| 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 | 58.7 | Low | 61.2 | Low | 249 Ų | 249 | 144.6 Ų | 144.6 | 100% | 1.227 | 86% | 0.858 | S | S | * | * | 0 | 118.4 | 0 | -82 | -178.4 | 166.7 | 0 | 0 | 109.4 | |||||
| 2 | S | 60.2 | Low | 62.6 | Low | 107 Ų | 107 | 152.7 Ų | 152.7 | 75% | 0.748 | 86% | 0.862 | S | S | * | * | trans | -158.9 | 74.6 | 161.9 | 167.6 | 0 | 0 | 0 | 0 | 108.1 | R4 | S2-R4 PolarHBondContact O-N 2.86Š| ||
| 3 | G | 61.2 | Low | 64 | Low | 89 Ų | 89 | 147.8 Ų | 147.8 | 92% | 0.918 | 85% | 0.853 | S | S | * | * | trans | -74.2 | 99.8 | 162 | 0 | 0 | 0 | 0 | 0 | 108 | ||||
| 4 | R | 61.4 | Low | 65.5 | Low | 236 Ų | 236 | 151.6 Ų | 151.6 | 89% | 0.891 | 86% | 0.855 | S | S | * | * | trans | -113.6 | 92.6 | 177.8 | -159 | 154.2 | -180 | 154.2 | -2.8 | 110.1 | S2 | S2-R4 PolarHBondContact O-N 2.86Š| ||
| 5 | G | 57.6 | Low | 67.1 | Low | 62 Ų | 62 | 147.9 Ų | 147.9 | 64% | 0.639 | 85% | 0.851 | S | S | * | * | trans | 60.9 | 92.7 | 143.6 | 0 | 0 | 0 | 0 | 0 | 117.2 | Q7 | G5-Q7 PolarHBondContact O-N 3.1Š| ||
| 6 | K | 58.5 | Low | 68.7 | Low | 217 Ų | 217 | 148.2 Ų | 148.2 | 94% | 0.943 | 84% | 0.839 | S | S | * | * | trans | -64.8 | 80.1 | 154.6 | -162 | 178.1 | -171.4 | 179.2 | 0 | 107.3 | G8 | K6-G8 PolarHBondContact O-N 2.9Å; K6-G8 VanDerWaalsContact O-N 3.14Å | ||
| 7 | Q | 56.7 | Low | 70.3 | Confident | 182 Ų | 182 | 143.3 Ų | 143.3 | 85% | 0.85 | 82% | 0.816 | S | S | * | * | trans | -50 | 123.1 | 174.1 | -87.1 | 179.7 | -11.7 | 0 | 0 | 107.6 | G5 G9 | G5-Q7 PolarHBondContact O-N 3.1Å; Q7-G9 PolarHBondContact O-N 2.85Å | ||
| 8 | G | 55.4 | Low | 71.8 | Confident | 73 Ų | 73 | 140.5 Ų | 140.5 | 75% | 0.753 | 79% | 0.79 | S | S | * | * | trans | -40.9 | 109.9 | -177.5 | 0 | 0 | 0 | 0 | 0 | 110.1 | K6 K10 | K6-G8 PolarHBondContact O-N 2.9Å; K6-G8 VanDerWaalsContact O-N 3.14Å; G8-K10 PolarHBondContact O-N 3.07Å | ||
| 9 | G | 61.5 | Low | 73.2 | Confident | 74 Ų | 74 | 133.9 Ų | 133.9 | 76% | 0.763 | 75% | 0.754 | S | S | * | * | trans | -64 | 100 | -174.7 | 0 | 0 | 0 | 0 | 0 | 108.1 | Q7 A11 | Q7-G9 PolarHBondContact O-N 2.85Å; G9-A11 PolarHBondContact O-N 2.72Å; G9-A11 VanDerWaalsContact O-N 3.08Å | ||
| 10 | K | 68.1 | Low | 74.4 | Confident | 201 Ų | 201 | 130.6 Ų | 130.6 | 87% | 0.874 | 74% | 0.74 | S | S | * | * | trans | -45.3 | 123.2 | 164 | -72.2 | -178.6 | 178.8 | 178.3 | 0 | 106.1 | G8 R12 | G8-K10 PolarHBondContact O-N 3.07Å; K10-R12 PolarHBondContact O-N 2.94Å | ||
| 11 | A | 74.3 | Confident | 75.4 | Confident | 101 Ų | 101 | 133 Ų | 133 | 84% | 0.835 | 74% | 0.737 | S | S | * | * | trans | -47.6 | 109.8 | -178 | 0 | 0 | 0 | 0 | 0 | 108.1 | G9 A13 | G9-A11 PolarHBondContact O-N 2.72Å; G9-A11 VanDerWaalsContact O-N 3.08Å; A11-A13 PolarHBondContact O-N 2.94Å | ||
| 12 | R | 77 | Confident | 77.3 | Confident | 241 Ų | 241 | 123.1 Ų | 123.1 | 91% | 0.909 | 70% | 0.696 | S | S | * | * | P | Polyproline II helix | trans | -59.1 | 120.4 | -173.7 | -173.5 | 177.3 | -178.9 | 178.7 | 1.6 | 106.7 | K10 K14 | K10-R12 PolarHBondContact O-N 2.94Å; R12-K14 PolarHBondContact O-N 3.29Å |
| 13 | A | 82 | Confident | 79.1 | Confident | 90 Ų | 90 | 121 Ų | 121 | 74% | 0.744 | 69% | 0.691 | S | S | * | * | P | Polyproline II helix | trans | -50.7 | 131 | 177.9 | 0 | 0 | 0 | 0 | 0 | 109 | A11 A15 | A11-A13 PolarHBondContact O-N 2.94Å; A13-A15 PolarHBondContact O-N 3.29Å |
| 14 | K | 84.7 | Confident | 80.8 | Confident | 201 Ų | 201 | 118 Ų | 118 | 87% | 0.874 | 65% | 0.654 | S | S | * | * | P | Polyproline II helix | trans | -53.8 | 129.8 | -179.1 | -74.2 | -176.6 | -179.8 | 177 | 0 | 108.9 | R12 K16 | R12-K14 PolarHBondContact O-N 3.29Å; K14-K16 PolarHBondContact O-N 3.13Å; K14-K16 VanDerWaalsContact O-N 3.1Å |
| 15 | A | 89.5 | Confident | 82.6 | Confident | 96 Ų | 96 | 114.8 Ų | 114.8 | 79% | 0.793 | 65% | 0.649 | S | S | * | * | P | Polyproline II helix | trans | -60.6 | 117.9 | 178.6 | 0 | 0 | 0 | 0 | 0 | 109.6 | A13 S17 | A13-A15 PolarHBondContact O-N 3.29Å; A15-S17 PolarHBondContact O-N 3.35Å |
| 16 | K | 92.9 | Very high | 84.5 | Confident | 152 Ų | 152 | 114.7 Ų | 114.7 | 66% | 0.661 | 63% | 0.631 | S | S | * | * | P | Polyproline II helix | trans | -61.2 | 129.9 | 173.2 | -67.9 | -172.8 | -179.8 | -176.4 | 0 | 109.6 | K14 R21 | K14-K16 PolarHBondContact O-N 3.13Å; K14-K16 VanDerWaalsContact O-N 3.1Å; K16-R21 HydrophobicContact CB-CG 4.05Å; K16-R21 PolarHBondContact O-NE 3.28Å |
| 17 | S | 95.9 | Very high | 86.4 | Confident | 65 Ų | 65 | 106.5 Ų | 106.5 | 46% | 0.455 | 60% | 0.6 | S | S | . | * | P | Polyproline II helix | trans | -66.3 | 155.1 | 177.8 | 75.8 | 0 | 0 | 0 | 0 | 110.7 | A15 S19 S20 R21 | A15-S17 PolarHBondContact O-N 3.35Å; S17-S19 PolarHBondContact O-N 2.88Å; S17-S20 PolarHBondContact N-OG 3.09Å; S17-S20 PolarHBondContact O-N 2.87Å; S17-S20 PolarHBondContact O-OG 3Å; S17-S20 WeakPolarHBondContact OG-CB 3.41Å; S17-S20 PolarHBondContact OG-N 3.32Å; S17-S20 PolarHBondContact OG-OG 3.49Å; S17-S20 VanDerWaalsContact OG-OG 3.14Å; S17-R21 WeakPolarHBondContact O-CG 3.36Å; S17-R21 PolarHBondContact O-N 2.87Å |
| 18 | R | 96.4 | Very high | 88.4 | Confident | 93 Ų | 93 | 97.8 Ų | 97.8 | 35% | 0.351 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -58.6 | -37.3 | 174.7 | -74 | -169.6 | -77.6 | 161 | -3.2 | 112.4 | R21 A22 V28 H32 | R18-R21 PolarHBondContact O-N 3.32Å; R18-A22 WeakPolarHBondContact O-CB 3.49Å; R18-A22 PolarHBondContact O-N 3.3Å; R18-V28 HydrophobicContact CB-CB 4.11Å; R18-V28 HydrophobicContact CB-CG1 3.86Å; R18-H32 PolarHBondContact NH1-ND1 3.24Å; R18-H32 PolarHBondContact NH2-ND1 3.36Å; R18-H32 VanDerWaalsContact NH2-ND1 3.14Å |
| 19 | S | 98 | Very high | 90.4 | Very high | 15 Ų | 15 | 96 Ų | 96 | 11% | 0.105 | 54% | 0.541 | C | S | . | . | H | α-helix | trans | -60.2 | -50.7 | 173.8 | -63 | 0 | 0 | 0 | 0 | 111.8 | S17 R21 A22 G23 L24 F26 P27 V28 | S17-S19 PolarHBondContact O-N 2.88Å; S19-R21 VanDerWaalsContact C-N 3.25Å; S19-R21 PolarHBondContact O-N 3.27Å; S19-A22 CarbonylContact O-C 3.6Å; S19-A22 PolarHBondContact O-N 3.26Å; S19-G23 PolarHBondContact O-N 3.27Å; S19-L24 CarbonylContact C-O 3.54Å; S19-L24 WeakPolarHBondContact CB-O 3.38Å; S19-L24 PolarHBondContact O-N 3.23Å; S19-F26 WeakPolarHBondContact CB-O 3.24Å; S19-F26 PolarHBondContact OG-O 3.15Å; S19-P27 WeakPolarHBondContact OG-CA 3.47Å; S19-V28 PolarHBondContact OG-N 2.94Å |
| 20 | S | 97 | Very high | 92.2 | Very high | 68 Ų | 68 | 99.5 Ų | 99.5 | 48% | 0.476 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -62.9 | -30.3 | 178.7 | 66.6 | 0 | 0 | 0 | 0 | 113.5 | S17 | S17-S20 PolarHBondContact N-OG 3.09Å; S17-S20 PolarHBondContact O-N 2.87Å; S17-S20 PolarHBondContact O-OG 3Å; S17-S20 WeakPolarHBondContact OG-CB 3.41Å; S17-S20 PolarHBondContact OG-N 3.32Å; S17-S20 PolarHBondContact OG-OG 3.49Å; S17-S20 VanDerWaalsContact OG-OG 3.14Å |
| 21 | R | 96.7 | Very high | 93.6 | Very high | 180 Ų | 180 | 90.8 Ų | 90.8 | 68% | 0.679 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -74.3 | -31.1 | 174.2 | -67.9 | 177.7 | -169.9 | -173 | -1.1 | 112.6 | K16 S17 R18 S19 | K16-R21 HydrophobicContact CB-CG 4.05Å; K16-R21 PolarHBondContact O-NE 3.28Å; S17-R21 WeakPolarHBondContact O-CG 3.36Å; S17-R21 PolarHBondContact O-N 2.87Å; R18-R21 PolarHBondContact O-N 3.32Å; S19-R21 VanDerWaalsContact C-N 3.25Å; S19-R21 PolarHBondContact O-N 3.27Å |
| 22 | A | 97.5 | Very high | 94.8 | Very high | 43 Ų | 43 | 87.6 Ų | 87.6 | 36% | 0.355 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -86.8 | -6.5 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | R18 S19 L24 V50 | R18-A22 WeakPolarHBondContact O-CB 3.49Å; R18-A22 PolarHBondContact O-N 3.3Å; S19-A22 CarbonylContact O-C 3.6Å; S19-A22 PolarHBondContact O-N 3.26Å; A22-L24 VanDerWaalsContact C-N 3.31Å; A22-L24 HydrophobicContact CB-CD1 3.96Å; A22-L24 HydrophobicContact CB-CG 4.02Å; A22-V50 HydrophobicContact CB-CG1 3.87Å |
| 23 | G | 97.9 | Very high | 95.8 | Very high | 63 Ų | 63 | 84.2 Ų | 84.2 | 65% | 0.649 | 45% | 0.45 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 72.8 | 21.6 | -175.5 | 0 | 0 | 0 | 0 | 0 | 114.1 | S19 | S19-G23 PolarHBondContact O-N 3.27Š|
