHBondContact O-N 2.85Å; C50-E52 PolarHBondContact O-N 3.28Å; C50-H53 PolarHBondContact O-N 3.22Å; C50-V54 WeakPolarHBondContact O-CB 3.26Å; C50-V54 VanDerWaalsContact O-CG2 3.28Å; C50-V54 WeakPolarHBondContact O-CG2 3.5Å; C50-V54 PolarHBondContact O-N 2.94Å |
| 51 | N | 53.6 | Low | 53.7 | Low | 97 Ų | 97 | 102.9 Ų | 102.9 | 52% | 0.519 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -62.7 | -41 | 173.9 | -100.2 | -40.7 | 0 | 0 | 0 | 112.1 | L47 V48 H53 V54 I55 | L47-N51 WeakPolarHBondContact O-CB 3.49Å; L47-N51 PolarHBondContact O-N 2.83Å; V48-N51 PolarHBondContact O-N 3.43Å; N51-H53 VanDerWaalsContact C-N 3.33Å; N51-H53 PolarHBondContact O-N 3.45Å; N51-V54 PolarHBondContact O-N 3.33Å; N51-I55 VanDerWaalsContact O-CB 3.29Å; N51-I55 WeakPolarHBondContact O-CB 3.41Å; N51-I55 WeakPolarHBondContact O-CD1 3.41Å; N51-I55 WeakPolarHBondContact O-CG1 3.34Å; N51-I55 PolarHBondContact O-N 3.21Å |
| 52 | E | 51.4 | Low | 52.9 | Low | 113 Ų | 113 | 99.9 Ų | 99.9 | 53% | 0.528 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -63 | -42 | 176.3 | -169.1 | 169.9 | 122.5 | 0 | 0 | 111.3 | V48 C50 I55 Q56 | V48-E52 PolarHBondContact O-N 2.87Å; C50-E52 PolarHBondContact O-N 3.28Å; E52-I55 PolarHBondContact O-N 3.28Å; E52-Q56 WeakPolarHBondContact O-CB 3.35Å; E52-Q56 VanDerWaalsContact O-CG 3.3Å; E52-Q56 WeakPolarHBondContact O-CG 3.23Å; E52-Q56 PolarHBondContact O-N 3.5Å |
| 53 | H | 50.3 | Low | 52 | Low | 103 Ų | 103 | 104.4 Ų | 104.4 | 48% | 0.477 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -66.5 | -39.1 | 177.6 | -129.8 | -81 | 0 | 0 | 0 | 112.7 | H49 C50 N51 L57 | H49-H53 PolarHBondContact O-N 3.39Å; H49-H53 VanDerWaalsContact O-N 3.11Å; C50-H53 PolarHBondContact O-N 3.22Å; N51-H53 VanDerWaalsContact C-N 3.33Å; N51-H53 PolarHBondContact O-N 3.45Å; H53-L57 VanDerWaalsContact O-CB 3.28Å; H53-L57 WeakPolarHBondContact O-CB 3.48Å; H53-L57 WeakPolarHBondContact O-CG 3.49Å; H53-L57 PolarHBondContact O-N 2.83Å |
| 54 | V | 52.1 | Low | 51 | Low | 66 Ų | 66 | 107 Ų | 107 | 40% | 0.4 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -69.3 | -42 | 174.9 | 172.3 | 0 | 0 | 0 | 0 | 110.7 | C50 N51 Q56 L57 S58 | C50-V54 WeakPolarHBondContact O-CB 3.26Å; C50-V54 VanDerWaalsContact O-CG2 3.28Å; C50-V54 WeakPolarHBondContact O-CG2 3.5Å; C50-V54 PolarHBondContact O-N 2.94Å; N51-V54 PolarHBondContact O-N 3.33Å; V54-Q56 VanDerWaalsContact C-N 3.33Å; V54-Q56 PolarHBondContact O-N 3.21Å; V54-L57 PolarHBondContact O-N 3.41Å; V54-S58 VanDerWaalsContact O-CB 3.23Å; V54-S58 WeakPolarHBondContact O-CB 3.42Å; V54-S58 PolarHBondContact O-N 3.09Å |
