| 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 | 43.4 | Very low | 59.8 | Low | 244 Ų | 244 | 154.1 Ų | 154.1 | 100% | 1.202 | 85% | 0.853 | S | S | * | * | 0 | 95.9 | 0 | -65.4 | 168.2 | 87.2 | 0 | 0 | 107.1 | |||||
| 2 | S | 47.2 | Very low | 60.8 | Low | 117 Ų | 117 | 151.6 Ų | 151.6 | 82% | 0.818 | 85% | 0.854 | S | S | * | * | trans | -86.3 | 108.1 | -179.1 | 18 | 0 | 0 | 0 | 0 | 108.8 | S4 | S2-S4 PolarHBondContact O-N 3.26Š| ||
| 3 | S | 50 | Low | 62.2 | Low | 113 Ų | 113 | 157.8 Ų | 157.8 | 79% | 0.79 | 86% | 0.856 | S | S | * | * | trans | -77.9 | 101.7 | 176.3 | 52.5 | 0 | 0 | 0 | 0 | 110 | T5 | S3-T5 PolarHBondContact O-N 3.17Å; S3-T5 VanDerWaalsContact O-N 3.17Å | ||
| 4 | S | 54.2 | Low | 63.7 | Low | 115 Ų | 115 | 153.6 Ų | 153.6 | 80% | 0.804 | 85% | 0.853 | S | S | * | * | trans | -67.7 | 104.4 | 171.9 | -38.7 | 0 | 0 | 0 | 0 | 109.5 | S2 S6 | S2-S4 PolarHBondContact O-N 3.26Å; S4-S6 PolarHBondContact O-N 3.04Å | ||
| 5 | T | 61 | Low | 65.1 | Low | 128 Ų | 128 | 148.8 Ų | 148.8 | 79% | 0.785 | 82% | 0.824 | S | S | * | * | trans | -69.5 | 100.9 | 168.3 | 44.5 | 0 | 0 | 0 | 0 | 108.8 | S3 R7 | S3-T5 PolarHBondContact O-N 3.17Å; S3-T5 VanDerWaalsContact O-N 3.17Å; T5-R7 PolarHBondContact O-N 3.19Å | ||
| 6 | S | 60.1 | Low | 66.7 | Low | 111 Ų | 111 | 144.6 Ų | 144.6 | 78% | 0.776 | 81% | 0.806 | S | S | * | * | trans | -60.3 | 114.6 | 169.3 | -177.8 | 0 | 0 | 0 | 0 | 108.7 | S4 Q8 | S4-S6 PolarHBondContact O-N 3.04Å; S6-Q8 PolarHBondContact O-N 3.05Å | ||
| 7 | R | 63.7 | Low | 67.9 | Low | 226 Ų | 226 | 141.1 Ų | 141.1 | 85% | 0.853 | 79% | 0.789 | S | S | * | * | trans | -71.7 | 98.3 | 170.2 | -66.7 | -177.2 | -159.2 | -125.1 | 2.2 | 106.8 | T5 L9 | T5-R7 PolarHBondContact O-N 3.19Å; R7-L9 PolarHBondContact O-N 2.94Å | ||
| 8 | Q | 66.5 | Low | 69.1 | Low | 187 Ų | 187 | 142.2 Ų | 142.2 | 87% | 0.874 | 78% | 0.779 | S | S | * | * | trans | -65.2 | 100.9 | 171.3 | -161 | -179.5 | -30 | 0 | 0 | 107.5 | S6 S10 | S6-Q8 PolarHBondContact O-N 3.05Å; Q8-S10 PolarHBondContact O-N 3.21Å | ||
| 9 | L | 65.9 | Low | 70.1 | Confident | 157 Ų | 157 | 139.9 Ų | 139.9 | 82% | 0.822 | 77% | 0.77 | S | S | * | * | trans | -65.5 | 116.1 | 174.4 | -71.1 | 166.1 | 0 | 0 | 0 | 107.4 | R7 E11 | R7-L9 PolarHBondContact O-N 2.94Å; L9-E11 PolarHBondContact O-N 3.08Å | ||
| 10 | S | 70.4 | Confident | 71.1 | Confident | 116 Ų | 116 | 134.9 Ų | 134.9 | 81% | 0.811 | 74% | 0.743 | S | S | * | * | trans | -64.6 | 115.2 | 171.8 | -177 | 0 | 0 | 0 | 0 | 108.2 | Q8 S12 | Q8-S10 PolarHBondContact O-N 3.21Å; S10-S12 PolarHBondContact O-N 3.27Å | ||
| 11 | E | 75.6 | Confident | 71.8 | Confident | 181 Ų | 181 | 132.5 Ų | 132.5 | 85% | 0.846 | 73% | 0.729 | S | S | * | * | trans | -61.5 | 123.7 | 169.7 | -73.7 | -169.5 | 154 | 0 | 0 | 109.3 | L9 R13 | L9-E11 PolarHBondContact O-N 3.08Å; E11-R13 PolarHBondContact O-N 3.14Å | ||
| 12 | S | 71.9 | Confident | 73.8 | Confident | 124 Ų | 124 | 121.2 Ų | 121.2 | 87% | 0.867 | 67% | 0.674 | S | S | * | * | trans | -73.4 | 110.5 | 175.9 | -175.5 | 0 | 0 | 0 | 0 | 109 | S10 | S10-S12 PolarHBondContact O-N 3.27Š| ||
| 13 | R | 79.2 | Confident | 75.4 | Confident | 232 Ų | 232 | 120.8 Ų | 120.8 | 88% | 0.875 | 66% | 0.662 | S | S | * | * | P | Polyproline II helix | trans | -75.8 | 139.3 | 171.6 | -84.3 | -178.6 | 169.9 | -171.3 | -3.1 | 110.3 | E11 I15 | E11-R13 PolarHBondContact O-N 3.14Å; R13-I15 PolarHBondContact O-N 3.26Å |
| 14 | A | 82.8 | Confident | 76.9 | Confident | 99 Ų | 99 | 118.3 Ų | 118.3 | 82% | 0.818 | 64% | 0.64 | S | S | * | * | P | Polyproline II helix | trans | -61.7 | 135.2 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||
| 15 | I | 85.1 | Confident | 78 | Confident | 82 Ų | 82 | 120 Ų | 120 | 42% | 0.421 | 63% | 0.629 | S | S | . | * | P | Polyproline II helix | trans | -73.3 | 126.2 | 178.4 | -62.5 | 174.7 | 0 | 0 | 0 | 109.2 | R13 T17 G47 R49 | R13-I15 PolarHBondContact O-N 3.26Å; I15-T17 PolarHBondContact O-N 3.18Å; I15-T17 PolarHBondContact O-OG1 3.26Å; I15-G47 WeakPolarHBondContact CG2-O 3.37Å; I15-R49 HydrophobicContact CG2-CB 3.8Å |
| 16 | P | 89.6 | Confident | 79 | Confident | 82 Ų | 82 | 119.5 Ų | 119.5 | 53% | 0.532 | 63% | 0.626 | S | S | . | * | P | Polyproline II helix | trans | -55 | 131.1 | 174 | -24.6 | 34.2 | 0 | 0 | 0 | 110.9 | T48 R49 | P16-T48 HydrophobicContact CB-CG2 4.5Å; P16-R49 PolarHBondContact O-N 2.79Å |
| 17 | T | 88.1 | Confident | 80.2 | Confident | 84 Ų | 84 | 118.6 Ų | 118.6 | 52% | 0.515 | 61% | 0.609 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -120.8 | 134.8 | -174.9 | -59.3 | 0 | 0 | 0 | 0 | 111.5 | I15 R49 I51 | I15-T17 PolarHBondContact O-N 3.18Å; I15-T17 PolarHBondContact O-OG1 3.26Å; T17-R49 CarbonylContact C-O 3.55Å; T17-R49 VanDerWaalsContact CA-O 3.28Å; T17-R49 WeakPolarHBondContact CA-O 3.39Å; T17-I51 HydrophobicContact CG2-CD1 3.57Å; T17-I51 HydrophobicContact CG2-CG1 3.91Å |
| 18 | R | 88.4 | Confident | 81.2 | Confident | 162 Ų | 162 | 109.4 Ų | 109.4 | 61% | 0.611 | 58% | 0.577 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -126.1 | 134.7 | 173.6 | 177.8 | -178.9 | 173.3 | 176.5 | -1.3 | 110.1 | V20 T48 R49 I50 I51 | R18-V20 HydrophobicContact CG-CG2 4.32Å; R18-T48 HydrophobicContact CB-CG2 4.38Å; R18-R49 PolarHBondContact N-O 3.14Å; R18-I50 CarbonylContact O-C 3.6Å; R18-I50 VanDerWaalsContact O-CA 3.28Å; R18-I50 WeakPolarHBondContact O-CA 3.46Å; R18-I51 PolarHBondContact O-N 3.22Å |
| 19 | T | 89.5 | Confident | 82.2 | Confident | 99 Ų | 99 | 102.1 Ų | 102.1 | 61% | 0.607 | 55% | 0.545 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -98 | 136.6 | 173.2 | -50.8 | 0 | 0 | 0 | 0 | 110.7 | I51 | T19-I51 CarbonylContact C-O 3.48Å; T19-I51 WeakPolarHBondContact CA-O 3.49Å |