| 24 | L | 98.4 | Very high | 96.5 | Very high | 25 Ų | 25 | 84.3 Ų | 84.3 | 13% | 0.131 | 44% | 0.437 | C | S | . | . | trans | -105.3 | 138.8 | -175.6 | -63.1 | 175.2 | 0 | 0 | 0 | 111.2 | S19 A22 V28 V50 A53 A54 E57 | S19-L24 CarbonylContact C-O 3.54Å; S19-L24 WeakPolarHBondContact CB-O 3.38Å; S19-L24 PolarHBondContact O-N 3.23Å; A22-L24 VanDerWaalsContact C-N 3.31Å; A22-L24 HydrophobicContact CB-CD1 3.96Å; A22-L24 HydrophobicContact CB-CG 4.02Å; L24-V28 HydrophobicContact CD1-CG2 3.79Å; L24-V50 HydrophobicContact CD1-CG1 4.28Å; L24-A53 HydrophobicContact CD1-CB 3.96Å; L24-A54 HydrophobicContact CD1-CB 4.04Å; L24-A54 HydrophobicContact CD2-CB 3.86Å; L24-E57 WeakPolarHBondContact CA-OE2 3.38Å; L24-E57 WeakPolarHBondContact CB-OE2 3.3Å | ||
| 25 | Q | 98.4 | Very high | 97.2 | Very high | 168 Ų | 168 | 76.2 Ų | 76.2 | 79% | 0.785 | 40% | 0.404 | S | S | * | . | S | Bend | trans | -73.8 | -32.2 | 165.4 | -62.4 | -56.6 | -38.8 | 0 | 0 | 111.3 | E57 | Q25-E57 VanDerWaalsContact N-CD 3.35Å; Q25-E57 PolarHBondContact N-OE1 3.16Å; Q25-E57 VanDerWaalsContact N-OE1 3.12Å; Q25-E57 PolarHBondContact N-OE2 3.29Å |
| 26 | F | 98.4 | Very high | 97.5 | Very high | 60 Ų | 60 | 78 Ų | 78 | 26% | 0.263 | 39% | 0.39 | S | S | . | . | S | Bend | trans | -71.8 | 144.6 | -176.4 | -84 | 33.9 | 0 | 0 | 0 | 111.4 | S19 V28 A53 L56 E57 T60 | S19-F26 WeakPolarHBondContact CB-O 3.24Å; S19-F26 PolarHBondContact OG-O 3.15Å; F26-V28 PolarHBondContact O-N 3.36Å; F26-A53 HydrophobicContact CB-CB 4.33Å; F26-L56 HydrophobicContact CD2-CB 3.81Å; F26-L56 HydrophobicContact CE2-CB 3.85Å; F26-L56 WeakPolarHBondContact CE2-O 3.47Å; F26-E57 HydrophobicContact CB-CB 4.11Å; F26-E57 WeakPolarHBondContact CB-OE2 3.06Å; F26-E57 HydrophobicContact CD1-CB 3.85Å; F26-E57 HydrophobicContact CD1-CG 3.83Å; F26-E57 HydrophobicContact CD2-CB 3.95Å; F26-E57 HydrophobicContact CE1-CB 4.28Å; F26-E57 HydrophobicContact CE1-CG 4.2Å; F26-E57 HydrophobicContact CE2-CB 4.36Å; F26-E57 HydrophobicContact CG-CB 3.69Å; F26-E57 HydrophobicContact CG-CG 4.18Å; F26-E57 PolarHBondContact N-OE2 3.01Å; F26-T60 HydrophobicContact CZ-CG2 3.87Å; F26-T60 WeakPolarHBondContact CZ-OG1 3.41Å |
| 27 | P | 98.4 | Very high | 97.7 | Very high | 45 Ų | 45 | 78.9 Ų | 78.9 | 29% | 0.292 | 39% | 0.393 | S | S | . | . | trans | -81.7 | 85.6 | -168.4 | 32.9 | -37.4 | 0 | 0 | 0 | 112.7 | S19 G29 R30 V31 | S19-P27 WeakPolarHBondContact OG-CA 3.47Å; P27-G29 PolarHBondContact O-N 2.85Å; P27-G29 VanDerWaalsContact O-N 3.09Å; P27-R30 HydrophobicContact CB-CB 3.83Å; P27-R30 HydrophobicContact CG-CB 3.92Å; P27-R30 WeakPolarHBondContact O-CA 3.21Å; P27-R30 WeakPolarHBondContact O-CB 3.31Å; P27-R30 PolarHBondContact O-N 3.29Å; P27-V31 PolarHBondContact O-N 3.06Å | ||
| 28 | V | 98.6 | Very high | 97.8 | Very high | 0 Ų | 0 | 77.3 Ų | 77.3 | 0% | 0 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -48.4 | -40 | 174.5 | 176.1 | 0 | 0 | 0 | 0 | 112.1 | R18 S19 L24 F26 R30 V31 H32 P49 V50 A53 | R18-V28 HydrophobicContact CB-CB 4.11Å; R18-V28 HydrophobicContact CB-CG1 3.86Å; S19-V28 PolarHBondContact OG-N 2.94Å; L24-V28 HydrophobicContact CD1-CG2 3.79Å; F26-V28 PolarHBondContact O-N 3.36Å; V28-R30 VanDerWaalsContact C-N 3.35Å; V28-R30 PolarHBondContact O-N 3.15Å; V28-V31 PolarHBondContact O-N 3.14Å; V28-H32 PolarHBondContact O-N 3.06Å; V28-P49 HydrophobicContact CG1-CB 4.23Å; V28-P49 HydrophobicContact CG1-CG 4.44Å; V28-V50 HydrophobicContact CG1-CG2 3.73Å; V28-A53 HydrophobicContact CG2-CB 3.88Å |
| 29 | G | 98 | Very high | 97.7 | Very high | 36 Ų | 36 | 79.4 Ų | 79.4 | 37% | 0.371 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -59.5 | -43.5 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | P27 R33 | P27-G29 PolarHBondContact O-N 2.85Å; P27-G29 VanDerWaalsContact O-N 3.09Å; G29-R33 PolarHBondContact O-N 3.4Å |
| 30 | R | 98.4 | Very high | 97.5 | Very high | 147 Ų | 147 | 87.3 Ų | 87.3 | 56% | 0.555 | 44% | 0.435 | S | S | * | . | H | α-helix | trans | -71.1 | -43.6 | 179.4 | -173.4 | -176.3 | -63.1 | 155.5 | 1.1 | 110.8 | P27 V28 H32 R33 L34 | P27-R30 HydrophobicContact CB-CB 3.83Å; P27-R30 HydrophobicContact CG-CB 3.92Å; P27-R30 WeakPolarHBondContact O-CA 3.21Å; P27-R30 WeakPolarHBondContact O-CB 3.31Å; P27-R30 PolarHBondContact O-N 3.29Å; V28-R30 VanDerWaalsContact C-N 3.35Å; V28-R30 PolarHBondContact O-N 3.15Å; R30-H32 VanDerWaalsContact C-N 3.33Å; R30-H32 PolarHBondContact O-N 2.72Å; R30-R33 PolarHBondContact O-N 3.13Å; R30-L34 HydrophobicContact CG-CD1 4.21Å; R30-L34 WeakPolarHBondContact O-CG 3.43Å; R30-L34 PolarHBondContact O-N 3.34Å |
| 31 | V | 98.3 | Very high | 97.4 | Very high | 18 Ų | 18 | 87.2 Ų | 87.2 | 11% | 0.109 | 43% | 0.434 | C | S | . | . | H | α-helix | trans | -57.9 | -45.9 | 176.3 | 177.9 | 0 | 0 | 0 | 0 | 110.5 | P27 V28 R33 L34 L35 P49 L52 A53 | P27-V31 PolarHBondContact O-N 3.06Å; V28-V31 PolarHBondContact O-N 3.14Å; V31-R33 VanDerWaalsContact C-N 3.34Å; V31-R33 PolarHBondContact O-N 3.26Å; V31-L34 PolarHBondContact O-N 2.92Å; V31-L35 HydrophobicContact CG1-CD1 4.05Å; V31-L35 HydrophobicContact CG1-CG 4.32Å; V31-L35 WeakPolarHBondContact O-CG 3.42Å; V31-L35 PolarHBondContact O-N 3.3Å; V31-P49 HydrophobicContact CB-CB 4.27Å; V31-P49 HydrophobicContact CG1-CB 4.05Å; V31-L52 HydrophobicContact CG1-CB 4.1Å; V31-L52 HydrophobicContact CG1-CD2 3.78Å; V31-L52 HydrophobicContact CG1-CG 4.05Å; V31-A53 HydrophobicContact CG2-CB 4.15Å |
| 32 | H | 98.2 | Very high | 97.4 | Very high | 33 Ų | 33 | 88 Ų | 88 | 15% | 0.153 | 45% | 0.445 | C | S | . | . | H | α-helix | trans | -58.3 | -44.5 | 176.3 | -173.3 | -149.6 | 0 | 0 | 0 | 112.9 | R18 V28 R30 L34 L35 R36 P49 | R18-H32 PolarHBondContact NH1-ND1 3.24Å; R18-H32 PolarHBondContact NH2-ND1 3.36Å; R18-H32 VanDerWaalsContact NH2-ND1 3.14Å; V28-H32 PolarHBondContact O-N 3.06Å; R30-H32 VanDerWaalsContact C-N 3.33Å; R30-H32 PolarHBondContact O-N 2.72Å; H32-L34 VanDerWaalsContact C-N 3.34Å; H32-L35 PolarHBondContact O-N 3.05Å; H32-R36 PolarHBondContact CE1-NE 2.82Å; H32-R36 PolarHBondContact NE2-NE 3.41Å; H32-R36 PolarHBondContact NE2-NH2 3.29Å; H32-R36 PolarHBondContact O-N 3.41Å; H32-R36 VanDerWaalsContact O-N 3.15Å; H32-P49 HydrophobicContact CB-CB 3.62Å; H32-P49 HydrophobicContact CB-CG 3.73Å |
| 33 | R | 97.9 | Very high | 97.4 | Very high | 170 Ų | 170 | 96.4 Ų | 96.4 | 64% | 0.642 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -62.9 | -42.4 | 178.3 | -175.3 | -177.8 | 66.7 | 177.7 | 2.9 | 111.3 | G29 R30 V31 R36 K37 | G29-R33 PolarHBondContact O-N 3.4Å; R30-R33 PolarHBondContact O-N 3.13Å; V31-R33 VanDerWaalsContact C-N 3.34Å; V31-R33 PolarHBondContact O-N 3.26Å; R33-R36 PolarHBondContact O-N 2.92Å; R33-K37 PolarHBondContact O-N 2.8Å |
| 34 | L | 98.2 | Very high | 97.3 | Very high | 93 Ų | 93 | 94.3 Ų | 94.3 | 49% | 0.487 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -68.5 | -40.8 | 179 | -68.8 | 175.5 | 0 | 0 | 0 | 112.2 | R30 V31 H32 R36 K37 G38 | R30-L34 HydrophobicContact CG-CD1 4.21Å; R30-L34 WeakPolarHBondContact O-CG 3.43Å; R30-L34 PolarHBondContact O-N 3.34Å; V31-L34 PolarHBondContact O-N 2.92Å; H32-L34 VanDerWaalsContact C-N 3.34Å; L34-R36 VanDerWaalsContact C-N 3.3Å; L34-R36 PolarHBondContact O-N 2.8Å; L34-K37 PolarHBondContact O-N 3.49Å; L34-G38 PolarHBondContact O-N 3.18Å |
| 35 | L | 97.7 | Very high | 97.3 | Very high | 31 Ų | 31 | 95.4 Ų | 95.4 | 16% | 0.162 | 46% | 0.46 | C | S | . | . | H | α-helix | trans | -58.3 | -41.8 | 174.3 | -74.3 | 172.7 | 0 | 0 | 0 | 112 | V31 H32 G38 Y40 V44 A48 P49 L52 | V31-L35 HydrophobicContact CG1-CD1 4.05Å; V31-L35 HydrophobicContact CG1-CG 4.32Å; V31-L35 WeakPolarHBondContact O-CG 3.42Å; V31-L35 PolarHBondContact O-N 3.3Å; H32-L35 PolarHBondContact O-N 3.05Å; L35-G38 PolarHBondContact O-N 2.96Å; L35-Y40 HydrophobicContact CD2-CD2 4.08Å; L35-Y40 HydrophobicContact CD2-CE2 4.26Å; L35-Y40 WeakPolarHBondContact O-CD2 3.33Å; L35-V44 HydrophobicContact CB-CG1 4.12Å; L35-V44 HydrophobicContact CB-CG2 4.29Å; L35-V44 HydrophobicContact CD1-CG1 4.09Å; L35-A48 HydrophobicContact CD1-CB 4.5Å; L35-P49 HydrophobicContact CD1-CB 4.13Å; L35-L52 HydrophobicContact CD1-CD2 4.29Å; L35-L52 HydrophobicContact CD2-CD2 3.88Å; L35-L52 HydrophobicContact CG-CD2 4.3Å |
