| 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 | 46.5 | Very low | 82.7 | Confident | 244 Ų | 244 | 125.3 Ų | 125.3 | 100% | 1.202 | 65% | 0.653 | S | S | * | * | 0 | 82.3 | 0 | -68.7 | -177.4 | 171.8 | 0 | 0 | 108 | G3 | M1-G3 PolarHBondContact O-N 3.1Š| |||
| 2 | T | 62.8 | Low | 83.8 | Confident | 148 Ų | 148 | 119.8 Ų | 119.8 | 91% | 0.908 | 63% | 0.625 | S | S | * | * | trans | -78 | 106.9 | 179.4 | 43.1 | 0 | 0 | 0 | 0 | 108 | ||||
| 3 | G | 79.1 | Confident | 84.6 | Confident | 63 Ų | 63 | 118.6 Ų | 118.6 | 65% | 0.649 | 61% | 0.614 | S | S | * | * | trans | -72.4 | 175.2 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | M1 | M1-G3 PolarHBondContact O-N 3.1Š| ||
| 4 | Y | 82.9 | Confident | 85.4 | Confident | 152 Ų | 152 | 117.6 Ų | 117.6 | 60% | 0.596 | 61% | 0.605 | S | S | * | * | trans | -48.6 | 137.4 | -178.7 | -61.5 | -77 | 0 | 0 | 0 | 113.8 | E8 K9 L12 | Y4-E8 WeakPolarHBondContact CA-OE2 3.44Å; Y4-E8 HydrophobicContact CD1-CB 4.29Å; Y4-K9 WeakPolarHBondContact O-CE 3.3Å; Y4-L12 HydrophobicContact CD1-CD1 3.8Å; Y4-L12 HydrophobicContact CE1-CD1 3.74Å; Y4-L12 HydrophobicContact CG-CD1 4.23Å | ||
| 5 | T | 90.1 | Very high | 86.2 | Confident | 66 Ų | 66 | 116.1 Ų | 116.1 | 41% | 0.405 | 60% | 0.598 | S | S | . | * | trans | -67.8 | 159.4 | 172 | 66.2 | 0 | 0 | 0 | 0 | 110.9 | D7 E8 K9 | T5-D7 VanDerWaalsContact C-N 3.27Å; T5-D7 PolarHBondContact O-N 3.32Å; T5-E8 PolarHBondContact N-OE2 3.05Å; T5-E8 PolarHBondContact O-N 3.44Å; T5-E8 WeakPolarHBondContact OG1-CB 3.39Å; T5-E8 WeakPolarHBondContact OG1-CG 3.3Å; T5-E8 PolarHBondContact OG1-N 3.29Å; T5-E8 PolarHBondContact OG1-OE1 3.43Å; T5-E8 PolarHBondContact OG1-OE2 2.86Å; T5-K9 WeakPolarHBondContact O-CG 3.47Å; T5-K9 PolarHBondContact O-N 3.03Å | ||
| 6 | P | 88.4 | Confident | 86.7 | Confident | 104 Ų | 104 | 119.1 Ų | 119.1 | 68% | 0.675 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -55.6 | -39.6 | 179.6 | -26.9 | 36 | 0 | 0 | 0 | 113.6 | K9 L10 | P6-K9 PolarHBondContact O-N 2.93Å; P6-L10 PolarHBondContact O-N 2.87Å |
| 7 | D | 89.6 | Confident | 87.3 | Confident | 126 Ų | 126 | 117.3 Ų | 117.3 | 67% | 0.674 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -70.9 | -37.2 | 179 | -64.9 | -33.7 | 0 | 0 | 0 | 112.3 | T5 K9 L10 R11 | T5-D7 VanDerWaalsContact C-N 3.27Å; T5-D7 PolarHBondContact O-N 3.32Å; D7-K9 VanDerWaalsContact C-N 3.32Å; D7-L10 PolarHBondContact O-N 3.38Å; D7-R11 WeakPolarHBondContact O-CB 3.46Å; D7-R11 PolarHBondContact O-N 2.76Å |
| 8 | E | 91.4 | Very high | 87.8 | Confident | 88 Ų | 88 | 116.8 Ų | 116.8 | 41% | 0.411 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -63.9 | -39.9 | 172.9 | -74.2 | 163.7 | -170.6 | 0 | 0 | 111.4 | Y4 T5 R11 L12 | Y4-E8 WeakPolarHBondContact CA-OE2 3.44Å; Y4-E8 HydrophobicContact CD1-CB 4.29Å; T5-E8 PolarHBondContact N-OE2 3.05Å; T5-E8 PolarHBondContact O-N 3.44Å; T5-E8 WeakPolarHBondContact OG1-CB 3.39Å; T5-E8 WeakPolarHBondContact OG1-CG 3.3Å; T5-E8 PolarHBondContact OG1-N 3.29Å; T5-E8 PolarHBondContact OG1-OE1 3.43Å; T5-E8 PolarHBondContact OG1-OE2 2.86Å; E8-R11 PolarHBondContact O-N 3.25Å; E8-L12 VanDerWaalsContact O-CB 3.32Å; E8-L12 WeakPolarHBondContact O-CB 3.19Å; E8-L12 WeakPolarHBondContact O-CG 3.28Å; E8-L12 PolarHBondContact O-N 3.34Å |