| 20 | V | 88.4 | Confident | 83.2 | Confident | 38 Ų | 38 | 104.1 Ų | 104.1 | 23% | 0.23 | 55% | 0.55 | C | S | . | * | E | Extended strand (participates in β ladder) | trans | -127.8 | 128.1 | 178.5 | 175.8 | 0 | 0 | 0 | 0 | 109.3 | R18 I22 I50 I51 Y52 D53 | R18-V20 HydrophobicContact CG-CG2 4.32Å; V20-I22 HydrophobicContact CG1-CD1 4.13Å; V20-I50 HydrophobicContact CB-CG2 4.18Å; V20-I50 HydrophobicContact CG2-CG2 3.66Å; V20-I51 PolarHBondContact N-O 3.31Å; V20-Y52 HydrophobicContact CB-CD1 4.06Å; V20-Y52 HydrophobicContact CB-CE1 4.26Å; V20-Y52 HydrophobicContact CG1-CD1 4.33Å; V20-Y52 HydrophobicContact CG1-CE1 4.46Å; V20-Y52 WeakPolarHBondContact O-CA 3.22Å; V20-D53 PolarHBondContact O-N 3.31Å |
| 21 | L | 87.4 | Confident | 84.2 | Confident | 85 Ų | 85 | 104.1 Ų | 104.1 | 45% | 0.445 | 54% | 0.541 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -76.3 | 131.9 | 171.4 | 177.1 | 64.3 | 0 | 0 | 0 | 109.8 | D53 K55 | L21-D53 HydrophobicContact CD1-CB 4.04Å; L21-K55 HydrophobicContact CD1-CB 4.47Å; L21-K55 HydrophobicContact CD1-CD 4.06Å |
| 22 | I | 84.9 | Confident | 84.9 | Confident | 8 Ų | 8 | 100 Ų | 100 | 4% | 0.041 | 52% | 0.519 | C | S | . | . | trans | -109 | 119.6 | 175.2 | -60.6 | -59.6 | 0 | 0 | 0 | 109.3 | V20 D24 Q27 L28 Y52 F56 | V20-I22 HydrophobicContact CG1-CD1 4.13Å; I22-D24 VanDerWaalsContact CG2-O 3.22Å; I22-D24 WeakPolarHBondContact CG2-O 3.15Å; I22-Q27 HydrophobicContact CD1-CB 3.94Å; I22-Q27 HydrophobicContact CG2-CB 4.41Å; I22-L28 HydrophobicContact CG1-CD1 4.18Å; I22-Y52 HydrophobicContact CD1-CD1 3.73Å; I22-Y52 HydrophobicContact CD1-CE1 4.38Å; I22-Y52 HydrophobicContact CG1-CD1 3.93Å; I22-Y52 HydrophobicContact CG1-CG 4.33Å; I22-F56 WeakPolarHBondContact O-CB 3.4Å | ||
| 23 | N | 81.5 | Confident | 85.8 | Confident | 107 Ų | 107 | 97.3 Ų | 97.3 | 57% | 0.572 | 50% | 0.499 | S | S | * | . | S | Bend | trans | -100.5 | -21.4 | 177.4 | -64.7 | -39.6 | 0 | 0 | 0 | 112.8 | F56 | N23-F56 WeakPolarHBondContact O-CD2 3.4Š|
| 24 | D | 79.8 | Confident | 86.4 | Confident | 62 Ų | 62 | 90 Ų | 90 | 33% | 0.332 | 48% | 0.48 | S | S | . | . | S | Bend | trans | -147.1 | 154.2 | 179.4 | -178.8 | 27.1 | 0 | 0 | 0 | 110.9 | I22 T26 Q27 | I22-D24 VanDerWaalsContact CG2-O 3.22Å; I22-D24 WeakPolarHBondContact CG2-O 3.15Å; D24-T26 PolarHBondContact O-N 2.82Å; D24-T26 WeakPolarHBondContact OD2-CB 3.15Å; D24-T26 VanDerWaalsContact OD2-CG2 3.29Å; D24-T26 WeakPolarHBondContact OD2-CG2 3.42Å; D24-T26 PolarHBondContact OD2-OG1 3.01Å; D24-Q27 WeakPolarHBondContact O-CB 3.32Å; D24-Q27 PolarHBondContact O-N 3.48Å; D24-Q27 VanDerWaalsContact O-N 3.09Å |
| 25 | R | 77.1 | Confident | 86.7 | Confident | 151 Ų | 151 | 87.7 Ų | 87.7 | 57% | 0.57 | 46% | 0.456 | S | S | * | . | G | 310 helix | trans | -58.4 | -32.2 | 178.9 | -60.6 | -173.9 | 73.5 | 168.4 | -0.5 | 112.9 | Q27 L28 F56 | R25-Q27 PolarHBondContact O-N 3.49Å; R25-L28 WeakPolarHBondContact O-CB 3.43Å; R25-L28 PolarHBondContact O-N 3.25Å; R25-L28 VanDerWaalsContact O-N 3.07Å; R25-F56 HydrophobicContact CB-CE1 4.41Å; R25-F56 HydrophobicContact CG-CD1 4.12Å; R25-F56 HydrophobicContact CG-CE1 3.19Å; R25-F56 HydrophobicContact CG-CZ 3.64Å |
| 26 | T | 83.1 | Confident | 87 | Confident | 117 Ų | 117 | 91 Ų | 91 | 72% | 0.718 | 48% | 0.483 | S | S | * | . | G | 310 helix | trans | -63.5 | -19.4 | 179.5 | 59.5 | 0 | 0 | 0 | 0 | 113 | D24 | D24-T26 PolarHBondContact O-N 2.82Å; D24-T26 WeakPolarHBondContact OD2-CB 3.15Å; D24-T26 VanDerWaalsContact OD2-CG2 3.29Å; D24-T26 WeakPolarHBondContact OD2-CG2 3.42Å; D24-T26 PolarHBondContact OD2-OG1 3.01Å |
| 27 | Q | 84.6 | Confident | 86.9 | Confident | 92 Ų | 92 | 90.3 Ų | 90.3 | 43% | 0.43 | 49% | 0.491 | S | S | . | . | G | 310 helix | trans | -87.8 | -11.4 | 178.4 | -57.2 | 171.2 | 10.3 | 0 | 0 | 112.4 | I22 D24 R25 | I22-Q27 HydrophobicContact CD1-CB 3.94Å; I22-Q27 HydrophobicContact CG2-CB 4.41Å; D24-Q27 WeakPolarHBondContact O-CB 3.32Å; D24-Q27 PolarHBondContact O-N 3.48Å; D24-Q27 VanDerWaalsContact O-N 3.09Å; R25-Q27 PolarHBondContact O-N 3.49Å |
| 28 | L | 85.8 | Confident | 86.7 | Confident | 33 Ų | 33 | 87.4 Ų | 87.4 | 17% | 0.173 | 48% | 0.477 | C | S | . | . | S | Bend | trans | -80.8 | 131.7 | 177.9 | -159.8 | 75.8 | 0 | 0 | 0 | 109.1 | I22 R25 Y32 L40 Y52 | I22-L28 HydrophobicContact CG1-CD1 4.18Å; R25-L28 WeakPolarHBondContact O-CB 3.43Å; R25-L28 PolarHBondContact O-N 3.25Å; R25-L28 VanDerWaalsContact O-N 3.07Å; L28-Y32 HydrophobicContact CD2-CD1 3.44Å; L28-Y32 VanDerWaalsContact CD2-CD1 3.44Å; L28-Y32 HydrophobicContact CD2-CD2 4.11Å; L28-Y32 HydrophobicContact CD2-CE1 3.32Å; L28-Y32 HydrophobicContact CD2-CE2 4.03Å; L28-Y32 HydrophobicContact CD2-CG 3.82Å; L28-Y32 HydrophobicContact CG-CD1 3.9Å; L28-Y32 HydrophobicContact CG-CE1 4.27Å; L28-Y32 HydrophobicContact CG-CG 4.11Å; L28-L40 HydrophobicContact CD1-CD2 3.86Å; L28-L40 HydrophobicContact CD2-CD2 4Å; L28-Y52 HydrophobicContact CD1-CD2 4.39Å; L28-Y52 HydrophobicContact CD1-CG 4.09Å |
| 29 | P | 87.9 | Confident | 86.7 | Confident | 33 Ų | 33 | 82.7 Ų | 82.7 | 21% | 0.214 | 47% | 0.467 | C | S | . | . | trans | -58.8 | 156.7 | 172.5 | -17.2 | 26.4 | 0 | 0 | 0 | 111.6 | D31 Y32 Y52 | P29-D31 VanDerWaalsContact C-N 3.28Å; P29-D31 WeakPolarHBondContact CB-OD1 3.21Å; P29-D31 PolarHBondContact O-N 2.78Å; P29-Y32 WeakPolarHBondContact O-CD1 3.03Å; P29-Y52 HydrophobicContact CG-CE1 4.05Å; P29-Y52 HydrophobicContact CG-CE2 3.83Å; P29-Y52 WeakPolarHBondContact CG-OH 3.28Å | ||
| 30 | H | 87 | Confident | 86.7 | Confident | 200 Ų | 200 | 78.5 Ų | 78.5 | 93% | 0.926 | 44% | 0.44 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.8 | -19.9 | 175.8 | -67.4 | -68.4 | 0 | 0 | 0 | 113.4 | ||
| 31 | D | 89.9 | Confident | 86.9 | Confident | 115 Ų | 115 | 78.8 Ų | 78.8 | 62% | 0.615 | 44% | 0.438 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -110.9 | 24.1 | -172.7 | 62.5 | -19.7 | 0 | 0 | 0 | 112.9 | P29 | P29-D31 VanDerWaalsContact C-N 3.28Å; P29-D31 WeakPolarHBondContact CB-OD1 3.21Å; P29-D31 PolarHBondContact O-N 2.78Å |