| 36 | R | 96.5 | Very high | 97.1 | Very high | 133 Ų | 133 | 91.3 Ų | 91.3 | 50% | 0.502 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -67.3 | -42.2 | 174.7 | -72.7 | -175.2 | 176.9 | -95.7 | -4.7 | 112.5 | H32 R33 L34 G38 N39 V44 | H32-R36 PolarHBondContact CE1-NE 2.82Å; H32-R36 PolarHBondContact NE2-NE 3.41Å; H32-R36 PolarHBondContact NE2-NH2 3.29Å; H32-R36 PolarHBondContact O-N 3.41Å; H32-R36 VanDerWaalsContact O-N 3.15Å; R33-R36 PolarHBondContact O-N 2.92Å; L34-R36 VanDerWaalsContact C-N 3.3Å; L34-R36 PolarHBondContact O-N 2.8Å; R36-G38 VanDerWaalsContact C-N 3.26Å; R36-G38 PolarHBondContact O-N 2.89Å; R36-N39 PolarHBondContact O-N 2.97Å; R36-N39 PolarHBondContact O-OD1 3.28Å; R36-V44 HydrophobicContact CG-CB 4.38Å; R36-V44 HydrophobicContact CG-CG2 4.1Å |
| 37 | K | 97.3 | Very high | 97.1 | Very high | 170 Ų | 170 | 90.8 Ų | 90.8 | 74% | 0.739 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -64.4 | -31.8 | 177.9 | -175.7 | 177.4 | 177 | -177.2 | 0 | 112.3 | R33 L34 N39 | R33-K37 PolarHBondContact O-N 2.8Å; L34-K37 PolarHBondContact O-N 3.49Å; K37-N39 PolarHBondContact O-N 3.35Å |
| 38 | G | 97 | Very high | 97.1 | Very high | 33 Ų | 33 | 90.8 Ų | 90.8 | 34% | 0.34 | 47% | 0.47 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -73.3 | -7.3 | 178.7 | 0 | 0 | 0 | 0 | 0 | 114.8 | L34 L35 R36 Y40 | L34-G38 PolarHBondContact O-N 3.18Å; L35-G38 PolarHBondContact O-N 2.96Å; R36-G38 VanDerWaalsContact C-N 3.26Å; R36-G38 PolarHBondContact O-N 2.89Å; G38-Y40 PolarHBondContact O-N 2.93Å; G38-Y40 VanDerWaalsContact O-N 3.11Å |
| 39 | N | 94.8 | Very high | 97.1 | Very high | 137 Ų | 137 | 90.8 Ų | 90.8 | 73% | 0.733 | 47% | 0.47 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 50.3 | 33.9 | 179.8 | -62.4 | -27.3 | 0 | 0 | 0 | 113.9 | R36 K37 S41 | R36-N39 PolarHBondContact O-N 2.97Å; R36-N39 PolarHBondContact O-OD1 3.28Å; K37-N39 PolarHBondContact O-N 3.35Å; N39-S41 PolarHBondContact O-N 3.42Å |
| 40 | Y | 94.5 | Very high | 97.1 | Very high | 181 Ų | 181 | 91.4 Ų | 91.4 | 71% | 0.71 | 47% | 0.467 | S | S | * | . | S | Bend | trans | -68.3 | -21.5 | -179 | -58.4 | -69.3 | 0 | 0 | 0 | 113.6 | L35 G38 | L35-Y40 HydrophobicContact CD2-CD2 4.08Å; L35-Y40 HydrophobicContact CD2-CE2 4.26Å; L35-Y40 WeakPolarHBondContact O-CD2 3.33Å; G38-Y40 PolarHBondContact O-N 2.93Å; G38-Y40 VanDerWaalsContact O-N 3.11Å |
| 41 | S | 95.3 | Very high | 97.1 | Very high | 65 Ų | 65 | 92.7 Ų | 92.7 | 46% | 0.455 | 47% | 0.473 | S | S | . | . | trans | -159.4 | 158.7 | 175.9 | 64.8 | 0 | 0 | 0 | 0 | 110 | N39 R43 | N39-S41 PolarHBondContact O-N 3.42Å; S41-R43 PolarHBondContact O-N 2.99Å; S41-R43 PolarHBondContact OG-O 3.42Å | ||
| 42 | E | 95.5 | Very high | 97.1 | Very high | 197 Ų | 197 | 94.9 Ų | 94.9 | 92% | 0.921 | 48% | 0.483 | S | S | * | . | S | Bend | trans | -61.2 | -34.5 | 173.9 | -63.2 | -178.2 | 173.5 | 0 | 0 | 112.2 | ||
| 43 | R | 97.1 | Very high | 97.2 | Very high | 219 Ų | 219 | 93.3 Ų | 93.3 | 83% | 0.826 | 48% | 0.476 | S | S | * | . | trans | -130.4 | 128.3 | -178.4 | -60.2 | -179.4 | 73.7 | 175.2 | 3 | 110.5 | S41 | S41-R43 PolarHBondContact O-N 2.99Å; S41-R43 PolarHBondContact OG-O 3.42Å | ||
| 44 | V | 96.8 | Very high | 97.2 | Very high | 20 Ų | 20 | 86.9 Ų | 86.9 | 12% | 0.121 | 46% | 0.459 | C | S | . | . | trans | -104.2 | 114.4 | 171.7 | -179.3 | 0 | 0 | 0 | 0 | 108.7 | L35 R36 A48 | L35-V44 HydrophobicContact CB-CG1 4.12Å; L35-V44 HydrophobicContact CB-CG2 4.29Å; L35-V44 HydrophobicContact CD1-CG1 4.09Å; R36-V44 HydrophobicContact CG-CB 4.38Å; R36-V44 HydrophobicContact CG-CG2 4.1Å; V44-A48 HydrophobicContact CG1-CB 4.12Å | ||
| 45 | G | 97.3 | Very high | 97.2 | Very high | 48 Ų | 48 | 84.9 Ų | 84.9 | 50% | 0.495 | 45% | 0.451 | S | S | . | . | trans | -63.9 | 151.3 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | G47 A48 P49 | G45-G47 VanDerWaalsContact C-N 3.26Å; G45-G47 PolarHBondContact O-N 3.03Å; G45-A48 WeakPolarHBondContact O-CB 3.44Å; G45-A48 PolarHBondContact O-N 3.36Å; G45-P49 WeakPolarHBondContact O-CD 3.1Å | ||
| 46 | A | 95.5 | Very high | 97.3 | Very high | 81 Ų | 81 | 86.9 Ų | 86.9 | 67% | 0.669 | 46% | 0.462 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.9 | -29.4 | -175 | 0 | 0 | 0 | 0 | 0 | 113.9 | P49 | A46-P49 WeakPolarHBondContact O-CD 3.45Å; A46-P49 WeakPolarHBondContact O-CG 3.43Å |
| 47 | G | 97.7 | Very high | 97.4 | Very high | 49 Ų | 49 | 82.3 Ų | 82.3 | 51% | 0.505 | 45% | 0.446 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -77.5 | -27.5 | 177.2 | 0 | 0 | 0 | 0 | 0 | 114.2 | G45 V50 Y51 | G45-G47 VanDerWaalsContact C-N 3.26Å; G45-G47 PolarHBondContact O-N 3.03Å; G47-V50 WeakPolarHBondContact O-CB 3.34Å; G47-V50 PolarHBondContact O-N 3.48Å; G47-Y51 PolarHBondContact O-N 3.22Å |
| 48 | A | 98.3 | Very high | 97.4 | Very high | 46 Ų | 46 | 81 Ų | 81 | 38% | 0.38 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -53.6 | -49.3 | -179.3 | 0 | 0 | 0 | 0 | 0 | 114 | L35 V44 G45 V50 Y51 L52 | L35-A48 HydrophobicContact CD1-CB 4.5Å; V44-A48 HydrophobicContact CG1-CB 4.12Å; G45-A48 WeakPolarHBondContact O-CB 3.44Å; G45-A48 PolarHBondContact O-N 3.36Å; A48-V50 VanDerWaalsContact C-N 3.29Å; A48-V50 PolarHBondContact O-N 3.46Å; A48-Y51 PolarHBondContact O-N 2.95Å; A48-L52 WeakPolarHBondContact O-CB 3.35Å; A48-L52 PolarHBondContact O-N 3.37Å |
| 49 | P | 98.5 | Very high | 97.5 | Very high | 0 Ų | 0 | 81.9 Ų | 81.9 | 0% | 0 | 43% | 0.434 | C | S | . | . | H | α-helix | trans | -70.1 | -22.1 | 176.5 | 28.4 | -37.3 | 0 | 0 | 0 | 114.3 | V28 V31 H32 L35 G45 A46 A53 | V28-P49 HydrophobicContact CG1-CB 4.23Å; V28-P49 HydrophobicContact CG1-CG 4.44Å; V31-P49 HydrophobicContact CB-CB 4.27Å; V31-P49 HydrophobicContact CG1-CB 4.05Å; H32-P49 HydrophobicContact CB-CB 3.62Å; H32-P49 HydrophobicContact CB-CG 3.73Å; L35-P49 HydrophobicContact CD1-CB 4.13Å; G45-P49 WeakPolarHBondContact O-CD 3.1Å; A46-P49 WeakPolarHBondContact O-CD 3.45Å; A46-P49 WeakPolarHBondContact O-CG 3.43Å; P49-A53 WeakPolarHBondContact O-CB 3.27Å; P49-A53 PolarHBondContact O-N 3.45Å |
| 50 | V | 98.6 | Very high | 97.7 | Very high | 49 Ų | 49 | 77.9 Ų | 77.9 | 30% | 0.297 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -73.2 | -50.8 | 174.8 | 179.5 | 0 | 0 | 0 | 0 | 109 | A22 L24 V28 G47 A48 A53 A54 | A22-V50 HydrophobicContact CB-CG1 3.87Å; L24-V50 HydrophobicContact CD1-CG1 4.28Å; V28-V50 HydrophobicContact CG1-CG2 3.73Å; G47-V50 WeakPolarHBondContact O-CB 3.34Å; G47-V50 PolarHBondContact O-N 3.48Å; A48-V50 VanDerWaalsContact C-N 3.29Å; A48-V50 PolarHBondContact O-N 3.46Å; V50-A53 PolarHBondContact O-N 2.84Å; V50-A54 WeakPolarHBondContact O-CB 3.31Å; V50-A54 PolarHBondContact O-N 3.34Å |
| 51 | Y | 98.7 | Very high | 97.9 | Very high | 173 Ų | 173 | 71.8 Ų | 71.8 | 68% | 0.678 | 40% | 0.402 | S | S | * | . | H | α-helix | trans | -58.2 | -50.9 | 178.1 | -179.1 | -98.3 | 0 | 0 | 0 | 111.6 | G47 A48 A53 A54 V55 | G47-Y51 PolarHBondContact O-N 3.22Å; A48-Y51 PolarHBondContact O-N 2.95Å; Y51-A53 VanDerWaalsContact C-N 3.34Å; Y51-A53 PolarHBondContact O-N 2.95Å; Y51-A54 WeakPolarHBondContact O-CB 3.34Å; Y51-A54 PolarHBondContact O-N 3.22Å; Y51-V55 HydrophobicContact CD1-CG2 4.33Å; Y51-V55 HydrophobicContact CE1-CG2 3.92Å; Y51-V55 HydrophobicContact CE2-CG2 4.31Å; Y51-V55 WeakPolarHBondContact O-CG2 3.3Å; Y51-V55 PolarHBondContact O-N 3.4Å |
| 52 | L | 98.6 | Very high | 98 | Very high | 64 Ų | 64 | 71.4 Ų | 71.4 | 34% | 0.335 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -63.4 | -39.6 | 179.6 | -179.2 | 59.2 | 0 | 0 | 0 | 112.2 | V31 L35 A48 A54 V55 L56 | V31-L52 HydrophobicContact CG1-CB 4.1Å; V31-L52 HydrophobicContact CG1-CD2 3.78Å; V31-L52 HydrophobicContact CG1-CG 4.05Å; L35-L52 HydrophobicContact CD1-CD2 4.29Å; L35-L52 HydrophobicContact CD2-CD2 3.88Å; L35-L52 HydrophobicContact CG-CD2 4.3Å; A48-L52 WeakPolarHBondContact O-CB 3.35Å; A48-L52 PolarHBondContact O-N 3.37Å; L52-A54 VanDerWaalsContact C-N 3.34Å; L52-V55 PolarHBondContact O-N 3.13Å; L52-L56 HydrophobicContact CD1-CD1 4.24Å; L52-L56 HydrophobicContact CD1-CG 4.19Å; L52-L56 HydrophobicContact CG-CD1 4.11Å; L52-L56 HydrophobicContact CG-CG 4.49Å; L52-L56 WeakPolarHBondContact O-CB 3.29Å; L52-L56 VanDerWaalsContact O-CG 3.23Å; L52-L56 WeakPolarHBondContact O-CG 3.19Å; L52-L56 PolarHBondContact O-N 2.88Å |