| 55 | I | 54.3 | Low | 50.2 | Low | 100 Ų | 100 | 107.3 Ų | 107.3 | 51% | 0.513 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -63.3 | -42.2 | 175.7 | -70.1 | 164.4 | 0 | 0 | 0 | 109.8 | N51 E52 S58 Y59 | N51-I55 VanDerWaalsContact O-CB 3.29Å; N51-I55 WeakPolarHBondContact O-CB 3.41Å; N51-I55 WeakPolarHBondContact O-CD1 3.41Å; N51-I55 WeakPolarHBondContact O-CG1 3.34Å; N51-I55 PolarHBondContact O-N 3.21Å; E52-I55 PolarHBondContact O-N 3.28Å; I55-S58 CarbonylContact O-C 3.48Å; I55-S58 WeakPolarHBondContact O-CB 3.5Å; I55-S58 PolarHBondContact O-N 3.39Å; I55-Y59 WeakPolarHBondContact O-CB 3.35Å; I55-Y59 PolarHBondContact O-N 3.35Å |
| 56 | Q | 49.2 | Very low | 49.3 | Very low | 106 Ų | 106 | 111.6 Ų | 111.6 | 50% | 0.495 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -67.7 | -41.6 | 176.3 | -76.9 | -179.4 | -5.9 | 0 | 0 | 112.8 | E52 V54 Y59 K60 | E52-Q56 WeakPolarHBondContact O-CB 3.35Å; E52-Q56 VanDerWaalsContact O-CG 3.3Å; E52-Q56 WeakPolarHBondContact O-CG 3.23Å; E52-Q56 PolarHBondContact O-N 3.5Å; V54-Q56 VanDerWaalsContact C-N 3.33Å; V54-Q56 PolarHBondContact O-N 3.21Å; Q56-Y59 PolarHBondContact O-N 3.39Å; Q56-K60 WeakPolarHBondContact O-CB 3.32Å; Q56-K60 PolarHBondContact O-N 3Å |
| 57 | L | 49.7 | Very low | 48.2 | Very low | 115 Ų | 115 | 113.9 Ų | 113.9 | 60% | 0.602 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -62 | -46.1 | 172.7 | -90.2 | 157.7 | 0 | 0 | 0 | 110.7 | H53 V54 Y59 K60 G61 | H53-L57 VanDerWaalsContact O-CB 3.28Å; H53-L57 WeakPolarHBondContact O-CB 3.48Å; H53-L57 WeakPolarHBondContact O-CG 3.49Å; H53-L57 PolarHBondContact O-N 2.83Å; V54-L57 PolarHBondContact O-N 3.41Å; L57-Y59 VanDerWaalsContact C-N 3.31Å; L57-Y59 PolarHBondContact O-N 3.13Å; L57-K60 PolarHBondContact O-N 3.14Å; L57-G61 PolarHBondContact O-N 3.01Å |
| 58 | S | 48.3 | Very low | 47.1 | Very low | 47 Ų | 47 | 116.3 Ų | 116.3 | 33% | 0.329 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -54.7 | -48.8 | 169.6 | -92.3 | 0 | 0 | 0 | 0 | 109.6 | V54 I55 K60 G61 F62 | V54-S58 VanDerWaalsContact O-CB 3.23Å; V54-S58 WeakPolarHBondContact O-CB 3.42Å; V54-S58 PolarHBondContact O-N 3.09Å; I55-S58 CarbonylContact O-C 3.48Å; I55-S58 WeakPolarHBondContact O-CB 3.5Å; I55-S58 PolarHBondContact O-N 3.39Å; S58-K60 PolarHBondContact O-N 2.87Å; S58-G61 CarbonylContact O-C 3.56Å; S58-G61 PolarHBondContact O-N 2.95Å; S58-F62 WeakPolarHBondContact O-CA 3.45Å; S58-F62 WeakPolarHBondContact O-CB 3.48Å; S58-F62 VanDerWaalsContact O-CD2 3.26Å; S58-F62 WeakPolarHBondContact O-CD2 3.36Å; S58-F62 PolarHBondContact O-N 3.35Å |
| 59 | Y | 46.5 | Very low | 45.7 | Very low | 176 Ų | 176 | 117.6 Ų | 117.6 | 69% | 0.69 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -65 | -40.4 | -177.4 | -130.3 | -97.2 | 0 | 0 | 0 | 113.2 | I55 Q56 L57 F62 R63 | I55-Y59 WeakPolarHBondContact O-CB 3.35Å; I55-Y59 PolarHBondContact O-N 3.35Å; Q56-Y59 PolarHBondContact O-N 3.39Å; L57-Y59 VanDerWaalsContact C-N 3.31Å; L57-Y59 PolarHBondContact O-N 3.13Å; Y59-F62 PolarHBondContact O-N 3.38Å; Y59-R63 PolarHBondContact O-N 2.84Å |