| 32 | Y | 90.6 | Very high | 87.1 | Confident | 96 Ų | 96 | 75.1 Ų | 75.1 | 38% | 0.376 | 42% | 0.42 | S | S | . | . | trans | -67.7 | 147.8 | 175.1 | 78.4 | -80.7 | 0 | 0 | 0 | 111.6 | L28 P29 L40 | L28-Y32 HydrophobicContact CD2-CD1 3.44Å; L28-Y32 VanDerWaalsContact CD2-CD1 3.44Å; L28-Y32 HydrophobicContact CD2-CD2 4.11Å; L28-Y32 HydrophobicContact CD2-CE1 3.32Å; L28-Y32 HydrophobicContact CD2-CE2 4.03Å; L28-Y32 HydrophobicContact CD2-CG 3.82Å; L28-Y32 HydrophobicContact CG-CD1 3.9Å; L28-Y32 HydrophobicContact CG-CE1 4.27Å; L28-Y32 HydrophobicContact CG-CG 4.11Å; P29-Y32 WeakPolarHBondContact O-CD1 3.03Å; Y32-L40 HydrophobicContact CD2-CB 4.44Å; Y32-L40 HydrophobicContact CD2-CD2 3.6Å; Y32-L40 HydrophobicContact CD2-CG 3.88Å; Y32-L40 HydrophobicContact CE2-CD2 3.62Å; Y32-L40 HydrophobicContact CE2-CG 4.07Å; Y32-L40 HydrophobicContact CG-CD2 4.46Å | ||
| 33 | C | 90.9 | Very high | 87.5 | Confident | 67 Ų | 67 | 78.2 Ų | 78.2 | 45% | 0.453 | 44% | 0.439 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.6 | 159.4 | 174.4 | -66.2 | 0 | 0 | 0 | 0 | 110.3 | L40 F41 | C33-L40 WeakPolarHBondContact O-CA 3.04Å; C33-F41 HydrophobicContact CB-CD1 4.18Å; C33-F41 HydrophobicContact CB-CE1 3.64Å; C33-F41 HydrophobicContact CB-CE2 4.2Å; C33-F41 HydrophobicContact CB-CZ 3.66Å; C33-F41 PolarHBondContact N-O 2.8Å; C33-F41 PolarHBondContact O-N 3.32Å |
| 34 | T | 91.1 | Very high | 88 | Confident | 78 Ų | 78 | 75.5 Ų | 75.5 | 48% | 0.479 | 43% | 0.427 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.4 | 128.9 | 176.3 | -49.5 | 0 | 0 | 0 | 0 | 109.8 | T39 L40 | T34-T39 WeakPolarHBondContact CA-O 3.4Å; T34-L40 HydrophobicContact CG2-CD1 4.45Å |
| 35 | T | 90.8 | Very high | 88.6 | Confident | 51 Ų | 51 | 79.6 Ų | 79.6 | 31% | 0.313 | 46% | 0.457 | S | S | . | . | trans | -73.2 | 159.2 | 171.5 | 65.4 | 0 | 0 | 0 | 0 | 110.5 | G37 G38 T39 F41 | T35-G37 PolarHBondContact O-N 2.88Å; T35-G37 VanDerWaalsContact O-N 3.08Å; T35-G38 WeakPolarHBondContact O-CA 3.36Å; T35-G38 PolarHBondContact O-N 2.82Å; T35-T39 PolarHBondContact N-O 2.82Å; T35-T39 WeakPolarHBondContact OG1-CB 3.26Å; T35-T39 PolarHBondContact OG1-N 3.04Å; T35-T39 VanDerWaalsContact OG1-N 3.14Å; T35-F41 HydrophobicContact CG2-CD1 3.88Å; T35-F41 HydrophobicContact CG2-CE1 3.62Å | ||
| 36 | P | 90.3 | Very high | 89.3 | Confident | 151 Ų | 151 | 76 Ų | 76 | 98% | 0.981 | 47% | 0.466 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -54.4 | -27.5 | 172.1 | -28.3 | 36.1 | 0 | 0 | 0 | 114 | G38 | P36-G38 PolarHBondContact O-N 3.49Š|
| 37 | G | 87.3 | Confident | 89.7 | Confident | 68 Ų | 68 | 72 Ų | 72 | 70% | 0.701 | 45% | 0.448 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -75.3 | -1.5 | 172.8 | 0 | 0 | 0 | 0 | 0 | 114.9 | T35 | T35-G37 PolarHBondContact O-N 2.88Å; T35-G37 VanDerWaalsContact O-N 3.08Å |
| 38 | G | 84.7 | Confident | 90.1 | Very high | 23 Ų | 23 | 69.8 Ų | 69.8 | 24% | 0.237 | 44% | 0.441 | C | S | . | . | trans | 83.3 | 16.1 | 177.1 | 0 | 0 | 0 | 0 | 0 | 115.1 | T35 P36 | T35-G38 WeakPolarHBondContact O-CA 3.36Å; T35-G38 PolarHBondContact O-N 2.82Å; P36-G38 PolarHBondContact O-N 3.49Å | ||
| 39 | T | 87.5 | Confident | 90.3 | Very high | 63 Ų | 63 | 72.8 Ų | 72.8 | 39% | 0.387 | 45% | 0.45 | S | S | . | . | trans | -82.7 | 123.9 | 175.6 | -56.8 | 0 | 0 | 0 | 0 | 109.7 | T34 T35 I51 | T34-T39 WeakPolarHBondContact CA-O 3.4Å; T35-T39 PolarHBondContact N-O 2.82Å; T35-T39 WeakPolarHBondContact OG1-CB 3.26Å; T35-T39 PolarHBondContact OG1-N 3.04Å; T35-T39 VanDerWaalsContact OG1-N 3.14Å; T39-I51 HydrophobicContact CG2-CG2 3.8Å | ||
| 40 | L | 90 | Very high | 90.5 | Very high | 11 Ų | 11 | 72.4 Ų | 72.4 | 6% | 0.058 | 45% | 0.446 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -82.8 | 132 | 173.3 | -77.8 | 77.2 | 0 | 0 | 0 | 109.9 | L28 Y32 C33 T34 Y52 R54 L57 | L28-L40 HydrophobicContact CD1-CD2 3.86Å; L28-L40 HydrophobicContact CD2-CD2 4Å; Y32-L40 HydrophobicContact CD2-CB 4.44Å; Y32-L40 HydrophobicContact CD2-CD2 3.6Å; Y32-L40 HydrophobicContact CD2-CG 3.88Å; Y32-L40 HydrophobicContact CE2-CD2 3.62Å; Y32-L40 HydrophobicContact CE2-CG 4.07Å; Y32-L40 HydrophobicContact CG-CD2 4.46Å; C33-L40 WeakPolarHBondContact O-CA 3.04Å; T34-L40 HydrophobicContact CG2-CD1 4.45Å; L40-Y52 HydrophobicContact CB-CD2 4.46Å; L40-Y52 PolarHBondContact O-N 3.18Å; L40-R54 HydrophobicContact CD1-CB 4.45Å; L40-L57 HydrophobicContact CD1-CD1 3.98Å; L40-L57 HydrophobicContact CD2-CD1 3.77Å |
| 41 | F | 92.3 | Very high | 90.7 | Very high | 43 Ų | 43 | 65.3 Ų | 65.3 | 19% | 0.189 | 42% | 0.415 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -149.4 | 159.9 | 176.8 | 73.8 | -77 | 0 | 0 | 0 | 112.2 | C33 T35 R49 I50 | C33-F41 HydrophobicContact CB-CD1 4.18Å; C33-F41 HydrophobicContact CB-CE1 3.64Å; C33-F41 HydrophobicContact CB-CE2 4.2Å; C33-F41 HydrophobicContact CB-CZ 3.66Å; C33-F41 PolarHBondContact N-O 2.8Å; C33-F41 PolarHBondContact O-N 3.32Å; T35-F41 HydrophobicContact CG2-CD1 3.88Å; T35-F41 HydrophobicContact CG2-CE1 3.62Å; F41-R49 HydrophobicContact CB-CG 4.41Å; F41-R49 HydrophobicContact CD2-CG 4.32Å; F41-I50 CarbonylContact C-O 3.56Å; F41-I50 WeakPolarHBondContact CA-O 3.36Å; F41-I50 VanDerWaalsContact CB-O 3.26Å; F41-I50 WeakPolarHBondContact CB-O 3.29Å |
| 42 | S | 92.6 | Very high | 90.6 | Very high | 9 Ų | 9 | 60.8 Ų | 60.8 | 6% | 0.063 | 39% | 0.389 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -139 | 168.1 | 165.8 | 67.8 | 0 | 0 | 0 | 0 | 109.3 | R49 I50 Y52 | S42-R49 CarbonylContact O-C 3.59Å; S42-R49 WeakPolarHBondContact O-CA 3.28Å; S42-I50 PolarHBondContact N-O 3.31Å; S42-I50 PolarHBondContact O-N 2.96Å; S42-Y52 VanDerWaalsContact OG-CE2 3.32Å; S42-Y52 WeakPolarHBondContact OG-CE2 3.45Å; S42-Y52 PolarHBondContact OG-OH 2.92Å |
| 43 | T | 92.8 | Very high | 90.3 | Very high | 72 Ų | 72 | 58.6 Ų | 58.6 | 44% | 0.442 | 38% | 0.384 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.7 | 123.4 | 175.1 | -55.1 | 0 | 0 | 0 | 0 | 108.3 | T48 | T43-T48 WeakPolarHBondContact CA-O 3.44Å |