| 53 | A | 98.8 | Very high | 98.2 | Very high | 0 Ų | 0 | 63.6 Ų | 63.6 | 0% | 0 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -62.8 | -41.6 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | L24 F26 V28 V31 P49 V50 Y51 L56 E57 | L24-A53 HydrophobicContact CD1-CB 3.96Å; F26-A53 HydrophobicContact CB-CB 4.33Å; V28-A53 HydrophobicContact CG2-CB 3.88Å; V31-A53 HydrophobicContact CG2-CB 4.15Å; P49-A53 WeakPolarHBondContact O-CB 3.27Å; P49-A53 PolarHBondContact O-N 3.45Å; V50-A53 PolarHBondContact O-N 2.84Å; Y51-A53 VanDerWaalsContact C-N 3.34Å; Y51-A53 PolarHBondContact O-N 2.95Å; A53-L56 PolarHBondContact O-N 3.13Å; A53-E57 WeakPolarHBondContact O-CB 3.31Å; A53-E57 PolarHBondContact O-N 3.28Å |
| 54 | A | 98.8 | Very high | 98.2 | Very high | 35 Ų | 35 | 57.4 Ų | 57.4 | 29% | 0.289 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -63.2 | -45.4 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | L24 V50 Y51 L52 L56 E57 Y58 | L24-A54 HydrophobicContact CD1-CB 4.04Å; L24-A54 HydrophobicContact CD2-CB 3.86Å; V50-A54 WeakPolarHBondContact O-CB 3.31Å; V50-A54 PolarHBondContact O-N 3.34Å; Y51-A54 WeakPolarHBondContact O-CB 3.34Å; Y51-A54 PolarHBondContact O-N 3.22Å; L52-A54 VanDerWaalsContact C-N 3.34Å; A54-L56 PolarHBondContact O-N 3.28Å; A54-E57 PolarHBondContact O-N 2.72Å; A54-Y58 WeakPolarHBondContact O-CB 3.41Å; A54-Y58 PolarHBondContact O-N 3.47Å |
| 55 | V | 98.7 | Very high | 98.3 | Very high | 51 Ų | 51 | 62.2 Ų | 62.2 | 31% | 0.309 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -62.4 | -44.2 | 177.5 | 173 | 0 | 0 | 0 | 0 | 111.2 | Y51 L52 E57 Y58 L59 | Y51-V55 HydrophobicContact CD1-CG2 4.33Å; Y51-V55 HydrophobicContact CE1-CG2 3.92Å; Y51-V55 HydrophobicContact CE2-CG2 4.31Å; Y51-V55 WeakPolarHBondContact O-CG2 3.3Å; Y51-V55 PolarHBondContact O-N 3.4Å; L52-V55 PolarHBondContact O-N 3.13Å; V55-E57 VanDerWaalsContact C-N 3.34Å; V55-E57 PolarHBondContact O-N 3.08Å; V55-Y58 PolarHBondContact O-N 2.71Å; V55-L59 HydrophobicContact CG1-CD1 4.02Å; V55-L59 WeakPolarHBondContact O-CG 3.31Å; V55-L59 PolarHBondContact O-N 3.5Å |
| 56 | L | 98.7 | Very high | 98.4 | Very high | 74 Ų | 74 | 62 Ų | 62 | 39% | 0.387 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -64.1 | -39.7 | 177.1 | -69.3 | 173.3 | 0 | 0 | 0 | 112 | F26 L52 A53 A54 T60 | F26-L56 HydrophobicContact CD2-CB 3.81Å; F26-L56 HydrophobicContact CE2-CB 3.85Å; F26-L56 WeakPolarHBondContact CE2-O 3.47Å; L52-L56 HydrophobicContact CD1-CD1 4.24Å; L52-L56 HydrophobicContact CD1-CG 4.19Å; L52-L56 HydrophobicContact CG-CD1 4.11Å; L52-L56 HydrophobicContact CG-CG 4.49Å; L52-L56 WeakPolarHBondContact O-CB 3.29Å; L52-L56 VanDerWaalsContact O-CG 3.23Å; L52-L56 WeakPolarHBondContact O-CG 3.19Å; L52-L56 PolarHBondContact O-N 2.88Å; A53-L56 PolarHBondContact O-N 3.13Å; A54-L56 PolarHBondContact O-N 3.28Å; L56-T60 VanDerWaalsContact O-CB 3.31Å; L56-T60 WeakPolarHBondContact O-CB 3.46Å; L56-T60 PolarHBondContact O-N 3.19Å; L56-T60 PolarHBondContact O-OG1 3.31Å |
| 57 | E | 98.7 | Very high | 98.5 | Very high | 37 Ų | 37 | 58.2 Ų | 58.2 | 17% | 0.173 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -64.8 | -47.9 | 176.9 | -175.5 | 166 | 150.8 | 0 | 0 | 111.3 | L24 Q25 F26 A53 A54 V55 T60 A61 | L24-E57 WeakPolarHBondContact CA-OE2 3.38Å; L24-E57 WeakPolarHBondContact CB-OE2 3.3Å; Q25-E57 VanDerWaalsContact N-CD 3.35Å; Q25-E57 PolarHBondContact N-OE1 3.16Å; Q25-E57 VanDerWaalsContact N-OE1 3.12Å; Q25-E57 PolarHBondContact N-OE2 3.29Å; F26-E57 HydrophobicContact CB-CB 4.11Å; F26-E57 WeakPolarHBondContact CB-OE2 3.06Å; F26-E57 HydrophobicContact CD1-CB 3.85Å; F26-E57 HydrophobicContact CD1-CG 3.83Å; F26-E57 HydrophobicContact CD2-CB 3.95Å; F26-E57 HydrophobicContact CE1-CB 4.28Å; F26-E57 HydrophobicContact CE1-CG 4.2Å; F26-E57 HydrophobicContact CE2-CB 4.36Å; F26-E57 HydrophobicContact CG-CB 3.69Å; F26-E57 HydrophobicContact CG-CG 4.18Å; F26-E57 PolarHBondContact N-OE2 3.01Å; A53-E57 WeakPolarHBondContact O-CB 3.31Å; A53-E57 PolarHBondContact O-N 3.28Å; A54-E57 PolarHBondContact O-N 2.72Å; V55-E57 VanDerWaalsContact C-N 3.34Å; V55-E57 PolarHBondContact O-N 3.08Å; E57-T60 PolarHBondContact O-N 3.2Å; E57-A61 WeakPolarHBondContact O-CB 3.31Å; E57-A61 PolarHBondContact O-N 3.27Å |
| 58 | Y | 98.3 | Very high | 98.6 | Very high | 141 Ų | 141 | 57.1 Ų | 57.1 | 55% | 0.553 | 31% | 0.305 | S | S | * | . | H | α-helix | trans | -55.8 | -54.6 | 176.5 | 170.9 | -100.7 | 0 | 0 | 0 | 111.9 | A54 V55 T60 A61 E62 | A54-Y58 WeakPolarHBondContact O-CB 3.41Å; A54-Y58 PolarHBondContact O-N 3.47Å; V55-Y58 PolarHBondContact O-N 2.71Å; Y58-T60 VanDerWaalsContact C-N 3.28Å; Y58-T60 PolarHBondContact O-N 2.83Å; Y58-A61 PolarHBondContact O-N 3.03Å; Y58-E62 PolarHBondContact O-N 3.18Å |
| 59 | L | 98.4 | Very high | 98.6 | Very high | 53 Ų | 53 | 57.3 Ų | 57.3 | 28% | 0.277 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -61.2 | -38 | 179.8 | -69.2 | 172.9 | 0 | 0 | 0 | 112.2 | V55 I63 L97 | V55-L59 HydrophobicContact CG1-CD1 4.02Å; V55-L59 WeakPolarHBondContact O-CG 3.31Å; V55-L59 PolarHBondContact O-N 3.5Å; L59-I63 WeakPolarHBondContact O-CD1 3.45Å; L59-I63 VanDerWaalsContact O-CG1 3.27Å; L59-I63 WeakPolarHBondContact O-CG1 3.33Å; L59-I63 PolarHBondContact O-N 2.94Å; L59-L97 HydrophobicContact CD1-CD2 4.39Å; L59-L97 HydrophobicContact CD2-CD2 3.79Å |
| 60 | T | 98.6 | Very high | 98.6 | Very high | 52 Ų | 52 | 58 Ų | 58 | 32% | 0.319 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -69 | -42.7 | 178.1 | -56.9 | 0 | 0 | 0 | 0 | 111.2 | F26 L56 E57 Y58 I63 L64 | F26-T60 HydrophobicContact CZ-CG2 3.87Å; F26-T60 WeakPolarHBondContact CZ-OG1 3.41Å; L56-T60 VanDerWaalsContact O-CB 3.31Å; L56-T60 WeakPolarHBondContact O-CB 3.46Å; L56-T60 PolarHBondContact O-N 3.19Å; L56-T60 PolarHBondContact O-OG1 3.31Å; E57-T60 PolarHBondContact O-N 3.2Å; Y58-T60 VanDerWaalsContact C-N 3.28Å; Y58-T60 PolarHBondContact O-N 2.83Å; T60-I63 PolarHBondContact O-N 2.82Å; T60-L64 HydrophobicContact CG2-CD1 3.68Å; T60-L64 HydrophobicContact CG2-CG 4.1Å; T60-L64 VanDerWaalsContact O-CB 3.31Å; T60-L64 WeakPolarHBondContact O-CB 3.44Å; T60-L64 WeakPolarHBondContact O-CG 3.27Å; T60-L64 PolarHBondContact O-N 3.45Å |
| 61 | A | 98.4 | Very high | 98.6 | Very high | 54 Ų | 54 | 55.8 Ų | 55.8 | 45% | 0.446 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -59.8 | -48.1 | 178.3 | 0 | 0 | 0 | 0 | 0 | 111 | E57 Y58 I63 L64 E65 | E57-A61 WeakPolarHBondContact O-CB 3.31Å; E57-A61 PolarHBondContact O-N 3.27Å; Y58-A61 PolarHBondContact O-N 3.03Å; A61-I63 PolarHBondContact O-N 2.77Å; A61-L64 PolarHBondContact O-N 3.35Å; A61-E65 WeakPolarHBondContact O-CB 3.25Å; A61-E65 PolarHBondContact O-N 3.47Å |
| 62 | E | 98.3 | Very high | 98.6 | Very high | 56 Ų | 56 | 55.1 Ų | 55.1 | 26% | 0.262 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -58.6 | -50 | 179 | -169.2 | 60.7 | -143.7 | 0 | 0 | 112 | Y58 L64 E65 L66 L94 | Y58-E62 PolarHBondContact O-N 3.18Å; E62-L64 VanDerWaalsContact C-N 3.32Å; E62-L64 PolarHBondContact O-N 2.84Å; E62-E65 PolarHBondContact O-N 3.3Å; E62-L66 HydrophobicContact CG-CD1 4.47Å; E62-L66 WeakPolarHBondContact O-CG 3.27Å; E62-L66 PolarHBondContact O-N 2.97Å; E62-L66 VanDerWaalsContact O-N 3.13Å; E62-L94 HydrophobicContact CG-CD1 4.27Å |
| 63 | I | 98.6 | Very high | 98.5 | Very high | 34 Ų | 34 | 57.6 Ų | 57.6 | 17% | 0.174 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -61.5 | -41.7 | 178.5 | -67.9 | 167.5 | 0 | 0 | 0 | 111 | L59 T60 A61 A67 L84 I88 L94 L98 | L59-I63 WeakPolarHBondContact O-CD1 3.45Å; L59-I63 VanDerWaalsContact O-CG1 3.27Å; L59-I63 WeakPolarHBondContact O-CG1 3.33Å; L59-I63 PolarHBondContact O-N 2.94Å; T60-I63 PolarHBondContact O-N 2.82Å; A61-I63 PolarHBondContact O-N 2.77Å; I63-A67 WeakPolarHBondContact O-CB 3.03Å; I63-A67 PolarHBondContact O-N 2.88Å; I63-L84 HydrophobicContact CG2-CD2 3.77Å; I63-I88 HydrophobicContact CG1-CG1 4.5Å; I63-I88 HydrophobicContact CG2-CD1 4.25Å; I63-I88 HydrophobicContact CG2-CG1 4.38Å; I63-L94 HydrophobicContact CD1-CD2 4.24Å; I63-L94 HydrophobicContact CG1-CD1 3.85Å; I63-L94 HydrophobicContact CG1-CD2 3.82Å; I63-L94 HydrophobicContact CG1-CG 4.49Å; I63-L98 HydrophobicContact CD1-CD1 4.24Å |