| 60 | K | 45.7 | Very low | 44.7 | Very low | 189 Ų | 189 | 116.5 Ų | 116.5 | 82% | 0.822 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -68.7 | -38.4 | 175.3 | -113.4 | 174.9 | 177.7 | 171.4 | 0 | 111.4 | Q56 L57 S58 F62 | Q56-K60 WeakPolarHBondContact O-CB 3.32Å; Q56-K60 PolarHBondContact O-N 3Å; L57-K60 PolarHBondContact O-N 3.14Å; S58-K60 PolarHBondContact O-N 2.87Å; K60-F62 VanDerWaalsContact C-N 3.32Å |
| 61 | G | 49.4 | Very low | 44.2 | Very low | 54 Ų | 54 | 120.3 Ų | 120.3 | 56% | 0.557 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -68.1 | -29.9 | 170 | 0 | 0 | 0 | 0 | 0 | 113.3 | L57 S58 R63 N64 | L57-G61 PolarHBondContact O-N 3.01Å; S58-G61 CarbonylContact O-C 3.56Å; S58-G61 PolarHBondContact O-N 2.95Å; G61-R63 VanDerWaalsContact C-N 3.33Å; G61-R63 PolarHBondContact O-N 3.29Å; G61-N64 PolarHBondContact O-N 3.08Å |
| 62 | F | 42.2 | Very low | 43.3 | Very low | 70 Ų | 70 | 125.7 Ų | 125.7 | 31% | 0.307 | 64% | 0.638 | S | S | . | * | H | α-helix | trans | -77.7 | -11 | -179.7 | -107.3 | -91.2 | 0 | 0 | 0 | 114.2 | S58 Y59 K60 N64 P65 F68 | S58-F62 WeakPolarHBondContact O-CA 3.45Å; S58-F62 WeakPolarHBondContact O-CB 3.48Å; S58-F62 VanDerWaalsContact O-CD2 3.26Å; S58-F62 WeakPolarHBondContact O-CD2 3.36Å; S58-F62 PolarHBondContact O-N 3.35Å; Y59-F62 PolarHBondContact O-N 3.38Å; K60-F62 VanDerWaalsContact C-N 3.32Å; F62-N64 CarbonylContact O-C 3.58Å; F62-N64 PolarHBondContact O-N 2.73Å; F62-P65 VanDerWaalsContact O-CA 3.3Å; F62-P65 WeakPolarHBondContact O-CA 3.43Å; F62-P65 WeakPolarHBondContact O-CB 3.42Å; F62-P65 WeakPolarHBondContact O-CD 3.48Å; F62-P65 VanDerWaalsContact O-N 3.15Å; F62-F68 HydrophobicContact CD2-CB 4.43Å; F62-F68 HydrophobicContact CE1-CB 4.45Å; F62-F68 HydrophobicContact CE2-CB 3.61Å; F62-F68 AromaticContact CE2-CD1 3.66Å; F62-F68 HydrophobicContact CE2-CD1 3.66Å; F62-F68 HydrophobicContact CE2-CG 4.05Å; F62-F68 HydrophobicContact CZ-CB 3.63Å; F62-F68 HydrophobicContact CZ-CD1 4.05Å; F62-F68 HydrophobicContact CZ-CG 4.34Å |
| 63 | R | 45.5 | Very low | 42.9 | Very low | 230 Ų | 230 | 126.4 Ų | 126.4 | 87% | 0.868 | 64% | 0.644 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.3 | 1.1 | 166.3 | -87.6 | -167.8 | 173.2 | -170.7 | -0.6 | 113.2 | Y59 G61 P65 | Y59-R63 PolarHBondContact O-N 2.84Å; G61-R63 VanDerWaalsContact C-N 3.33Å; G61-R63 PolarHBondContact O-N 3.29Å; R63-P65 VanDerWaalsContact C-CD 3.48Å; R63-P65 WeakPolarHBondContact O-CD 3.08Å |