| 44 | T | 91.8 | Very high | 89.5 | Confident | 51 Ų | 51 | 61.3 Ų | 61.3 | 31% | 0.313 | 39% | 0.385 | S | S | . | . | trans | -73.1 | 157.1 | 174.2 | 63.6 | 0 | 0 | 0 | 0 | 110.2 | G46 G47 T48 I50 | T44-G46 PolarHBondContact O-N 2.8Å; T44-G47 PolarHBondContact O-N 3.08Å; T44-T48 PolarHBondContact N-O 3.34Å; T44-T48 PolarHBondContact OG1-N 2.99Å; T44-I50 HydrophobicContact CG2-CD1 3.61Å; T44-I50 HydrophobicContact CG2-CG1 4.3Å | ||
| 45 | P | 92.5 | Very high | 88.8 | Confident | 148 Ų | 148 | 63 Ų | 63 | 96% | 0.961 | 39% | 0.385 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -53 | -26.2 | 174.3 | -29.4 | 36 | 0 | 0 | 0 | 114.4 | G47 | P45-G47 PolarHBondContact O-N 2.92Š|
| 46 | G | 92.3 | Very high | 87.8 | Confident | 74 Ų | 74 | 62.6 Ų | 62.6 | 76% | 0.763 | 38% | 0.379 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -75.9 | 2.2 | 174 | 0 | 0 | 0 | 0 | 0 | 115.1 | T44 | T44-G46 PolarHBondContact O-N 2.8Š|
| 47 | G | 91.3 | Very high | 86.9 | Confident | 33 Ų | 33 | 58.8 Ų | 58.8 | 34% | 0.34 | 35% | 0.35 | S | S | . | . | S | Bend | trans | 85.9 | 3.4 | 175.6 | 0 | 0 | 0 | 0 | 0 | 115.2 | I15 T44 P45 | I15-G47 WeakPolarHBondContact CG2-O 3.37Å; T44-G47 PolarHBondContact O-N 3.08Å; P45-G47 PolarHBondContact O-N 2.92Å |
| 48 | T | 92.1 | Very high | 86.5 | Confident | 46 Ų | 46 | 58.4 Ų | 58.4 | 28% | 0.282 | 33% | 0.332 | S | S | . | . | P | Polyproline II helix | trans | -79.3 | 127.7 | 177.5 | -59.9 | 0 | 0 | 0 | 0 | 110.3 | P16 R18 T43 T44 | P16-T48 HydrophobicContact CB-CG2 4.5Å; R18-T48 HydrophobicContact CB-CG2 4.38Å; T43-T48 WeakPolarHBondContact CA-O 3.44Å; T44-T48 PolarHBondContact N-O 3.34Å; T44-T48 PolarHBondContact OG1-N 2.99Å |
| 49 | R | 91.8 | Very high | 86.2 | Confident | 97 Ų | 97 | 62.5 Ų | 62.5 | 37% | 0.366 | 35% | 0.348 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -81.1 | 122.5 | 170.4 | -178.3 | 174.1 | -72.6 | 178.1 | -2.6 | 109.8 | I15 P16 T17 R18 F41 S42 | I15-R49 HydrophobicContact CG2-CB 3.8Å; P16-R49 PolarHBondContact O-N 2.79Å; T17-R49 CarbonylContact C-O 3.55Å; T17-R49 VanDerWaalsContact CA-O 3.28Å; T17-R49 WeakPolarHBondContact CA-O 3.39Å; R18-R49 PolarHBondContact N-O 3.14Å; F41-R49 HydrophobicContact CB-CG 4.41Å; F41-R49 HydrophobicContact CD2-CG 4.32Å; S42-R49 CarbonylContact O-C 3.59Å; S42-R49 WeakPolarHBondContact O-CA 3.28Å |
| 50 | I | 92 | Very high | 85.7 | Confident | 24 Ų | 24 | 63.5 Ų | 63.5 | 12% | 0.123 | 35% | 0.345 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.2 | 126.7 | 173.3 | -54.4 | 175.7 | 0 | 0 | 0 | 108 | R18 V20 F41 S42 T44 Y52 | R18-I50 CarbonylContact O-C 3.6Å; R18-I50 VanDerWaalsContact O-CA 3.28Å; R18-I50 WeakPolarHBondContact O-CA 3.46Å; V20-I50 HydrophobicContact CB-CG2 4.18Å; V20-I50 HydrophobicContact CG2-CG2 3.66Å; F41-I50 CarbonylContact C-O 3.56Å; F41-I50 WeakPolarHBondContact CA-O 3.36Å; F41-I50 VanDerWaalsContact CB-O 3.26Å; F41-I50 WeakPolarHBondContact CB-O 3.29Å; S42-I50 PolarHBondContact N-O 3.31Å; S42-I50 PolarHBondContact O-N 2.96Å; T44-I50 HydrophobicContact CG2-CD1 3.61Å; T44-I50 HydrophobicContact CG2-CG1 4.3Å; I50-Y52 HydrophobicContact CB-CE1 4.39Å; I50-Y52 HydrophobicContact CB-CE2 4.24Å; I50-Y52 HydrophobicContact CG2-CD1 4.07Å; I50-Y52 HydrophobicContact CG2-CE1 3.46Å; I50-Y52 VanDerWaalsContact CG2-CE1 3.46Å; I50-Y52 HydrophobicContact CG2-CE2 4.08Å; I50-Y52 VanDerWaalsContact CG2-CZ 3.43Å |
| 51 | I | 90.3 | Very high | 85.3 | Confident | 52 Ų | 52 | 71.1 Ų | 71.1 | 27% | 0.267 | 37% | 0.373 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.3 | 124.5 | 173.1 | -60.8 | 178.3 | 0 | 0 | 0 | 108.2 | T17 R18 T19 V20 T39 | T17-I51 HydrophobicContact CG2-CD1 3.57Å; T17-I51 HydrophobicContact CG2-CG1 3.91Å; R18-I51 PolarHBondContact O-N 3.22Å; T19-I51 CarbonylContact C-O 3.48Å; T19-I51 WeakPolarHBondContact CA-O 3.49Å; V20-I51 PolarHBondContact N-O 3.31Å; T39-I51 HydrophobicContact CG2-CG2 3.8Å |
| 52 | Y | 87.5 | Confident | 84.8 | Confident | 19 Ų | 19 | 73.8 Ų | 73.8 | 8% | 0.075 | 39% | 0.389 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -97.9 | 125.6 | -179.8 | -59.6 | -71.4 | 0 | 0 | 0 | 110.2 | V20 I22 L28 P29 L40 S42 I50 R54 | V20-Y52 HydrophobicContact CB-CD1 4.06Å; V20-Y52 HydrophobicContact CB-CE1 4.26Å; V20-Y52 HydrophobicContact CG1-CD1 4.33Å; V20-Y52 HydrophobicContact CG1-CE1 4.46Å; V20-Y52 WeakPolarHBondContact O-CA 3.22Å; I22-Y52 HydrophobicContact CD1-CD1 3.73Å; I22-Y52 HydrophobicContact CD1-CE1 4.38Å; I22-Y52 HydrophobicContact CG1-CD1 3.93Å; I22-Y52 HydrophobicContact CG1-CG 4.33Å; L28-Y52 HydrophobicContact CD1-CD2 4.39Å; L28-Y52 HydrophobicContact CD1-CG 4.09Å; P29-Y52 HydrophobicContact CG-CE1 4.05Å; P29-Y52 HydrophobicContact CG-CE2 3.83Å; P29-Y52 WeakPolarHBondContact CG-OH 3.28Å; L40-Y52 HydrophobicContact CB-CD2 4.46Å; L40-Y52 PolarHBondContact O-N 3.18Å; S42-Y52 VanDerWaalsContact OG-CE2 3.32Å; S42-Y52 WeakPolarHBondContact OG-CE2 3.45Å; S42-Y52 PolarHBondContact OG-OH 2.92Å; I50-Y52 HydrophobicContact CB-CE1 4.39Å; I50-Y52 HydrophobicContact CB-CE2 4.24Å; I50-Y52 HydrophobicContact CG2-CD1 4.07Å; I50-Y52 HydrophobicContact CG2-CE1 3.46Å; I50-Y52 VanDerWaalsContact CG2-CE1 3.46Å; I50-Y52 HydrophobicContact CG2-CE2 4.08Å; I50-Y52 VanDerWaalsContact CG2-CZ 3.43Å; Y52-R54 PolarHBondContact O-N 3.09Å |
| 53 | D | 83.8 | Confident | 84.4 | Confident | 51 Ų | 51 | 74.9 Ų | 74.9 | 27% | 0.273 | 40% | 0.397 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -70.1 | 128.1 | 177.2 | -165.4 | -1.3 | 0 | 0 | 0 | 110.2 | V20 L21 K55 | V20-D53 PolarHBondContact O-N 3.31Å; L21-D53 HydrophobicContact CD1-CB 4.04Å; D53-K55 VanDerWaalsContact C-N 3.25Å; D53-K55 PolarHBondContact O-N 3.2Å; D53-K55 IonicContact OD2-NZ 2.64Å; D53-K55 PolarHBondContact OD2-NZ 3.07Å |
| 54 | R | 75.7 | Confident | 83.9 | Confident | 124 Ų | 124 | 76.6 Ų | 76.6 | 47% | 0.468 | 41% | 0.409 | S | S | . | . | trans | -84.1 | 10.1 | -173.6 | 70.1 | 171.4 | -172.5 | 171.8 | 7.5 | 113.9 | L40 Y52 F56 L57 L58 | L40-R54 HydrophobicContact CD1-CB 4.45Å; Y52-R54 PolarHBondContact O-N 3.09Å; R54-F56 VanDerWaalsContact C-N 3.31Å; R54-F56 PolarHBondContact O-N 2.89Å; R54-L57 PolarHBondContact O-N 3.45Å; R54-L58 HydrophobicContact CG-CD1 3.84Å; R54-L58 HydrophobicContact CG-CG 3.9Å; R54-L58 PolarHBondContact O-N 2.66Å | ||