| 64 | L | 98.6 | Very high | 98.4 | Very high | 88 Ų | 88 | 61.2 Ų | 61.2 | 46% | 0.461 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -71.9 | -34.2 | -178.8 | -72.2 | 179.4 | 0 | 0 | 0 | 112.8 | T60 A61 E62 G68 I79 | T60-L64 HydrophobicContact CG2-CD1 3.68Å; T60-L64 HydrophobicContact CG2-CG 4.1Å; T60-L64 VanDerWaalsContact O-CB 3.31Å; T60-L64 WeakPolarHBondContact O-CB 3.44Å; T60-L64 WeakPolarHBondContact O-CG 3.27Å; T60-L64 PolarHBondContact O-N 3.45Å; A61-L64 PolarHBondContact O-N 3.35Å; E62-L64 VanDerWaalsContact C-N 3.32Å; E62-L64 PolarHBondContact O-N 2.84Å; L64-G68 WeakPolarHBondContact O-CA 3.31Å; L64-G68 PolarHBondContact O-N 2.82Å; L64-I79 HydrophobicContact CD2-CD1 4.08Å |
| 65 | E | 98.5 | Very high | 98.4 | Very high | 121 Ų | 121 | 68.8 Ų | 68.8 | 57% | 0.565 | 35% | 0.348 | S | S | * | . | H | α-helix | trans | -62.9 | -54.5 | 175 | 175.5 | 163.1 | -164.9 | 0 | 0 | 110.6 | A61 E62 A67 G68 N69 | A61-E65 WeakPolarHBondContact O-CB 3.25Å; A61-E65 PolarHBondContact O-N 3.47Å; E62-E65 PolarHBondContact O-N 3.3Å; E65-A67 PolarHBondContact O-N 3.12Å; E65-G68 PolarHBondContact O-N 2.7Å; E65-N69 PolarHBondContact O-N 2.77Å; E65-N69 PolarHBondContact O-ND2 2.91Å |
| 66 | L | 98.7 | Very high | 98.4 | Very high | 45 Ų | 45 | 72.4 Ų | 72.4 | 24% | 0.236 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -63.5 | -41.7 | 179.3 | -64.6 | 175.8 | 0 | 0 | 0 | 112 | E62 G68 N69 A70 A87 D91 L94 | E62-L66 HydrophobicContact CG-CD1 4.47Å; E62-L66 WeakPolarHBondContact O-CG 3.27Å; E62-L66 PolarHBondContact O-N 2.97Å; E62-L66 VanDerWaalsContact O-N 3.13Å; L66-G68 VanDerWaalsContact C-N 3.32Å; L66-G68 PolarHBondContact O-N 2.98Å; L66-N69 PolarHBondContact O-N 2.87Å; L66-A70 PolarHBondContact O-N 3.29Å; L66-A87 HydrophobicContact CB-CB 3.65Å; L66-D91 HydrophobicContact CD1-CB 3.94Å; L66-L94 HydrophobicContact CD1-CD1 3.76Å |
| 67 | A | 98.8 | Very high | 98.3 | Very high | 0 Ų | 0 | 76.4 Ų | 76.4 | 0% | 0 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -69.4 | -31.5 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | I63 E65 A71 I79 H83 L84 A87 | I63-A67 WeakPolarHBondContact O-CB 3.03Å; I63-A67 PolarHBondContact O-N 2.88Å; E65-A67 PolarHBondContact O-N 3.12Å; A67-A71 WeakPolarHBondContact O-CB 3.04Å; A67-A71 PolarHBondContact O-N 3.49Å; A67-I79 HydrophobicContact CB-CD1 4.18Å; A67-I79 HydrophobicContact CB-CG2 3.99Å; A67-H83 HydrophobicContact CB-CB 4.44Å; A67-L84 HydrophobicContact CB-CD2 3.81Å; A67-A87 HydrophobicContact CB-CB 4.01Å |
| 68 | G | 98.7 | Very high | 98.3 | Very high | 26 Ų | 26 | 83.7 Ų | 83.7 | 27% | 0.268 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -64.3 | -44.5 | 171.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | L64 E65 L66 A71 R72 | L64-G68 WeakPolarHBondContact O-CA 3.31Å; L64-G68 PolarHBondContact O-N 2.82Å; E65-G68 PolarHBondContact O-N 2.7Å; L66-G68 VanDerWaalsContact C-N 3.32Å; L66-G68 PolarHBondContact O-N 2.98Å; G68-A71 PolarHBondContact O-N 2.98Å; G68-R72 PolarHBondContact O-N 3.44Å |
| 69 | N | 98.5 | Very high | 98.3 | Very high | 51 Ų | 51 | 80 Ų | 80 | 27% | 0.273 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -59.1 | -50.4 | 172.8 | -70.1 | -28.6 | 0 | 0 | 0 | 110.9 | E65 L66 A71 R72 D73 | E65-N69 PolarHBondContact O-N 2.77Å; E65-N69 PolarHBondContact O-ND2 2.91Å; L66-N69 PolarHBondContact O-N 2.87Å; N69-A71 VanDerWaalsContact C-N 3.28Å; N69-A71 PolarHBondContact O-N 3.46Å; N69-R72 WeakPolarHBondContact O-CB 3.38Å; N69-R72 PolarHBondContact O-N 3.02Å; N69-R72 VanDerWaalsContact O-N 3.09Å; N69-R72 PolarHBondContact OD1-NH1 3.02Å; N69-R72 PolarHBondContact OD1-NH2 3.44Å; N69-D73 VanDerWaalsContact O-CG 3.25Å; N69-D73 PolarHBondContact O-N 2.91Å |
| 70 | A | 98.3 | Very high | 98.3 | Very high | 13 Ų | 13 | 81.2 Ų | 81.2 | 11% | 0.107 | 41% | 0.408 | C | S | . | . | H | α-helix | trans | -60.7 | -34.4 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | L66 N74 H83 L86 | L66-A70 PolarHBondContact O-N 3.29Å; A70-N74 PolarHBondContact O-N 3.45Å; A70-N74 PolarHBondContact O-ND2 3.2Å; A70-N74 VanDerWaalsContact O-ND2 3.15Å; A70-H83 HydrophobicContact CB-CB 4.24Å; A70-L86 HydrophobicContact CB-CB 4.33Å |
| 71 | A | 98.7 | Very high | 98.3 | Very high | 4 Ų | 4 | 81.2 Ų | 81.2 | 3% | 0.033 | 41% | 0.41 | C | S | . | . | H | α-helix | trans | -66 | -45.2 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | A67 G68 N69 N74 K75 K76 I79 H83 | A67-A71 WeakPolarHBondContact O-CB 3.04Å; A67-A71 PolarHBondContact O-N 3.49Å; G68-A71 PolarHBondContact O-N 2.98Å; N69-A71 VanDerWaalsContact C-N 3.28Å; N69-A71 PolarHBondContact O-N 3.46Å; A71-N74 CarbonylContact O-C 3.51Å; A71-N74 PolarHBondContact O-N 3.09Å; A71-K75 PolarHBondContact O-N 3.18Å; A71-K76 CarbonylContact C-O 3.33Å; A71-K76 PolarHBondContact O-N 3.17Å; A71-K76 VanDerWaalsContact O-O 3.08Å; A71-I79 HydrophobicContact CB-CG1 4.25Å; A71-H83 VanDerWaalsContact CA-CE1 3.47Å; A71-H83 WeakPolarHBondContact CA-CE1 3.41Å; A71-H83 WeakPolarHBondContact CA-ND1 3.35Å; A71-H83 HydrophobicContact CB-CB 4.49Å; A71-H83 WeakPolarHBondContact CB-ND1 3.35Å |
| 72 | R | 98.4 | Very high | 98.3 | Very high | 159 Ų | 159 | 82 Ų | 82 | 60% | 0.6 | 40% | 0.401 | S | S | * | . | H | α-helix | trans | -62.1 | -43.1 | 178 | -175.4 | 177.9 | 64.5 | -137.6 | -7.4 | 111.6 | G68 N69 N74 K75 | G68-R72 PolarHBondContact O-N 3.44Å; N69-R72 WeakPolarHBondContact O-CB 3.38Å; N69-R72 PolarHBondContact O-N 3.02Å; N69-R72 VanDerWaalsContact O-N 3.09Å; N69-R72 PolarHBondContact OD1-NH1 3.02Å; N69-R72 PolarHBondContact OD1-NH2 3.44Å; R72-N74 VanDerWaalsContact C-N 3.26Å; R72-N74 PolarHBondContact O-N 3.05Å; R72-K75 WeakPolarHBondContact O-CA 3.46Å; R72-K75 PolarHBondContact O-N 3.43Å |
| 73 | D | 97.4 | Very high | 98.3 | Very high | 115 Ų | 115 | 79.5 Ų | 79.5 | 62% | 0.615 | 39% | 0.389 | S | S | * | . | H | α-helix | trans | -63.1 | -35.4 | 178.4 | -63.5 | -15.8 | 0 | 0 | 0 | 111.6 | N69 K75 | N69-D73 VanDerWaalsContact O-CG 3.25Å; N69-D73 PolarHBondContact O-N 2.91Å; D73-K75 PolarHBondContact O-N 2.88Å |
| 74 | N | 96.8 | Very high | 98.3 | Very high | 76 Ų | 76 | 80.2 Ų | 80.2 | 41% | 0.406 | 39% | 0.393 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -79.6 | 11 | 171.9 | -68.6 | -32.7 | 0 | 0 | 0 | 113.9 | A70 A71 R72 K76 H83 | A70-N74 PolarHBondContact O-N 3.45Å; A70-N74 PolarHBondContact O-ND2 3.2Å; A70-N74 VanDerWaalsContact O-ND2 3.15Å; A71-N74 CarbonylContact O-C 3.51Å; A71-N74 PolarHBondContact O-N 3.09Å; R72-N74 VanDerWaalsContact C-N 3.26Å; R72-N74 PolarHBondContact O-N 3.05Å; N74-K76 HydrophobicContact CB-CG 4.34Å; N74-K76 WeakPolarHBondContact O-CG 3.4Å; N74-K76 PolarHBondContact O-N 2.95Å; N74-H83 PolarHBondContact ND2-CD2 3.33Å; N74-H83 VanDerWaalsContact ND2-CD2 3.29Å; N74-H83 PolarHBondContact ND2-NE2 3.21Å |
| 75 | K | 98.1 | Very high | 98.3 | Very high | 194 Ų | 194 | 76.8 Ų | 76.8 | 84% | 0.843 | 38% | 0.375 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 55.9 | 37.6 | -179.1 | -53.5 | 176.3 | -178.1 | 178.1 | 0 | 112.5 | A71 R72 D73 | A71-K75 PolarHBondContact O-N 3.18Å; R72-K75 WeakPolarHBondContact O-CA 3.46Å; R72-K75 PolarHBondContact O-N 3.43Å; D73-K75 PolarHBondContact O-N 2.88Å |
| 76 | K | 98.3 | Very high | 98.3 | Very high | 128 Ų | 128 | 72.4 Ų | 72.4 | 56% | 0.557 | 36% | 0.355 | S | S | * | . | trans | -116.7 | 146 | 176.7 | -58.1 | -57.7 | -179.9 | -178 | 0 | 110.5 | A71 N74 | A71-K76 CarbonylContact C-O 3.33Å; A71-K76 PolarHBondContact O-N 3.17Å; A71-K76 VanDerWaalsContact O-O 3.08Å; N74-K76 HydrophobicContact CB-CG 4.34Å; N74-K76 WeakPolarHBondContact O-CG 3.4Å; N74-K76 PolarHBondContact O-N 2.95Å | ||
| 77 | T | 97.2 | Very high | 98.3 | Very high | 158 Ų | 158 | 70.7 Ų | 70.7 | 97% | 0.969 | 35% | 0.347 | S | S | * | . | S | Bend | trans | -94.7 | -7.9 | 173.6 | 54.8 | 0 | 0 | 0 | 0 | 113.1 | ||
| 78 | R | 98.7 | Very high | 98.2 | Very high | 190 Ų | 190 | 71.1 Ų | 71.1 | 72% | 0.717 | 35% | 0.35 | S | S | * | . | S | Bend | trans | -115.3 | 129.1 | -178.1 | -177.2 | 176.1 | -65.1 | 141.2 | 1.8 | 110.4 | I80 H83 | R78-I80 HydrophobicContact CG-CG2 4.4Å; R78-I80 PolarHBondContact O-N 3.38Å; R78-H83 PolarHBondContact O-CE1 3.08Å; R78-H83 VanDerWaalsContact O-CE1 3.32Å; R78-H83 PolarHBondContact O-ND1 3.36Å |