| 9 | K | 91.8 | Very high | 88.1 | Confident | 125 Ų | 125 | 118.3 Ų | 118.3 | 54% | 0.543 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -64 | -43.9 | 175.3 | -71.2 | 175.1 | 178.6 | 170.2 | 0 | 111.4 | Y4 T5 P6 D7 L12 Q13 | Y4-K9 WeakPolarHBondContact O-CE 3.3Å; T5-K9 WeakPolarHBondContact O-CG 3.47Å; T5-K9 PolarHBondContact O-N 3.03Å; P6-K9 PolarHBondContact O-N 2.93Å; D7-K9 VanDerWaalsContact C-N 3.32Å; K9-L12 PolarHBondContact O-N 3.36Å; K9-Q13 WeakPolarHBondContact O-CB 3.45Å; K9-Q13 PolarHBondContact O-N 3.33Å |
| 10 | L | 93.9 | Very high | 88.4 | Confident | 89 Ų | 89 | 121.8 Ų | 121.8 | 47% | 0.466 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -62.4 | -45.5 | 177.1 | -178.1 | 63.5 | 0 | 0 | 0 | 111.1 | P6 D7 L12 Q13 Q14 | P6-L10 PolarHBondContact O-N 2.87Å; D7-L10 PolarHBondContact O-N 3.38Å; L10-L12 PolarHBondContact O-N 2.75Å; L10-Q13 WeakPolarHBondContact O-CB 3.43Å; L10-Q13 PolarHBondContact O-N 3.33Å; L10-Q14 WeakPolarHBondContact O-CG 3.33Å; L10-Q14 PolarHBondContact O-N 3.32Å |
| 11 | R | 93.8 | Very high | 88.6 | Confident | 173 Ų | 173 | 123.9 Ų | 123.9 | 65% | 0.653 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -62.5 | -43 | 176.8 | -173.2 | -179.5 | -179.4 | 97.5 | 0 | 112.1 | D7 E8 Q13 Q14 L15 | D7-R11 WeakPolarHBondContact O-CB 3.46Å; D7-R11 PolarHBondContact O-N 2.76Å; E8-R11 PolarHBondContact O-N 3.25Å; R11-Q13 VanDerWaalsContact C-N 3.32Å; R11-Q13 PolarHBondContact O-N 2.96Å; R11-Q14 PolarHBondContact O-N 3.05Å; R11-L15 HydrophobicContact CG-CD1 4.27Å; R11-L15 WeakPolarHBondContact O-CB 3.33Å; R11-L15 WeakPolarHBondContact O-CG 3.49Å; R11-L15 PolarHBondContact O-N 3.42Å |
| 12 | L | 95 | Very high | 90.7 | Very high | 60 Ų | 60 | 119.4 Ų | 119.4 | 31% | 0.314 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -65.4 | -36.3 | 176.9 | -74.9 | 171.4 | 0 | 0 | 0 | 112 | Y4 E8 K9 L10 R16 | Y4-L12 HydrophobicContact CD1-CD1 3.8Å; Y4-L12 HydrophobicContact CE1-CD1 3.74Å; Y4-L12 HydrophobicContact CG-CD1 4.23Å; E8-L12 VanDerWaalsContact O-CB 3.32Å; E8-L12 WeakPolarHBondContact O-CB 3.19Å; E8-L12 WeakPolarHBondContact O-CG 3.28Å; E8-L12 PolarHBondContact O-N 3.34Å; K9-L12 PolarHBondContact O-N 3.36Å; L10-L12 PolarHBondContact O-N 2.75Å; L12-R16 WeakPolarHBondContact O-CB 3.21Å; L12-R16 VanDerWaalsContact O-CG 3.32Å; L12-R16 WeakPolarHBondContact O-CG 3.18Å; L12-R16 PolarHBondContact O-N 3.18Å |