| 55 | K | 76.3 | Confident | 83.4 | Confident | 113 Ų | 113 | 80.6 Ų | 80.6 | 49% | 0.491 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -48.4 | -51.5 | -177 | -80.2 | -169.8 | 179.7 | 68.4 | 0 | 112.1 | L21 D53 L57 L58 D59 | L21-K55 HydrophobicContact CD1-CB 4.47Å; L21-K55 HydrophobicContact CD1-CD 4.06Å; D53-K55 VanDerWaalsContact C-N 3.25Å; D53-K55 PolarHBondContact O-N 3.2Å; D53-K55 IonicContact OD2-NZ 2.64Å; D53-K55 PolarHBondContact OD2-NZ 3.07Å; K55-L57 PolarHBondContact O-N 2.84Å; K55-L58 CarbonylContact O-C 3.49Å; K55-L58 PolarHBondContact O-N 3.24Å; K55-L58 VanDerWaalsContact O-N 3.1Å; K55-D59 WeakPolarHBondContact O-CB 3.46Å; K55-D59 PolarHBondContact O-N 3.32Å |
| 56 | F | 69.1 | Low | 82.9 | Confident | 43 Ų | 43 | 76.3 Ų | 76.3 | 19% | 0.189 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -57.4 | -43.2 | 177 | 174.7 | -91.9 | 0 | 0 | 0 | 113.7 | I22 N23 R25 R54 L58 D59 R60 | I22-F56 WeakPolarHBondContact O-CB 3.4Å; N23-F56 WeakPolarHBondContact O-CD2 3.4Å; R25-F56 HydrophobicContact CB-CE1 4.41Å; R25-F56 HydrophobicContact CG-CD1 4.12Å; R25-F56 HydrophobicContact CG-CE1 3.19Å; R25-F56 HydrophobicContact CG-CZ 3.64Å; R54-F56 VanDerWaalsContact C-N 3.31Å; R54-F56 PolarHBondContact O-N 2.89Å; F56-L58 VanDerWaalsContact C-N 3.34Å; F56-L58 PolarHBondContact O-N 3.22Å; F56-D59 PolarHBondContact O-N 2.99Å; F56-R60 HydrophobicContact CE1-CG 4.13Å; F56-R60 VanDerWaalsContact CE1-NE 3.34Å; F56-R60 HydrophobicContact CZ-CG 4.08Å; F56-R60 WeakPolarHBondContact O-CG 3.44Å; F56-R60 PolarHBondContact O-N 3.29Å |
| 57 | L | 71.3 | Confident | 82.4 | Confident | 70 Ų | 70 | 79.2 Ų | 79.2 | 37% | 0.366 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -65 | -39.1 | 177.2 | -77.2 | 171.3 | 0 | 0 | 0 | 111.9 | L40 R54 K55 R60 | L40-L57 HydrophobicContact CD1-CD1 3.98Å; L40-L57 HydrophobicContact CD2-CD1 3.77Å; R54-L57 PolarHBondContact O-N 3.45Å; K55-L57 PolarHBondContact O-N 2.84Å; L57-R60 PolarHBondContact O-N 2.94Å |
| 58 | L | 78 | Confident | 82 | Confident | 61 Ų | 61 | 80.9 Ų | 80.9 | 32% | 0.319 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -69.1 | -39.6 | 176.3 | -69.3 | 179.4 | 0 | 0 | 0 | 112.2 | R54 K55 F56 R60 R61 | R54-L58 HydrophobicContact CG-CD1 3.84Å; R54-L58 HydrophobicContact CG-CG 3.9Å; R54-L58 PolarHBondContact O-N 2.66Å; K55-L58 CarbonylContact O-C 3.49Å; K55-L58 PolarHBondContact O-N 3.24Å; K55-L58 VanDerWaalsContact O-N 3.1Å; F56-L58 VanDerWaalsContact C-N 3.34Å; F56-L58 PolarHBondContact O-N 3.22Å; L58-R60 PolarHBondContact O-N 3.33Å; L58-R61 WeakPolarHBondContact O-CB 3.49Å; L58-R61 VanDerWaalsContact O-CD 3.32Å; L58-R61 WeakPolarHBondContact O-CD 3.04Å; L58-R61 WeakPolarHBondContact O-CG 3.44Å; L58-R61 PolarHBondContact O-N 2.64Å |
| 59 | D | 79.4 | Confident | 81.4 | Confident | 108 Ų | 108 | 80.2 Ų | 80.2 | 58% | 0.578 | 40% | 0.398 | S | S | * | . | H | α-helix | trans | -62.4 | -33.8 | 178.5 | -68.4 | -22.5 | 0 | 0 | 0 | 110.9 | K55 F56 R61 N62 | K55-D59 WeakPolarHBondContact O-CB 3.46Å; K55-D59 PolarHBondContact O-N 3.32Å; F56-D59 PolarHBondContact O-N 2.99Å; D59-R61 PolarHBondContact O-N 3.32Å; D59-N62 PolarHBondContact O-N 3.01Å |
| 60 | R | 76.6 | Confident | 80.9 | Confident | 85 Ų | 85 | 79.3 Ų | 79.3 | 32% | 0.321 | 41% | 0.405 | S | S | . | . | G | 310 helix | trans | -65 | -16.1 | 173.4 | -70.8 | -155.8 | -65.5 | 161.4 | -1.5 | 114.6 | F56 L57 L58 N62 S63 A66 | F56-R60 HydrophobicContact CE1-CG 4.13Å; F56-R60 VanDerWaalsContact CE1-NE 3.34Å; F56-R60 HydrophobicContact CZ-CG 4.08Å; F56-R60 WeakPolarHBondContact O-CG 3.44Å; F56-R60 PolarHBondContact O-N 3.29Å; L57-R60 PolarHBondContact O-N 2.94Å; L58-R60 PolarHBondContact O-N 3.33Å; R60-N62 PolarHBondContact O-N 2.78Å; R60-N62 VanDerWaalsContact O-N 3.16Å; R60-S63 VanDerWaalsContact O-CB 3.23Å; R60-S63 WeakPolarHBondContact O-CB 3.32Å; R60-S63 PolarHBondContact O-N 3.27Å; R60-S63 PolarHBondContact O-OG 3.05Å; R60-A66 WeakPolarHBondContact O-CB 3.32Å |
| 61 | R | 82 | Confident | 80.3 | Confident | 171 Ų | 171 | 81.3 Ų | 81.3 | 65% | 0.645 | 43% | 0.425 | S | S | * | . | G | 310 helix | trans | -59.6 | -26.9 | 175 | 87.2 | -168.9 | -178.7 | 176.8 | -4.3 | 112.5 | L58 D59 S63 | L58-R61 WeakPolarHBondContact O-CB 3.49Å; L58-R61 VanDerWaalsContact O-CD 3.32Å; L58-R61 WeakPolarHBondContact O-CD 3.04Å; L58-R61 WeakPolarHBondContact O-CG 3.44Å; L58-R61 PolarHBondContact O-N 2.64Å; D59-R61 PolarHBondContact O-N 3.32Å; R61-S63 VanDerWaalsContact C-N 3.33Å |
| 62 | N | 80.9 | Confident | 79.9 | Confident | 98 Ų | 98 | 87 Ų | 87 | 52% | 0.524 | 45% | 0.45 | S | S | . | . | G | 310 helix | trans | -89 | -1.8 | 178.8 | -58.7 | -38.8 | 0 | 0 | 0 | 112.4 | D59 R60 | D59-N62 PolarHBondContact O-N 3.01Å; R60-N62 PolarHBondContact O-N 2.78Å; R60-N62 VanDerWaalsContact O-N 3.16Å |
| 63 | S | 84.8 | Confident | 79.6 | Confident | 32 Ų | 32 | 89.9 Ų | 89.9 | 22% | 0.224 | 47% | 0.466 | C | S | . | . | S | Bend | trans | -67.7 | 145.2 | 177.1 | 68.9 | 0 | 0 | 0 | 0 | 110.5 | R60 R61 I65 A66 Q67 | R60-S63 VanDerWaalsContact O-CB 3.23Å; R60-S63 WeakPolarHBondContact O-CB 3.32Å; R60-S63 PolarHBondContact O-N 3.27Å; R60-S63 PolarHBondContact O-OG 3.05Å; R61-S63 VanDerWaalsContact C-N 3.33Å; S63-I65 PolarHBondContact O-N 3.37Å; S63-I65 VanDerWaalsContact O-N 3.15Å; S63-I65 WeakPolarHBondContact OG-CG2 3.49Å; S63-A66 PolarHBondContact O-N 2.81Å; S63-A66 WeakPolarHBondContact OG-CB 3.37Å; S63-A66 PolarHBondContact OG-N 3.46Å; S63-Q67 PolarHBondContact O-N 2.98Å |
| 64 | P | 83 | Confident | 79.6 | Confident | 108 Ų | 108 | 91.3 Ų | 91.3 | 70% | 0.701 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -53.7 | -37.7 | 179.9 | -28.4 | 35 | 0 | 0 | 0 | 113.2 | A66 Q67 T68 | P64-A66 VanDerWaalsContact C-N 3.34Å; P64-A66 PolarHBondContact O-N 3.44Å; P64-Q67 PolarHBondContact O-N 3.27Å; P64-Q67 VanDerWaalsContact O-N 3.14Å; P64-T68 PolarHBondContact O-N 3Å |