| 79 | I | 98.7 | Very high | 98.2 | Very high | 64 Ų | 64 | 71.8 Ų | 71.8 | 33% | 0.328 | 34% | 0.344 | S | S | . | . | trans | -69.4 | 127 | 168.2 | -62.8 | 174.3 | 0 | 0 | 0 | 108.5 | L64 A67 A71 H83 L84 | L64-I79 HydrophobicContact CD2-CD1 4.08Å; A67-I79 HydrophobicContact CB-CD1 4.18Å; A67-I79 HydrophobicContact CB-CG2 3.99Å; A71-I79 HydrophobicContact CB-CG1 4.25Å; I79-H83 HydrophobicContact CG2-CB 4.25Å; I79-L84 HydrophobicContact CG2-CD2 4.13Å; I79-L84 HydrophobicContact CG2-CG 4.1Å | ||
| 80 | I | 98.3 | Very high | 98.1 | Very high | 77 Ų | 77 | 74.9 Ų | 74.9 | 40% | 0.395 | 36% | 0.36 | S | S | . | . | trans | -122.1 | 166.9 | 174.5 | 65.8 | 168.8 | 0 | 0 | 0 | 109 | R78 R82 H83 L84 | R78-I80 HydrophobicContact CG-CG2 4.4Å; R78-I80 PolarHBondContact O-N 3.38Å; I80-R82 HydrophobicContact CD1-CB 4.03Å; I80-R82 HydrophobicContact CG1-CB 4.08Å; I80-R82 PolarHBondContact O-N 2.83Å; I80-H83 PolarHBondContact N-ND1 3.05Å; I80-H83 WeakPolarHBondContact O-CB 3.32Å; I80-H83 PolarHBondContact O-N 3.06Å; I80-L84 PolarHBondContact O-N 3.23Å | ||
| 81 | P | 98.6 | Very high | 98.1 | Very high | 53 Ų | 53 | 76.3 Ų | 76.3 | 34% | 0.344 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -53.2 | -32.8 | -178.4 | -30.3 | 37.6 | 0 | 0 | 0 | 114.8 | H83 L84 Q85 I103 A104 Q105 | P81-H83 VanDerWaalsContact C-N 3.32Å; P81-H83 PolarHBondContact O-N 2.76Å; P81-L84 PolarHBondContact O-N 3.25Å; P81-Q85 PolarHBondContact O-N 3.25Å; P81-I103 HydrophobicContact CB-CG2 4.44Å; P81-A104 VanDerWaalsContact CB-O 3.31Å; P81-A104 WeakPolarHBondContact CB-O 3.46Å; P81-Q105 HydrophobicContact CB-CB 4.05Å; P81-Q105 HydrophobicContact CG-CB 4.18Å |
| 82 | R | 98.4 | Very high | 98.1 | Very high | 70 Ų | 70 | 84.2 Ų | 84.2 | 26% | 0.264 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -57.8 | -41.3 | 172.5 | 178.9 | 55.6 | 177.8 | 177 | -2.5 | 113 | I80 Q85 L86 G106 V108 | I80-R82 HydrophobicContact CD1-CB 4.03Å; I80-R82 HydrophobicContact CG1-CB 4.08Å; I80-R82 PolarHBondContact O-N 2.83Å; R82-Q85 PolarHBondContact O-N 3.36Å; R82-L86 HydrophobicContact CG-CD1 4.28Å; R82-L86 WeakPolarHBondContact O-CG 3.4Å; R82-L86 PolarHBondContact O-N 3.24Å; R82-G106 WeakPolarHBondContact CD-O 3.36Å; R82-G106 PolarHBondContact NH1-O 3.1Å; R82-G106 VanDerWaalsContact NH1-O 3.15Å; R82-V108 PolarHBondContact NH1-O 3.38Å; R82-V108 PolarHBondContact NH2-O 3.14Å |
| 83 | H | 98.6 | Very high | 98.1 | Very high | 3 Ų | 3 | 83.5 Ų | 83.5 | 1% | 0.014 | 41% | 0.406 | C | S | . | . | H | α-helix | trans | -69 | -37.8 | -179.9 | -55 | 152.7 | 0 | 0 | 0 | 111.2 | A67 A70 A71 N74 R78 I79 I80 P81 L86 A87 | A67-H83 HydrophobicContact CB-CB 4.44Å; A70-H83 HydrophobicContact CB-CB 4.24Å; A71-H83 VanDerWaalsContact CA-CE1 3.47Å; A71-H83 WeakPolarHBondContact CA-CE1 3.41Å; A71-H83 WeakPolarHBondContact CA-ND1 3.35Å; A71-H83 HydrophobicContact CB-CB 4.49Å; A71-H83 WeakPolarHBondContact CB-ND1 3.35Å; N74-H83 PolarHBondContact ND2-CD2 3.33Å; N74-H83 VanDerWaalsContact ND2-CD2 3.29Å; N74-H83 PolarHBondContact ND2-NE2 3.21Å; R78-H83 PolarHBondContact O-CE1 3.08Å; R78-H83 VanDerWaalsContact O-CE1 3.32Å; R78-H83 PolarHBondContact O-ND1 3.36Å; I79-H83 HydrophobicContact CG2-CB 4.25Å; I80-H83 PolarHBondContact N-ND1 3.05Å; I80-H83 WeakPolarHBondContact O-CB 3.32Å; I80-H83 PolarHBondContact O-N 3.06Å; P81-H83 VanDerWaalsContact C-N 3.32Å; P81-H83 PolarHBondContact O-N 2.76Å; H83-L86 PolarHBondContact O-N 3.06Å; H83-A87 VanDerWaalsContact O-CB 3.3Å; H83-A87 WeakPolarHBondContact O-CB 3.37Å; H83-A87 PolarHBondContact O-N 3.03Å |
| 84 | L | 98.4 | Very high | 98.1 | Very high | 50 Ų | 50 | 78.3 Ų | 78.3 | 26% | 0.262 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -62.8 | -43.5 | 172.7 | -64.9 | 172.9 | 0 | 0 | 0 | 111.5 | I63 A67 I79 I80 P81 A87 I88 I103 | I63-L84 HydrophobicContact CG2-CD2 3.77Å; A67-L84 HydrophobicContact CB-CD2 3.81Å; I79-L84 HydrophobicContact CG2-CD2 4.13Å; I79-L84 HydrophobicContact CG2-CG 4.1Å; I80-L84 PolarHBondContact O-N 3.23Å; P81-L84 PolarHBondContact O-N 3.25Å; L84-A87 PolarHBondContact O-N 3.02Å; L84-I88 HydrophobicContact CB-CD1 4.45Å; L84-I88 VanDerWaalsContact O-CB 3.31Å; L84-I88 WeakPolarHBondContact O-CB 3.49Å; L84-I88 WeakPolarHBondContact O-CG1 3.23Å; L84-I88 PolarHBondContact O-N 3.02Å; L84-I103 HydrophobicContact CB-CG2 4.49Å |
| 85 | Q | 98.4 | Very high | 98.1 | Very high | 15 Ų | 15 | 77.7 Ų | 77.7 | 7% | 0.07 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -61.4 | -46.9 | 176.6 | -178.5 | 76.3 | 19.7 | 0 | 0 | 111.8 | P81 R82 R89 I103 G106 G107 | P81-Q85 PolarHBondContact O-N 3.25Å; R82-Q85 PolarHBondContact O-N 3.36Å; Q85-R89 HydrophobicContact CG-CG 4.27Å; Q85-R89 WeakPolarHBondContact O-CB 3.47Å; Q85-R89 VanDerWaalsContact O-CG 3.27Å; Q85-R89 WeakPolarHBondContact O-CG 3.33Å; Q85-R89 PolarHBondContact O-N 3.05Å; Q85-I103 HydrophobicContact CB-CD1 4.5Å; Q85-G106 WeakPolarHBondContact CB-O 3.43Å; Q85-G106 WeakPolarHBondContact CG-O 3.41Å; Q85-G107 WeakPolarHBondContact CG-O 3.4Å; Q85-G107 PolarHBondContact NE2-O 3.14Å |
| 86 | L | 98 | Very high | 98.1 | Very high | 30 Ų | 30 | 77 Ų | 77 | 16% | 0.157 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -62.9 | -43.3 | 178.7 | -70.3 | 176.9 | 0 | 0 | 0 | 111.5 | A70 R82 H83 N90 L109 | A70-L86 HydrophobicContact CB-CB 4.33Å; R82-L86 HydrophobicContact CG-CD1 4.28Å; R82-L86 WeakPolarHBondContact O-CG 3.4Å; R82-L86 PolarHBondContact O-N 3.24Å; H83-L86 PolarHBondContact O-N 3.06Å; L86-N90 VanDerWaalsContact O-CB 3.29Å; L86-N90 WeakPolarHBondContact O-CB 3.39Å; L86-N90 PolarHBondContact O-N 2.97Å; L86-N90 PolarHBondContact O-ND2 3.49Å; L86-L109 HydrophobicContact CD2-CD2 3.87Å |
| 87 | A | 98.2 | Very high | 98.1 | Very high | 8 Ų | 8 | 75.9 Ų | 75.9 | 7% | 0.066 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -62.3 | -55.5 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | L66 A67 H83 L84 R89 D91 | L66-A87 HydrophobicContact CB-CB 3.65Å; A67-A87 HydrophobicContact CB-CB 4.01Å; H83-A87 VanDerWaalsContact O-CB 3.3Å; H83-A87 WeakPolarHBondContact O-CB 3.37Å; H83-A87 PolarHBondContact O-N 3.03Å; L84-A87 PolarHBondContact O-N 3.02Å; A87-R89 PolarHBondContact O-N 3.3Å; A87-D91 PolarHBondContact O-N 3.17Å |
| 88 | I | 98.3 | Very high | 98.1 | Very high | 10 Ų | 10 | 70.3 Ų | 70.3 | 5% | 0.051 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -67.4 | -35.8 | -173 | -70.5 | 163.2 | 0 | 0 | 0 | 112.3 | I63 L84 L94 N95 L98 I103 | I63-I88 HydrophobicContact CG1-CG1 4.5Å; I63-I88 HydrophobicContact CG2-CD1 4.25Å; I63-I88 HydrophobicContact CG2-CG1 4.38Å; L84-I88 HydrophobicContact CB-CD1 4.45Å; L84-I88 VanDerWaalsContact O-CB 3.31Å; L84-I88 WeakPolarHBondContact O-CB 3.49Å; L84-I88 WeakPolarHBondContact O-CG1 3.23Å; L84-I88 PolarHBondContact O-N 3.02Å; I88-L94 HydrophobicContact CG2-CB 4.43Å; I88-N95 VanDerWaalsContact O-CA 3.31Å; I88-N95 WeakPolarHBondContact O-CA 3.41Å; I88-N95 VanDerWaalsContact O-CB 3.3Å; I88-N95 WeakPolarHBondContact O-CB 3.42Å; I88-N95 PolarHBondContact O-N 2.99Å; I88-N95 VanDerWaalsContact O-N 3.13Å; I88-L98 HydrophobicContact CD1-CD1 3.72Å; I88-L98 HydrophobicContact CG1-CD1 4Å; I88-L98 HydrophobicContact CG2-CB 3.92Å; I88-L98 HydrophobicContact CG2-CD1 3.77Å; I88-L98 HydrophobicContact CG2-CG 4.42Å; I88-I103 HydrophobicContact CB-CD1 4.28Å; I88-I103 HydrophobicContact CD1-CD1 3.59Å; I88-I103 HydrophobicContact CG2-CD1 4.44Å |
| 89 | R | 98.1 | Very high | 98 | Very high | 40 Ų | 40 | 63.6 Ų | 63.6 | 15% | 0.151 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -84.9 | -24 | -176.6 | -60.3 | -52.9 | 173.7 | -148.4 | -4.2 | 114.5 | Q85 A87 N95 L98 V101 L109 | Q85-R89 HydrophobicContact CG-CG 4.27Å; Q85-R89 WeakPolarHBondContact O-CB 3.47Å; Q85-R89 VanDerWaalsContact O-CG 3.27Å; Q85-R89 WeakPolarHBondContact O-CG 3.33Å; Q85-R89 PolarHBondContact O-N 3.05Å; A87-R89 PolarHBondContact O-N 3.3Å; R89-N95 WeakPolarHBondContact CD-OD1 3.43Å; R89-N95 PolarHBondContact NH1-OD1 2.93Å; R89-L98 PolarHBondContact NH1-O 3.49Å; R89-V101 PolarHBondContact NH2-O 3.46Å; R89-L109 HydrophobicContact CB-CD1 3.6Å; R89-L109 HydrophobicContact CB-CD2 3.93Å; R89-L109 HydrophobicContact CB-CG 3.61Å; R89-L109 HydrophobicContact CG-CG 4.38Å |