| 64 | N | 38.9 | Very low | 42.5 | Very low | 129 Ų | 129 | 127.6 Ų | 127.6 | 69% | 0.69 | 65% | 0.653 | S | S | * | * | S | Bend | trans | -107.9 | 81.2 | 150.6 | -149.5 | 46.8 | 0 | 0 | 0 | 110.6 | G61 F62 K66 | G61-N64 PolarHBondContact O-N 3.08Å; F62-N64 CarbonylContact O-C 3.58Å; F62-N64 PolarHBondContact O-N 2.73Å; N64-K66 PolarHBondContact O-N 3.47Å |
| 65 | P | 44.2 | Very low | 42 | Very low | 95 Ų | 95 | 131 Ų | 131 | 62% | 0.617 | 67% | 0.667 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.6 | 17.8 | -159.9 | 30 | -37.5 | 0 | 0 | 0 | 116.4 | F62 R63 | F62-P65 VanDerWaalsContact O-CA 3.3Å; F62-P65 WeakPolarHBondContact O-CA 3.43Å; F62-P65 WeakPolarHBondContact O-CB 3.42Å; F62-P65 WeakPolarHBondContact O-CD 3.48Å; F62-P65 VanDerWaalsContact O-N 3.15Å; R63-P65 VanDerWaalsContact C-CD 3.48Å; R63-P65 WeakPolarHBondContact O-CD 3.08Å |
| 66 | K | 37.7 | Very low | 41.2 | Very low | 183 Ų | 183 | 132.8 Ų | 132.8 | 80% | 0.796 | 68% | 0.676 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.8 | -7.8 | -176.8 | -90.1 | -172.6 | 176.3 | -178.2 | 0 | 116.2 | N64 | N64-K66 PolarHBondContact O-N 3.47Š|
| 67 | H | 35 | Very low | 40.7 | Very low | 148 Ų | 148 | 134.5 Ų | 134.5 | 69% | 0.685 | 69% | 0.687 | S | S | * | * | S | Bend | trans | -128.5 | 5.4 | -165.1 | -96.3 | -84.3 | 0 | 0 | 0 | 119.4 | ||
| 68 | F | 38.3 | Very low | 40.1 | Very low | 139 Ų | 139 | 135.8 Ų | 135.8 | 61% | 0.61 | 69% | 0.693 | S | S | * | * | S | Bend | trans | -136.3 | 5.5 | -179.8 | -154.2 | -94.8 | 0 | 0 | 0 | 116.2 | F62 | F62-F68 HydrophobicContact CD2-CB 4.43Å; F62-F68 HydrophobicContact CE1-CB 4.45Å; F62-F68 HydrophobicContact CE2-CB 3.61Å; F62-F68 AromaticContact CE2-CD1 3.66Å; F62-F68 HydrophobicContact CE2-CD1 3.66Å; F62-F68 HydrophobicContact CE2-CG 4.05Å; F62-F68 HydrophobicContact CZ-CB 3.63Å; F62-F68 HydrophobicContact CZ-CD1 4.05Å; F62-F68 HydrophobicContact CZ-CG 4.34Å |
| 69 | C | 29 | Very low | 39.6 | Very low | 114 Ų | 114 | 142.1 Ų | 142.1 | 77% | 0.77 | 72% | 0.719 | S | S | * | * | S | Bend | trans | -83.8 | 4.2 | 161.2 | -161.9 | 0 | 0 | 0 | 0 | 111.8 | ||
| 70 | V | 31.1 | Very low | 39 | Very low | 102 Ų | 102 | 139.5 Ų | 139.5 | 62% | 0.618 | 72% | 0.721 | S | S | * | * | S | Bend | trans | -117.4 | 117 | 179.8 | -164 | 0 | 0 | 0 | 0 | 106 | ||
| 71 | M | 36 | Very low | 38.5 | Very low | 151 Ų | 151 | 135.4 Ų | 135.4 | 74% | 0.744 | 71% | 0.712 | S | S | * | * | trans | 85.7 | 80.7 | -172.8 | -46.2 | -170.2 | -64.2 | 0 | 0 | 111.9 | ||||
| 72 | T | 34.5 | Very low | 37.5 | Very low | 210 Ų | 210 | 142.8 Ų | 142.8 | 100% | 1.288 | 73% | 0.727 | S | S | * | * | 29.2 | 0 | 66.9 | 64.9 | 0 | 0 | 0 | 0 | 113.5 |
Retrieved 72 of 72 residues in 44.8 ms
(Link to these results)