| 65 | I | 79.8 | Confident | 80 | Confident | 136 Ų | 136 | 90.2 Ų | 90.2 | 70% | 0.697 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -70.1 | -26.4 | 179.5 | -163 | 160.9 | 0 | 0 | 0 | 113.6 | S63 Q67 T68 | S63-I65 PolarHBondContact O-N 3.37Å; S63-I65 VanDerWaalsContact O-N 3.15Å; S63-I65 WeakPolarHBondContact OG-CG2 3.49Å; I65-Q67 VanDerWaalsContact C-N 3.26Å; I65-T68 PolarHBondContact O-OG1 2.68Å |
| 66 | A | 83.8 | Confident | 80.5 | Confident | 58 Ų | 58 | 88.7 Ų | 88.7 | 48% | 0.479 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -76.8 | -18.6 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | R60 S63 P64 | R60-A66 WeakPolarHBondContact O-CB 3.32Å; S63-A66 PolarHBondContact O-N 2.81Å; S63-A66 WeakPolarHBondContact OG-CB 3.37Å; S63-A66 PolarHBondContact OG-N 3.46Å; P64-A66 VanDerWaalsContact C-N 3.34Å; P64-A66 PolarHBondContact O-N 3.44Å |
| 67 | Q | 81.9 | Confident | 81.2 | Confident | 135 Ų | 135 | 92.4 Ų | 92.4 | 63% | 0.631 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -92.1 | -9.3 | 176.8 | -63.1 | -178.1 | 6.1 | 0 | 0 | 112.9 | S63 P64 I65 P69 | S63-Q67 PolarHBondContact O-N 2.98Å; P64-Q67 PolarHBondContact O-N 3.27Å; P64-Q67 VanDerWaalsContact O-N 3.14Å; I65-Q67 VanDerWaalsContact C-N 3.26Å; Q67-P69 VanDerWaalsContact O-CD 3.31Å; Q67-P69 WeakPolarHBondContact O-CD 3.04Å |
| 68 | T | 81.3 | Confident | 81.7 | Confident | 67 Ų | 67 | 93.5 Ų | 93.5 | 41% | 0.411 | 53% | 0.534 | S | S | . | . | S | Bend | trans | -76.4 | 119.8 | 171.8 | 56.6 | 0 | 0 | 0 | 0 | 109.1 | P64 I65 | P64-T68 PolarHBondContact O-N 3Å; I65-T68 PolarHBondContact O-OG1 2.68Å |
| 69 | P | 79.8 | Confident | 82.1 | Confident | 33 Ų | 33 | 95.6 Ų | 95.6 | 21% | 0.214 | 55% | 0.549 | C | S | . | . | P | Polyproline II helix | trans | -61.3 | 147.9 | 175.6 | -22 | 33.7 | 0 | 0 | 0 | 111.9 | Q67 A71 V84 | Q67-P69 VanDerWaalsContact O-CD 3.31Å; Q67-P69 WeakPolarHBondContact O-CD 3.04Å; P69-A71 PolarHBondContact O-N 3.35Å; P69-V84 HydrophobicContact CB-CB 3.81Å; P69-V84 HydrophobicContact CB-CG1 3.15Å; P69-V84 HydrophobicContact CB-CG2 3.64Å; P69-V84 HydrophobicContact CG-CB 4.04Å; P69-V84 HydrophobicContact CG-CG1 3.83Å; P69-V84 HydrophobicContact CG-CG2 3.8Å |
| 70 | P | 80.7 | Confident | 82.3 | Confident | 78 Ų | 78 | 91.9 Ų | 91.9 | 51% | 0.506 | 53% | 0.53 | S | S | . | . | P | Polyproline II helix | trans | -61.5 | 131.2 | 175.2 | -21.5 | 32.5 | 0 | 0 | 0 | 111.4 | L73 | P70-L73 HydrophobicContact CB-CB 4.36Å; P70-L73 HydrophobicContact CG-CD2 4.48Å |
| 71 | A | 80.7 | Confident | 82 | Confident | 66 Ų | 66 | 92 Ų | 92 | 55% | 0.545 | 54% | 0.544 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -64.3 | 142.7 | 172.9 | 0 | 0 | 0 | 0 | 0 | 110.1 | P69 L73 | P69-A71 PolarHBondContact O-N 3.35Å; A71-L73 PolarHBondContact O-N 3.42Å |
| 72 | H | 80.7 | Confident | 81 | Confident | 170 Ų | 170 | 88.9 Ų | 88.9 | 79% | 0.787 | 54% | 0.54 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 61 | 22 | 176.5 | -45.4 | -67.4 | 0 | 0 | 0 | 116.1 | ||
| 73 | L | 82.2 | Confident | 79.9 | Confident | 80 Ų | 80 | 91 Ų | 91 | 42% | 0.419 | 55% | 0.551 | S | S | . | * | trans | -70.4 | 127.3 | 173.4 | -164.5 | 71.8 | 0 | 0 | 0 | 110.4 | P70 A71 T80 | P70-L73 HydrophobicContact CB-CB 4.36Å; P70-L73 HydrophobicContact CG-CD2 4.48Å; A71-L73 PolarHBondContact O-N 3.42Å; L73-T80 HydrophobicContact CD2-CG2 3.54Å; L73-T80 HydrophobicContact CG-CG2 3.98Å | ||
| 74 | P | 83.6 | Confident | 78.5 | Confident | 82 Ų | 82 | 91.2 Ų | 91.2 | 53% | 0.532 | 55% | 0.551 | S | S | . | * | trans | -66.3 | 150.3 | -179.9 | 27.7 | -34.7 | 0 | 0 | 0 | 111.4 | I76 T80 | P74-I76 HydrophobicContact CG-CD1 4.42Å; P74-I76 PolarHBondContact O-N 3.21Å; P74-T80 PolarHBondContact O-OG1 3.31Å | ||
| 75 | I | 84.3 | Confident | 77.2 | Confident | 101 Ų | 101 | 89.7 Ų | 89.7 | 52% | 0.518 | 54% | 0.536 | S | S | . | . | trans | -83.7 | 100.9 | 177.1 | -52.2 | 167.9 | 0 | 0 | 0 | 108.9 | T80 L82 L85 | I75-T80 WeakPolarHBondContact CA-OG1 3.19Å; I75-L82 HydrophobicContact CD1-CD1 3.79Å; I75-L85 HydrophobicContact CD1-CD1 3.76Å; I75-L85 HydrophobicContact CG1-CD1 4.39Å | ||
| 76 | I | 87.5 | Confident | 76 | Confident | 80 Ų | 80 | 87.7 Ų | 87.7 | 41% | 0.41 | 53% | 0.531 | S | S | . | . | trans | -102.8 | 115 | 172.7 | -57.2 | 170.4 | 0 | 0 | 0 | 107.9 | P74 G78 V79 T80 | P74-I76 HydrophobicContact CG-CD1 4.42Å; P74-I76 PolarHBondContact O-N 3.21Å; I76-G78 PolarHBondContact O-N 2.98Å; I76-V79 HydrophobicContact CB-CB 3.96Å; I76-V79 HydrophobicContact CB-CG2 4.4Å; I76-V79 HydrophobicContact CG2-CB 3.78Å; I76-V79 HydrophobicContact CG2-CG2 3.65Å; I76-V79 PolarHBondContact O-N 2.95Å; I76-T80 PolarHBondContact N-OG1 3.18Å; I76-T80 PolarHBondContact O-N 3.16Å; I76-T80 PolarHBondContact O-OG1 3.41Å | ||
| 77 | P | 83.1 | Confident | 74.6 | Confident | 121 Ų | 121 | 89 Ų | 89 | 79% | 0.786 | 53% | 0.527 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -53.4 | 129.9 | 178.6 | -26 | 34.3 | 0 | 0 | 0 | 112 | V79 | P77-V79 PolarHBondContact O-N 3.48Š|
| 78 | G | 82.6 | Confident | 73.3 | Confident | 93 Ų | 93 | 83.5 Ų | 83.5 | 96% | 0.959 | 50% | 0.502 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 77 | -6 | -179.5 | 0 | 0 | 0 | 0 | 0 | 115.8 | I76 | I76-G78 PolarHBondContact O-N 2.98Š|
| 79 | V | 86.3 | Confident | 71.9 | Confident | 106 Ų | 106 | 89.7 Ų | 89.7 | 64% | 0.642 | 52% | 0.518 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -114.1 | -52 | 179.3 | -179 | 0 | 0 | 0 | 0 | 111.3 | I76 P77 | I76-V79 HydrophobicContact CB-CB 3.96Å; I76-V79 HydrophobicContact CB-CG2 4.4Å; I76-V79 HydrophobicContact CG2-CB 3.78Å; I76-V79 HydrophobicContact CG2-CG2 3.65Å; I76-V79 PolarHBondContact O-N 2.95Å; P77-V79 PolarHBondContact O-N 3.48Å |