| 90 | N | 97 | Very high | 97.8 | Very high | 115 Ų | 115 | 72.5 Ų | 72.5 | 62% | 0.615 | 36% | 0.355 | S | S | * | . | H | α-helix | trans | -85 | -20.5 | 175.6 | -72.3 | -49 | 0 | 0 | 0 | 112.5 | L86 | L86-N90 VanDerWaalsContact O-CB 3.29Å; L86-N90 WeakPolarHBondContact O-CB 3.39Å; L86-N90 PolarHBondContact O-N 2.97Å; L86-N90 PolarHBondContact O-ND2 3.49Å |
| 91 | D | 97.9 | Very high | 97.8 | Very high | 44 Ų | 44 | 72.3 Ų | 72.3 | 24% | 0.235 | 36% | 0.357 | C | S | . | . | S | Bend | trans | -86.5 | 128 | 172.6 | -178.6 | -95.8 | 0 | 0 | 0 | 111.4 | L66 A87 E93 L94 N95 | L66-D91 HydrophobicContact CD1-CB 3.94Å; A87-D91 PolarHBondContact O-N 3.17Å; D91-E93 PolarHBondContact OD1-N 3.26Å; D91-L94 HydrophobicContact CB-CB 4.1Å; D91-L94 HydrophobicContact CB-CD1 4.1Å; D91-L94 HydrophobicContact CB-CG 4.33Å; D91-L94 VanDerWaalsContact OD1-CB 3.27Å; D91-L94 WeakPolarHBondContact OD1-CB 3.16Å; D91-L94 VanDerWaalsContact OD1-CG 3.25Å; D91-L94 WeakPolarHBondContact OD1-CG 3.43Å; D91-L94 PolarHBondContact OD1-N 2.98Å; D91-N95 WeakPolarHBondContact O-CB 3.46Å; D91-N95 PolarHBondContact O-N 3.14Å |
| 92 | E | 97.8 | Very high | 97.7 | Very high | 169 Ų | 169 | 76.2 Ų | 76.2 | 79% | 0.79 | 38% | 0.38 | S | S | * | . | H | α-helix | trans | -65.5 | -45.9 | -173.8 | -174.8 | -178.7 | 166.6 | 0 | 0 | 112.3 | K96 | E92-K96 WeakPolarHBondContact O-CB 3.49Å; E92-K96 PolarHBondContact O-N 3.4Å |
| 93 | E | 98 | Very high | 97.6 | Very high | 145 Ų | 145 | 74.3 Ų | 74.3 | 68% | 0.678 | 38% | 0.375 | S | S | * | . | H | α-helix | trans | -71.4 | -46 | -174.4 | -61.8 | -166.6 | 151.2 | 0 | 0 | 111.2 | D91 K96 L97 | D91-E93 PolarHBondContact OD1-N 3.26Å; E93-K96 PolarHBondContact O-N 2.98Å; E93-L97 WeakPolarHBondContact O-CB 3.38Å; E93-L97 PolarHBondContact O-N 3.15Å |
| 94 | L | 98.3 | Very high | 97.6 | Very high | 6 Ų | 6 | 77.7 Ų | 77.7 | 3% | 0.031 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -65.8 | -39 | 175.7 | -67.8 | 177.2 | 0 | 0 | 0 | 111.3 | E62 I63 L66 I88 D91 K96 L97 L98 | E62-L94 HydrophobicContact CG-CD1 4.27Å; I63-L94 HydrophobicContact CD1-CD2 4.24Å; I63-L94 HydrophobicContact CG1-CD1 3.85Å; I63-L94 HydrophobicContact CG1-CD2 3.82Å; I63-L94 HydrophobicContact CG1-CG 4.49Å; L66-L94 HydrophobicContact CD1-CD1 3.76Å; I88-L94 HydrophobicContact CG2-CB 4.43Å; D91-L94 HydrophobicContact CB-CB 4.1Å; D91-L94 HydrophobicContact CB-CD1 4.1Å; D91-L94 HydrophobicContact CB-CG 4.33Å; D91-L94 VanDerWaalsContact OD1-CB 3.27Å; D91-L94 WeakPolarHBondContact OD1-CB 3.16Å; D91-L94 VanDerWaalsContact OD1-CG 3.25Å; D91-L94 WeakPolarHBondContact OD1-CG 3.43Å; D91-L94 PolarHBondContact OD1-N 2.98Å; L94-K96 VanDerWaalsContact C-N 3.3Å; L94-K96 PolarHBondContact O-N 3.36Å; L94-L97 PolarHBondContact O-N 3.47Å; L94-L98 VanDerWaalsContact O-CB 3.31Å; L94-L98 WeakPolarHBondContact O-CB 3.46Å; L94-L98 PolarHBondContact O-N 2.88Å |
| 95 | N | 97.8 | Very high | 97.6 | Very high | 62 Ų | 62 | 83.7 Ų | 83.7 | 33% | 0.332 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -64.9 | -38.6 | 176.3 | -172.3 | 45.1 | 0 | 0 | 0 | 111.2 | I88 R89 D91 L98 G99 | I88-N95 VanDerWaalsContact O-CA 3.31Å; I88-N95 WeakPolarHBondContact O-CA 3.41Å; I88-N95 VanDerWaalsContact O-CB 3.3Å; I88-N95 WeakPolarHBondContact O-CB 3.42Å; I88-N95 PolarHBondContact O-N 2.99Å; I88-N95 VanDerWaalsContact O-N 3.13Å; R89-N95 WeakPolarHBondContact CD-OD1 3.43Å; R89-N95 PolarHBondContact NH1-OD1 2.93Å; D91-N95 WeakPolarHBondContact O-CB 3.46Å; D91-N95 PolarHBondContact O-N 3.14Å; N95-L98 CarbonylContact O-C 3.5Å; N95-G99 WeakPolarHBondContact O-CA 3.44Å; N95-G99 PolarHBondContact O-N 3.18Å |
| 96 | K | 98 | Very high | 97.6 | Very high | 180 Ų | 180 | 83 Ų | 83 | 78% | 0.783 | 43% | 0.428 | S | S | * | . | H | α-helix | trans | -65.8 | -47 | 173.7 | -177 | 177 | 179.9 | 178.5 | 0 | 111.5 | E92 E93 L94 L98 | E92-K96 WeakPolarHBondContact O-CB 3.49Å; E92-K96 PolarHBondContact O-N 3.4Å; E93-K96 PolarHBondContact O-N 2.98Å; L94-K96 VanDerWaalsContact C-N 3.3Å; L94-K96 PolarHBondContact O-N 3.36Å; K96-L98 VanDerWaalsContact C-N 3.33Å; K96-L98 PolarHBondContact O-N 3.4Å |
| 97 | L | 97.9 | Very high | 97.5 | Very high | 105 Ų | 105 | 84.1 Ų | 84.1 | 55% | 0.55 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -61.5 | -40.8 | 178.9 | -179.6 | 62.9 | 0 | 0 | 0 | 112 | L59 E93 L94 | L59-L97 HydrophobicContact CD1-CD2 4.39Å; L59-L97 HydrophobicContact CD2-CD2 3.79Å; E93-L97 WeakPolarHBondContact O-CB 3.38Å; E93-L97 PolarHBondContact O-N 3.15Å; L94-L97 PolarHBondContact O-N 3.47Å |
| 98 | L | 97.5 | Very high | 97.4 | Very high | 40 Ų | 40 | 89 Ų | 89 | 21% | 0.209 | 47% | 0.474 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -109.1 | 22.9 | -174.1 | -57.7 | 177.1 | 0 | 0 | 0 | 112.8 | I63 I88 R89 L94 N95 K96 R100 V101 | I63-L98 HydrophobicContact CD1-CD1 4.24Å; I88-L98 HydrophobicContact CD1-CD1 3.72Å; I88-L98 HydrophobicContact CG1-CD1 4Å; I88-L98 HydrophobicContact CG2-CB 3.92Å; I88-L98 HydrophobicContact CG2-CD1 3.77Å; I88-L98 HydrophobicContact CG2-CG 4.42Å; R89-L98 PolarHBondContact NH1-O 3.49Å; L94-L98 VanDerWaalsContact O-CB 3.31Å; L94-L98 WeakPolarHBondContact O-CB 3.46Å; L94-L98 PolarHBondContact O-N 2.88Å; N95-L98 CarbonylContact O-C 3.5Å; K96-L98 VanDerWaalsContact C-N 3.33Å; K96-L98 PolarHBondContact O-N 3.4Å; L98-R100 PolarHBondContact O-N 3.48Å; L98-R100 VanDerWaalsContact O-N 3.16Å; L98-V101 HydrophobicContact CB-CB 4.32Å; L98-V101 HydrophobicContact CB-CG2 4.38Å; L98-V101 HydrophobicContact CD2-CG2 4.07Å; L98-V101 PolarHBondContact O-N 3.01Å; L98-V101 VanDerWaalsContact O-N 3.08Å |
| 99 | G | 95.1 | Very high | 97.2 | Very high | 49 Ų | 49 | 91 Ų | 91 | 51% | 0.505 | 49% | 0.485 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -63.3 | -25.1 | -171.6 | 0 | 0 | 0 | 0 | 0 | 114.5 | N95 | N95-G99 WeakPolarHBondContact O-CA 3.44Å; N95-G99 PolarHBondContact O-N 3.18Å |
| 100 | R | 95.9 | Very high | 97 | Very high | 251 Ų | 251 | 94.2 Ų | 94.2 | 95% | 0.947 | 51% | 0.511 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -104.7 | 8.4 | 178.4 | -61.1 | -178.4 | -177.3 | 172.5 | 0.6 | 113.8 | L98 | L98-R100 PolarHBondContact O-N 3.48Å; L98-R100 VanDerWaalsContact O-N 3.16Å |
| 101 | V | 96.9 | Very high | 96.9 | Very high | 74 Ų | 74 | 94.4 Ų | 94.4 | 45% | 0.448 | 51% | 0.512 | S | S | . | . | trans | -96.7 | 124.7 | -178.6 | 177.9 | 0 | 0 | 0 | 0 | 109.4 | R89 L98 | R89-V101 PolarHBondContact NH2-O 3.46Å; L98-V101 HydrophobicContact CB-CB 4.32Å; L98-V101 HydrophobicContact CB-CG2 4.38Å; L98-V101 HydrophobicContact CD2-CG2 4.07Å; L98-V101 PolarHBondContact O-N 3.01Å; L98-V101 VanDerWaalsContact O-N 3.08Å | ||
| 102 | T | 97.1 | Very high | 96.8 | Very high | 134 Ų | 134 | 97.9 Ų | 97.9 | 82% | 0.822 | 53% | 0.529 | S | S | * | . | trans | -84.2 | 123.4 | 172.5 | -60.5 | 0 | 0 | 0 | 0 | 110.2 | A104 | T102-A104 PolarHBondContact O-N 3.19Š| ||
| 103 | I | 97.5 | Very high | 96.6 | Very high | 30 Ų | 30 | 95.3 Ų | 95.3 | 15% | 0.154 | 52% | 0.517 | C | S | . | . | trans | -93.2 | 99.7 | 172.7 | -54.9 | 174.7 | 0 | 0 | 0 | 107.7 | P81 L84 Q85 I88 Q105 G106 | P81-I103 HydrophobicContact CB-CG2 4.44Å; L84-I103 HydrophobicContact CB-CG2 4.49Å; Q85-I103 HydrophobicContact CB-CD1 4.5Å; I88-I103 HydrophobicContact CB-CD1 4.28Å; I88-I103 HydrophobicContact CD1-CD1 3.59Å; I88-I103 HydrophobicContact CG2-CD1 4.44Å; I103-Q105 PolarHBondContact O-N 3.27Å; I103-G106 PolarHBondContact O-N 3.11Å | ||
| 104 | A | 98 | Very high | 96.4 | Very high | 75 Ų | 75 | 92.1 Ų | 92.1 | 62% | 0.62 | 52% | 0.516 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.4 | 136.2 | 177.5 | 0 | 0 | 0 | 0 | 0 | 110.6 | P81 T102 G106 | P81-A104 VanDerWaalsContact CB-O 3.31Å; P81-A104 WeakPolarHBondContact CB-O 3.46Å; T102-A104 PolarHBondContact O-N 3.19Å; A104-G106 PolarHBondContact O-N 3.31Å; A104-G106 VanDerWaalsContact O-N 3.14Å |
| 105 | Q | 97.9 | Very high | 96.2 | Very high | 175 Ų | 175 | 98.1 Ų | 98.1 | 82% | 0.818 | 55% | 0.553 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 62.1 | 11.2 | -177.3 | -53.9 | -62.1 | -32.5 | 0 | 0 | 115.3 | P81 I103 | P81-Q105 HydrophobicContact CB-CB 4.05Å; P81-Q105 HydrophobicContact CG-CB 4.18Å; I103-Q105 PolarHBondContact O-N 3.27Å |