| 80 | T | 82.6 | Confident | 70.7 | Confident | 30 Ų | 30 | 96.3 Ų | 96.3 | 18% | 0.184 | 54% | 0.538 | C | S | . | . | S | Bend | trans | -115.2 | 118.7 | -177.9 | 60.6 | 0 | 0 | 0 | 0 | 109.3 | L73 P74 I75 I76 | L73-T80 HydrophobicContact CD2-CG2 3.54Å; L73-T80 HydrophobicContact CG-CG2 3.98Å; P74-T80 PolarHBondContact O-OG1 3.31Å; I75-T80 WeakPolarHBondContact CA-OG1 3.19Å; I76-T80 PolarHBondContact N-OG1 3.18Å; I76-T80 PolarHBondContact O-N 3.16Å; I76-T80 PolarHBondContact O-OG1 3.41Å |
| 81 | S | 69.6 | Low | 69.3 | Low | 87 Ų | 87 | 95.7 Ų | 95.7 | 61% | 0.608 | 53% | 0.531 | S | S | * | . | trans | -78.8 | 141.4 | -175.8 | -43.5 | 0 | 0 | 0 | 0 | 112.6 | N83 | S81-N83 VanDerWaalsContact C-N 3.25Å; S81-N83 PolarHBondContact O-N 2.81Å | ||
| 82 | L | 62 | Low | 68 | Low | 106 Ų | 106 | 98.4 Ų | 98.4 | 56% | 0.555 | 53% | 0.532 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.2 | -23.6 | 178.9 | -168.2 | 69.5 | 0 | 0 | 0 | 114.2 | I75 V84 L85 | I75-L82 HydrophobicContact CD1-CD1 3.79Å; L82-V84 PolarHBondContact O-N 3.5Å; L82-L85 HydrophobicContact CD1-CD1 3.42Å; L82-L85 VanDerWaalsContact CD1-CD1 3.42Å; L82-L85 HydrophobicContact CD1-CG 4.27Å; L82-L85 HydrophobicContact CG-CD1 4.46Å; L82-L85 PolarHBondContact O-N 3.1Å |
| 83 | N | 57.2 | Low | 66.6 | Low | 141 Ų | 141 | 94.7 Ų | 94.7 | 75% | 0.754 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -57.8 | -13.8 | -178.8 | -68.9 | -0.6 | 0 | 0 | 0 | 113.9 | S81 | S81-N83 VanDerWaalsContact C-N 3.25Å; S81-N83 PolarHBondContact O-N 2.81Å |
| 84 | V | 56.6 | Low | 65.1 | Low | 38 Ų | 38 | 97.7 Ų | 97.7 | 23% | 0.23 | 55% | 0.547 | C | S | . | . | H | α-helix | trans | -70.9 | -36.1 | 175.2 | 160 | 0 | 0 | 0 | 0 | 113.4 | P69 L82 T86 E87 N88 | P69-V84 HydrophobicContact CB-CB 3.81Å; P69-V84 HydrophobicContact CB-CG1 3.15Å; P69-V84 HydrophobicContact CB-CG2 3.64Å; P69-V84 HydrophobicContact CG-CB 4.04Å; P69-V84 HydrophobicContact CG-CG1 3.83Å; P69-V84 HydrophobicContact CG-CG2 3.8Å; L82-V84 PolarHBondContact O-N 3.5Å; V84-T86 PolarHBondContact O-N 2.93Å; V84-E87 PolarHBondContact O-N 3.28Å; V84-N88 VanDerWaalsContact CG1-ND2 3.32Å; V84-N88 WeakPolarHBondContact CG1-ND2 3.23Å; V84-N88 PolarHBondContact O-N 3.37Å; V84-N88 PolarHBondContact O-ND2 3.12Å; V84-N88 PolarHBondContact O-OD1 3.23Å |
| 85 | L | 55.6 | Low | 63.6 | Low | 75 Ų | 75 | 99.6 Ų | 99.6 | 39% | 0.393 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -70.6 | -29.3 | -171.7 | -64.2 | 178.4 | 0 | 0 | 0 | 113.7 | I75 L82 E87 | I75-L85 HydrophobicContact CD1-CD1 3.76Å; I75-L85 HydrophobicContact CG1-CD1 4.39Å; L82-L85 HydrophobicContact CD1-CD1 3.42Å; L82-L85 VanDerWaalsContact CD1-CD1 3.42Å; L82-L85 HydrophobicContact CD1-CG 4.27Å; L82-L85 HydrophobicContact CG-CD1 4.46Å; L82-L85 PolarHBondContact O-N 3.1Å; L85-E87 VanDerWaalsContact C-N 3.35Å |
| 86 | T | 53.5 | Low | 61.7 | Low | 95 Ų | 95 | 102.2 Ų | 102.2 | 58% | 0.583 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -69.9 | -34.2 | -179.4 | -48.4 | 0 | 0 | 0 | 0 | 111.7 | V84 | V84-T86 PolarHBondContact O-N 2.93Å |
| 87 | E | 55.9 | Low | 60.1 | Low | 86 Ų | 86 | 105.1 Ų | 105.1 | 40% | 0.402 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -80.8 | -33.2 | 178 | -68.9 | -65.1 | 113.8 | 0 | 0 | 112.2 | V84 L85 R89 R90 N91 | V84-E87 PolarHBondContact O-N 3.28Å; L85-E87 VanDerWaalsContact C-N 3.35Å; E87-R89 VanDerWaalsContact C-N 3.25Å; E87-R89 PolarHBondContact O-N 3.24Å; E87-R90 PolarHBondContact O-N 3.26Å; E87-R90 VanDerWaalsContact O-N 3.12Å; E87-R90 IonicContact OE1-NH1 3.03Å; E87-R90 PolarHBondContact OE1-NH1 3.28Å; E87-N91 PolarHBondContact O-OD1 3.36Å |
| 88 | N | 52.8 | Low | 58.1 | Low | 19 Ų | 19 | 106.9 Ų | 106.9 | 10% | 0.102 | 57% | 0.573 | C | S | . | * | H | α-helix | trans | -58.3 | -35.5 | 177.6 | -70.5 | -16.5 | 0 | 0 | 0 | 113.1 | V84 R90 N91 E92 | V84-N88 VanDerWaalsContact CG1-ND2 3.32Å; V84-N88 WeakPolarHBondContact CG1-ND2 3.23Å; V84-N88 PolarHBondContact O-N 3.37Å; V84-N88 PolarHBondContact O-ND2 3.12Å; V84-N88 PolarHBondContact O-OD1 3.23Å; N88-R90 PolarHBondContact O-N 3.19Å; N88-N91 PolarHBondContact O-N 3.22Å; N88-N91 VanDerWaalsContact O-N 3.12Å; N88-E92 WeakPolarHBondContact O-CG 3.31Å; N88-E92 PolarHBondContact O-N 3.12Å |
| 89 | R | 53.7 | Low | 56.2 | Low | 197 Ų | 197 | 108.3 Ų | 108.3 | 74% | 0.743 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -65.3 | -23 | -179.8 | -143.1 | -165.2 | -53.3 | -131 | 2.9 | 113.6 | E87 | E87-R89 VanDerWaalsContact C-N 3.25Å; E87-R89 PolarHBondContact O-N 3.24Å |
| 90 | R | 53.3 | Low | 54.2 | Low | 171 Ų | 171 | 111.3 Ų | 111.3 | 65% | 0.645 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -82.2 | -31.6 | 174.3 | -76.1 | -177.3 | 176.4 | 128.9 | -2.7 | 112.3 | E87 N88 | E87-R90 PolarHBondContact O-N 3.26Å; E87-R90 VanDerWaalsContact O-N 3.12Å; E87-R90 IonicContact OE1-NH1 3.03Å; E87-R90 PolarHBondContact OE1-NH1 3.28Å; N88-R90 PolarHBondContact O-N 3.19Å |
| 91 | N | 51.4 | Low | 52.5 | Low | 66 Ų | 66 | 116.8 Ų | 116.8 | 35% | 0.353 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -84.6 | -26.9 | -171 | -59.8 | 8.7 | 0 | 0 | 0 | 112.1 | E87 N88 A93 N94 | E87-N91 PolarHBondContact O-OD1 3.36Å; N88-N91 PolarHBondContact O-N 3.22Å; N88-N91 VanDerWaalsContact O-N 3.12Å; N91-A93 PolarHBondContact O-N 3.24Å; N91-N94 PolarHBondContact O-N 3.15Å |
| 92 | E | 54.3 | Low | 51.3 | Low | 122 Ų | 122 | 117.3 Ų | 117.3 | 57% | 0.57 | 60% | 0.604 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.5 | -26.6 | 173.5 | -73.1 | 174 | -177.7 | 0 | 0 | 113.1 | N88 N94 | N88-E92 WeakPolarHBondContact O-CG 3.31Å; N88-E92 PolarHBondContact O-N 3.12Å; E92-N94 VanDerWaalsContact C-N 3.27Å; E92-N94 PolarHBondContact O-N 3.14Å |
| 93 | A | 50.3 | Low | 50.2 | Low | 92 Ų | 92 | 121 Ų | 121 | 76% | 0.76 | 62% | 0.618 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.1 | -15.1 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.9 | N91 | N91-A93 PolarHBondContact O-N 3.24Š|
| 94 | N | 50.2 | Low | 49.2 | Very low | 143 Ų | 143 | 117.5 Ų | 117.5 | 77% | 0.765 | 62% | 0.615 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -111.1 | -6.8 | -171.1 | -149.7 | 21.2 | 0 | 0 | 0 | 114.4 | N91 E92 | N91-N94 PolarHBondContact O-N 3.15Å; E92-N94 VanDerWaalsContact C-N 3.27Å; E92-N94 PolarHBondContact O-N 3.14Å |
| 95 | N | 52 | Low | 48.3 | Very low | 123 Ų | 123 | 125.7 Ų | 125.7 | 66% | 0.658 | 65% | 0.648 | S | S | * | * | trans | -118.3 | 71.7 | -179.9 | -86.1 | -30.3 | 0 | 0 | 0 | 111.5 | I97 | N95-I97 PolarHBondContact O-N 3.28Š| ||
| 96 | H | 45.3 | Very low | 47.6 | Very low | 155 Ų | 155 | 129 Ų | 129 | 72% | 0.718 | 67% | 0.671 | S | S | * | * | trans | -76.3 | 77.7 | 163 | -173.6 | 73.3 | 0 | 0 | 0 | 109.7 | ||||
| 97 | I | 53.6 | Low | 46.8 | Very low | 142 Ų | 142 | 129 Ų | 129 | 73% | 0.728 | 68% | 0.681 | S | S | * | * | trans | -84.9 | 113 | 164.6 | -57.5 | -175.6 | 0 | 0 | 0 | 106.8 | N95 | N95-I97 PolarHBondContact O-N 3.28Š| ||
| 98 | K | 42 | Very low | 46.1 | Very low | 157 Ų | 157 | 131.4 Ų | 131.4 | 68% | 0.683 | 70% | 0.702 | S | S | * | * | trans | -63.2 | 132.7 | 175.9 | -61.8 | -159 | 179.9 | -148.4 | 0 | 109.8 | H100 | K98-H100 PolarHBondContact O-N 3.41Š| ||
| 99 | P | 42.8 | Very low | 45.7 | Very low | 123 Ų | 123 | 133.9 Ų | 133.9 | 80% | 0.799 | 73% | 0.731 | S | S | * | * | trans | -68.9 | 122.1 | 174.6 | 26.5 | -31.6 | 0 | 0 | 0 | 110.1 | N101 | P99-N101 PolarHBondContact O-N 3.38Š| ||
| 100 | H | 43.6 | Very low | 45.5 | Very low | 169 Ų | 169 | 131.8 Ų | 131.8 | 78% | 0.782 | 73% | 0.73 | S | S | * | * | trans | -76.6 | 101.3 | 169.4 | -173.3 | -85.4 | 0 | 0 | 0 | 108.5 | K98 S102 | K98-H100 PolarHBondContact O-N 3.41Å; H100-S102 PolarHBondContact O-N 3.02Å | ||
| 101 | N | 46.2 | Very low | 45.3 | Very low | 146 Ų | 146 | 131.2 Ų | 131.2 | 78% | 0.781 | 74% | 0.74 | S | S | * | * | trans | -66.9 | 114 | 167.1 | -111.1 | 2.6 | 0 | 0 | 0 | 108.8 | P99 | P99-N101 PolarHBondContact O-N 3.38Š| ||
| 102 | S | 45.7 | Very low | 46.1 | Very low | 98 Ų | 98 | 132.7 Ų | 132.7 | 69% | 0.685 | 76% | 0.761 | S | S | * | * | trans | -124.5 | 108.1 | 158.6 | 56.4 | 0 | 0 | 0 | 0 | 110 | H100 | H100-S102 PolarHBondContact O-N 3.02Š| ||
| 103 | H | 39 | Very low | 46.8 | Very low | 184 Ų | 184 | 134.9 Ų | 134.9 | 85% | 0.852 | 77% | 0.772 | S | S | * | * | trans | -53.3 | 132 | 175.4 | -86.5 | -71.1 | 0 | 0 | 0 | 114.2 | ||||
| 104 | G | 35.9 | Very low | 47.2 | Very low | 66 Ų | 66 | 139.2 Ų | 139.2 | 68% | 0.68 | 77% | 0.774 | S | S | * | * | 66.2 | 115.9 | 124.2 | 0 | 0 | 0 | 0 | 0 | 120.2 | |||||
| 105 | K | 36.7 | Very low | 47.8 | Very low | 211 Ų | 211 | 140.8 Ų | 140.8 | 92% | 0.917 | 78% | 0.776 | S | S | * | * | -174.8 | 134 | 107.1 | -96.9 | 167.4 | -175.7 | -179.6 | 0 | 111.1 | |||||
| 106 | T | 41.9 | Very low | 48.6 | Very low | 143 Ų | 143 | 142.7 Ų | 142.7 | 88% | 0.877 | 78% | 0.783 | S | S | * | * | trans | -65.9 | 137.3 | 172.1 | 47.3 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 107 | A | 35.9 | Very low | 49.8 | Very low | 97 Ų | 97 | 142.2 Ų | 142.2 | 80% | 0.802 | 79% | 0.786 | S | S | * | * | trans | -153 | 114.6 | 151.6 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 108 | T | 42.7 | Very low | 50.2 | Low | 136 Ų | 136 | 146.4 Ų | 146.4 | 83% | 0.834 | 81% | 0.808 | S | S | * | * | trans | -46.5 | 141.5 | 159.8 | -0.2 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 109 | G | 43.9 | Very low | 50.6 | Low | 70 Ų | 70 | 145.9 Ų | 145.9 | 72% | 0.722 | 81% | 0.814 | S | S | * | * | trans | 179.9 | 71.9 | -178.5 | 0 | 0 | 0 | 0 | 0 | 109.2 | D111 | G109-D111 PolarHBondContact O-N 3.4Š| ||
| 110 | E | 48.3 | Very low | 51 | Low | 153 Ų | 153 | 147.1 Ų | 147.1 | 72% | 0.715 | 82% | 0.815 | S | S | * | * | trans | -51 | 110.9 | 166 | 37.3 | -90.8 | 100.3 | 0 | 0 | 112.1 | ||||
| 111 | D | 50.4 | Low | 51.4 | Low | 159 Ų | 159 | 145.9 Ų | 145.9 | 85% | 0.85 | 82% | 0.816 | S | S | * | * | trans | -161.4 | 106.2 | 147.7 | -83.3 | -39.1 | 0 | 0 | 0 | 107.1 | G109 Q113 | G109-D111 PolarHBondContact O-N 3.4Å; D111-Q113 PolarHBondContact O-N 3.28Å; D111-Q113 VanDerWaalsContact O-N 3.14Å | ||
| 112 | A | 68.4 | Low | 51.7 | Low | 98 Ų | 98 | 145.9 Ų | 145.9 | 81% | 0.81 | 82% | 0.818 | S | S | * | * | trans | -61.3 | 117.1 | -177.5 | 0 | 0 | 0 | 0 | 0 | 109.9 | F114 | A112-F114 PolarHBondContact O-N 2.9Å; A112-F114 VanDerWaalsContact O-N 3.08Å | ||
| 113 | Q | 67.9 | Low | 52.1 | Low | 168 Ų | 168 | 148.9 Ų | 148.9 | 79% | 0.785 | 83% | 0.827 | S | S | * | * | S | Bend | trans | -64.6 | -18.8 | -165.1 | -170.8 | 168.9 | -19.8 | 0 | 0 | 114.5 | D111 | D111-Q113 PolarHBondContact O-N 3.28Å; D111-Q113 VanDerWaalsContact O-N 3.14Å |
| 114 | F | 59.7 | Low | 53 | Low | 183 Ų | 183 | 146.5 Ų | 146.5 | 80% | 0.803 | 83% | 0.825 | S | S | * | * | trans | -157.5 | 124.7 | 164.5 | -65.1 | -74.6 | 0 | 0 | 0 | 110.3 | A112 | A112-F114 PolarHBondContact O-N 2.9Å; A112-F114 VanDerWaalsContact O-N 3.08Å | ||
| 115 | E | 62.3 | Low | 54.2 | Low | 175 Ų | 175 | 152.3 Ų | 152.3 | 82% | 0.818 | 84% | 0.835 | S | S | * | * | trans | -76.8 | 124.2 | 166.2 | -170.8 | 170.3 | -172.4 | 0 | 0 | 108.4 | ||||
| 116 | M | 69.4 | Low | 55.6 | Low | 163 Ų | 163 | 147.8 Ų | 147.8 | 80% | 0.803 | 83% | 0.829 | S | S | * | * | trans | -92.7 | 104.1 | 174.5 | 179.3 | 77 | 70.3 | 0 | 0 | 107.3 | I118 | M116-I118 HydrophobicContact CG-CG2 4.26Å; M116-I118 PolarHBondContact O-N 3.03Å | ||
| 117 | D | 68.8 | Low | 56.7 | Low | 146 Ų | 146 | 148.2 Ų | 148.2 | 78% | 0.781 | 83% | 0.825 | S | S | * | * | trans | -62.8 | 120.9 | 169.8 | -66.7 | -38.5 | 0 | 0 | 0 | 108.9 | ||||
| 118 | I | 62.6 | Low | 58.6 | Low | 230 Ų | 230 | 152.8 Ų | 152.8 | 100% | 1.179 | 83% | 0.827 | S | S | * | * | trans | -112.2 | 0 | 170 | 54.6 | 165.8 | 0 | 0 | 0 | 110.9 | M116 | M116-I118 HydrophobicContact CG-CG2 4.26Å; M116-I118 PolarHBondContact O-N 3.03Å |
Retrieved 118 of 118 residues in 220.2 ms
(Link to these results)