| 106 | G | 97.6 | Very high | 96.1 | Very high | 2 Ų | 2 | 101.4 Ų | 101.4 | 2% | 0.021 | 57% | 0.57 | C | S | . | * | trans | -79.7 | -22.5 | 178.2 | 0 | 0 | 0 | 0 | 0 | 114.9 | R82 Q85 I103 A104 | R82-G106 WeakPolarHBondContact CD-O 3.36Å; R82-G106 PolarHBondContact NH1-O 3.1Å; R82-G106 VanDerWaalsContact NH1-O 3.15Å; Q85-G106 WeakPolarHBondContact CB-O 3.43Å; Q85-G106 WeakPolarHBondContact CG-O 3.41Å; I103-G106 PolarHBondContact O-N 3.11Å; A104-G106 PolarHBondContact O-N 3.31Å; A104-G106 VanDerWaalsContact O-N 3.14Å | ||
| 107 | G | 96.4 | Very high | 95.8 | Very high | 52 Ų | 52 | 97.5 Ų | 97.5 | 54% | 0.536 | 56% | 0.557 | S | S | . | * | trans | 66.1 | -156.5 | -168.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | Q85 | Q85-G107 WeakPolarHBondContact CG-O 3.4Å; Q85-G107 PolarHBondContact NE2-O 3.14Å | ||
| 108 | V | 95.8 | Very high | 95.6 | Very high | 110 Ų | 110 | 98.2 Ų | 98.2 | 67% | 0.667 | 57% | 0.568 | S | S | * | * | trans | -124.9 | 161 | 178.8 | -64.3 | 0 | 0 | 0 | 0 | 111 | R82 | R82-V108 PolarHBondContact NH1-O 3.38Å; R82-V108 PolarHBondContact NH2-O 3.14Å | ||
| 109 | L | 95.1 | Very high | 95 | Very high | 54 Ų | 54 | 105.7 Ų | 105.7 | 28% | 0.283 | 60% | 0.599 | S | S | . | * | trans | -58.3 | 133.3 | 167.6 | -72.1 | -175.5 | 0 | 0 | 0 | 108.6 | L86 R89 N111 | L86-L109 HydrophobicContact CD2-CD2 3.87Å; R89-L109 HydrophobicContact CB-CD1 3.6Å; R89-L109 HydrophobicContact CB-CD2 3.93Å; R89-L109 HydrophobicContact CB-CG 3.61Å; R89-L109 HydrophobicContact CG-CG 4.38Å; L109-N111 PolarHBondContact O-N 2.83Å; L109-N111 VanDerWaalsContact O-N 3.13Å | ||
| 110 | P | 93.6 | Very high | 94.3 | Very high | 107 Ų | 107 | 113.3 Ų | 113.3 | 70% | 0.695 | 62% | 0.618 | S | S | * | * | trans | -57.7 | 121.3 | 175.5 | -21.3 | 33.8 | 0 | 0 | 0 | 109.3 | ||||
| 111 | N | 94.7 | Very high | 93.3 | Very high | 119 Ų | 119 | 107.6 Ų | 107.6 | 64% | 0.636 | 61% | 0.611 | S | S | * | * | trans | -149.5 | 135.2 | 177.6 | -179 | 43.5 | 0 | 0 | 0 | 108.7 | L109 Q113 | L109-N111 PolarHBondContact O-N 2.83Å; L109-N111 VanDerWaalsContact O-N 3.13Å; N111-Q113 PolarHBondContact ND2-NE2 2.94Å | ||
| 112 | I | 95.2 | Very high | 92 | Very high | 116 Ų | 116 | 112.2 Ų | 112.2 | 60% | 0.595 | 63% | 0.627 | S | S | * | * | trans | -117.2 | 120.2 | 174.9 | -58 | 177 | 0 | 0 | 0 | 107.1 | L116 L117 | I112-L116 HydrophobicContact CG2-CB 4.2Å; I112-L117 HydrophobicContact CG2-CD2 3.83Å; I112-L117 HydrophobicContact CG2-CG 4.32Å | ||
| 113 | Q | 94 | Very high | 90.5 | Very high | 115 Ų | 115 | 110.3 Ų | 110.3 | 54% | 0.537 | 62% | 0.62 | S | S | . | * | trans | -65.6 | 135.6 | 175.1 | -63 | -63.8 | -17.2 | 0 | 0 | 109.7 | N111 V115 L116 | N111-Q113 PolarHBondContact ND2-NE2 2.94Å; Q113-V115 HydrophobicContact CB-CG1 4.05Å; Q113-V115 PolarHBondContact O-N 3.26Å; Q113-L116 HydrophobicContact CB-CD1 4.28Å; Q113-L116 HydrophobicContact CB-CG 4.31Å; Q113-L116 WeakPolarHBondContact O-CB 3.18Å; Q113-L116 PolarHBondContact O-N 3.47Å | ||
| 114 | A | 93.5 | Very high | 88.6 | Confident | 79 Ų | 79 | 117.3 Ų | 117.3 | 65% | 0.653 | 65% | 0.651 | S | S | * | * | G | 310 helix | trans | -56 | -30.4 | -175.5 | 0 | 0 | 0 | 0 | 0 | 113.6 | L116 L117 | A114-L116 PolarHBondContact O-N 2.91Å; A114-L117 WeakPolarHBondContact O-CB 3.45Å; A114-L117 PolarHBondContact O-N 3.39Å; A114-L117 VanDerWaalsContact O-N 3.13Å |
| 115 | V | 95.1 | Very high | 86.8 | Confident | 131 Ų | 131 | 122 Ų | 122 | 79% | 0.794 | 66% | 0.66 | S | S | * | * | G | 310 helix | trans | -62.9 | -25 | 175.9 | 68.7 | 0 | 0 | 0 | 0 | 113.7 | Q113 L117 | Q113-V115 HydrophobicContact CB-CG1 4.05Å; Q113-V115 PolarHBondContact O-N 3.26Å; V115-L117 VanDerWaalsContact C-N 3.34Å |
| 116 | L | 94.5 | Very high | 84.7 | Confident | 132 Ų | 132 | 122.8 Ų | 122.8 | 69% | 0.691 | 66% | 0.661 | S | S | * | * | G | 310 helix | trans | -85.9 | -8.9 | 178.7 | -58.5 | 176.9 | 0 | 0 | 0 | 112.5 | I112 Q113 A114 | I112-L116 HydrophobicContact CG2-CB 4.2Å; Q113-L116 HydrophobicContact CB-CD1 4.28Å; Q113-L116 HydrophobicContact CB-CG 4.31Å; Q113-L116 WeakPolarHBondContact O-CB 3.18Å; Q113-L116 PolarHBondContact O-N 3.47Å; A114-L116 PolarHBondContact O-N 2.91Å |
| 117 | L | 93.6 | Very high | 82.9 | Confident | 97 Ų | 97 | 127.3 Ų | 127.3 | 51% | 0.508 | 70% | 0.698 | S | S | . | * | S | Bend | trans | -76.7 | 144.5 | 176.1 | -62.4 | 175.5 | 0 | 0 | 0 | 110 | I112 A114 V115 K119 | I112-L117 HydrophobicContact CG2-CD2 3.83Å; I112-L117 HydrophobicContact CG2-CG 4.32Å; A114-L117 WeakPolarHBondContact O-CB 3.45Å; A114-L117 PolarHBondContact O-N 3.39Å; A114-L117 VanDerWaalsContact O-N 3.13Å; V115-L117 VanDerWaalsContact C-N 3.34Å; L117-K119 PolarHBondContact O-N 3Å |
| 118 | P | 92.3 | Very high | 80.9 | Confident | 121 Ų | 121 | 135 Ų | 135 | 79% | 0.786 | 72% | 0.717 | S | S | * | * | P | Polyproline II helix | trans | -56.2 | 134.3 | 174.6 | -21.1 | 31 | 0 | 0 | 0 | 110.6 | K120 | P118-K120 PolarHBondContact O-N 3.49Š|
| 119 | K | 85.5 | Confident | 79.1 | Confident | 197 Ų | 197 | 133.2 Ų | 133.2 | 86% | 0.857 | 72% | 0.72 | S | S | * | * | P | Polyproline II helix | trans | -61.9 | 127 | 168.2 | -68.7 | -178.2 | 174.7 | 178.3 | 0 | 107.5 | L117 T121 | L117-K119 PolarHBondContact O-N 3Å; K119-T121 PolarHBondContact O-N 3.21Å |
| 120 | K | 80.9 | Confident | 77.3 | Confident | 209 Ų | 209 | 144.1 Ų | 144.1 | 91% | 0.909 | 77% | 0.766 | S | S | * | * | trans | -54 | 110 | 169.7 | -90 | -178.2 | 172.5 | -179.9 | 0 | 107.9 | P118 | P118-K120 PolarHBondContact O-N 3.49Š| ||
| 121 | T | 74.1 | Confident | 76.4 | Confident | 130 Ų | 130 | 146 Ų | 146 | 80% | 0.798 | 77% | 0.769 | S | S | * | * | trans | -70.7 | 127.8 | 163.3 | 42.9 | 0 | 0 | 0 | 0 | 107.2 | K119 S123 | K119-T121 PolarHBondContact O-N 3.21Å; T121-S123 PolarHBondContact O-N 2.97Å | ||
| 122 | E | 69.6 | Low | 75.5 | Confident | 171 Ų | 171 | 147.4 Ų | 147.4 | 80% | 0.799 | 78% | 0.776 | S | S | * | * | trans | -53.8 | 118.2 | 169.8 | -66.8 | -171.9 | 166.8 | 0 | 0 | 108.1 | H124 | E122-H124 PolarHBondContact O-N 3.41Š| ||
| 123 | S | 64.6 | Low | 74.4 | Confident | 94 Ų | 94 | 149.2 Ų | 149.2 | 66% | 0.657 | 79% | 0.786 | S | S | * | * | trans | -62.5 | 106.5 | 171.6 | 53.6 | 0 | 0 | 0 | 0 | 106.8 | T121 H125 | T121-S123 PolarHBondContact O-N 2.97Å; S123-H125 PolarHBondContact O-N 2.73Å | ||
| 124 | H | 59.4 | Low | 73.2 | Confident | 177 Ų | 177 | 151.2 Ų | 151.2 | 82% | 0.819 | 80% | 0.801 | S | S | * | * | trans | -65.4 | 73 | 166.5 | -73.4 | -69.7 | 0 | 0 | 0 | 109 | E122 K126 | E122-H124 PolarHBondContact O-N 3.41Å; H124-K126 PolarHBondContact O-N 3.27Å | ||
| 125 | H | 58.6 | Low | 72 | Confident | 173 Ų | 173 | 155.7 Ų | 155.7 | 80% | 0.801 | 81% | 0.81 | S | S | * | * | trans | -69 | 81.4 | 155.4 | -88.2 | -56.4 | 0 | 0 | 0 | 106.5 | S123 A127 | S123-H125 PolarHBondContact O-N 2.73Å; H125-A127 VanDerWaalsContact C-N 3.26Å; H125-A127 PolarHBondContact O-N 2.78Å | ||
| 126 | K | 55.7 | Low | 70.4 | Confident | 192 Ų | 192 | 157.3 Ų | 157.3 | 84% | 0.835 | 81% | 0.811 | S | S | * | * | trans | -58.2 | 100 | 157.3 | -112.5 | -179.8 | 178.2 | 175.5 | 0 | 105.5 | H124 K128 | H124-K126 PolarHBondContact O-N 3.27Å; K126-K128 VanDerWaalsContact C-N 3.29Å; K126-K128 PolarHBondContact O-N 3.26Å | ||
| 127 | A | 59.1 | Low | 68.7 | Low | 98 Ų | 98 | 159.1 Ų | 159.1 | 81% | 0.81 | 82% | 0.82 | S | S | * | * | trans | -56 | 99.6 | 163.9 | 0 | 0 | 0 | 0 | 0 | 107 | H125 G129 | H125-A127 VanDerWaalsContact C-N 3.26Å; H125-A127 PolarHBondContact O-N 2.78Å; A127-G129 PolarHBondContact O-N 3.36Å; A127-G129 VanDerWaalsContact O-N 3.1Å | ||
| 128 | K | 54.1 | Low | 66.8 | Low | 214 Ų | 214 | 163.9 Ų | 163.9 | 93% | 0.93 | 84% | 0.844 | S | S | * | * | trans | -75.6 | 86.4 | 163.3 | -80.3 | -173.5 | 176.3 | -179.9 | 0 | 106.2 | K126 | K126-K128 VanDerWaalsContact C-N 3.29Å; K126-K128 PolarHBondContact O-N 3.26Å | ||
| 129 | G | 58.9 | Low | 64.7 | Low | 71 Ų | 71 | 167.5 Ų | 167.5 | 73% | 0.732 | 85% | 0.848 | S | S | * | * | trans | -128.7 | 93 | 165.4 | 0 | 0 | 0 | 0 | 0 | 107.4 | A127 | A127-G129 PolarHBondContact O-N 3.36Å; A127-G129 VanDerWaalsContact O-N 3.1Å | ||
| 130 | K | 55.5 | Low | 62.8 | Low | 284 Ų | 284 | 164.8 Ų | 164.8 | 100% | 1.235 | 85% | 0.848 | S | S | * | * | trans | -95.6 | 0 | 155.8 | -90.9 | -172.3 | 173.1 | -172.8 | 0 | 106.8 |
Retrieved 130 of 130 residues in 32.3 ms
(Link to these results)