| 13 | Q | 95 | Very high | 91.9 | Very high | 104 Ų | 104 | 116.4 Ų | 116.4 | 49% | 0.486 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -64.6 | -48.2 | 174.1 | -176.8 | -179.8 | -16.4 | 0 | 0 | 111.1 | K9 L10 R11 L15 R16 E17 | K9-Q13 WeakPolarHBondContact O-CB 3.45Å; K9-Q13 PolarHBondContact O-N 3.33Å; L10-Q13 WeakPolarHBondContact O-CB 3.43Å; L10-Q13 PolarHBondContact O-N 3.33Å; R11-Q13 VanDerWaalsContact C-N 3.32Å; R11-Q13 PolarHBondContact O-N 2.96Å; Q13-L15 VanDerWaalsContact C-N 3.34Å; Q13-L15 PolarHBondContact O-N 3.29Å; Q13-R16 WeakPolarHBondContact O-CB 3.42Å; Q13-R16 PolarHBondContact O-N 2.93Å; Q13-R16 VanDerWaalsContact O-N 3.15Å; Q13-E17 PolarHBondContact NE2-OE1 3.25Å; Q13-E17 PolarHBondContact O-N 3.37Å |
| 14 | Q | 95.6 | Very high | 92.3 | Very high | 105 Ų | 105 | 120.3 Ų | 120.3 | 49% | 0.491 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -58.1 | -45.5 | 176.7 | -71.5 | 172.6 | -7.5 | 0 | 0 | 111.6 | L10 R11 R16 E17 L18 | L10-Q14 WeakPolarHBondContact O-CG 3.33Å; L10-Q14 PolarHBondContact O-N 3.32Å; R11-Q14 PolarHBondContact O-N 3.05Å; Q14-R16 PolarHBondContact O-N 3.25Å; Q14-E17 PolarHBondContact O-N 2.73Å; Q14-L18 WeakPolarHBondContact O-CG 3.46Å; Q14-L18 PolarHBondContact O-N 3.37Å |
| 15 | L | 96.6 | Very high | 92.5 | Very high | 94 Ų | 94 | 118.8 Ų | 118.8 | 49% | 0.492 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -64.7 | -37.7 | 176.8 | -72.3 | 172.4 | 0 | 0 | 0 | 112.4 | R11 Q13 R19 | R11-L15 HydrophobicContact CG-CD1 4.27Å; R11-L15 WeakPolarHBondContact O-CB 3.33Å; R11-L15 WeakPolarHBondContact O-CG 3.49Å; R11-L15 PolarHBondContact O-N 3.42Å; Q13-L15 VanDerWaalsContact C-N 3.34Å; Q13-L15 PolarHBondContact O-N 3.29Å; L15-R19 VanDerWaalsContact O-CB 3.23Å; L15-R19 WeakPolarHBondContact O-CB 3.3Å; L15-R19 PolarHBondContact O-N 3.13Å |
| 16 | R | 95.6 | Very high | 92 | Very high | 165 Ų | 165 | 121.2 Ų | 121.2 | 62% | 0.623 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -64.4 | -41.3 | 174.8 | -83.3 | 177.6 | -174.7 | 161.1 | 2.8 | 112.2 | L12 Q13 Q14 R19 R20 | L12-R16 WeakPolarHBondContact O-CB 3.21Å; L12-R16 VanDerWaalsContact O-CG 3.32Å; L12-R16 WeakPolarHBondContact O-CG 3.18Å; L12-R16 PolarHBondContact O-N 3.18Å; Q13-R16 WeakPolarHBondContact O-CB 3.42Å; Q13-R16 PolarHBondContact O-N 2.93Å; Q13-R16 VanDerWaalsContact O-N 3.15Å; Q14-R16 PolarHBondContact O-N 3.25Å; R16-R19 PolarHBondContact O-N 2.92Å; R16-R20 WeakPolarHBondContact O-CB 3.33Å; R16-R20 WeakPolarHBondContact O-CG 3.1Å; R16-R20 PolarHBondContact O-N 3.19Å |
| 17 | E | 95.6 | Very high | 91.5 | Very high | 88 Ų | 88 | 123.6 Ų | 123.6 | 41% | 0.411 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -64.7 | -45.7 | 178.4 | -74.8 | 178.1 | -165.6 | 0 | 0 | 111.6 | Q13 Q14 R19 R20 R21 | Q13-E17 PolarHBondContact NE2-OE1 3.25Å; Q13-E17 PolarHBondContact O-N 3.37Å; Q14-E17 PolarHBondContact O-N 2.73Å; E17-R19 VanDerWaalsContact C-N 3.33Å; E17-R19 PolarHBondContact O-N 3.2Å; E17-R20 PolarHBondContact O-N 3.34Å; E17-R21 PolarHBondContact O-N 3.3Å; E17-R21 VanDerWaalsContact O-N 3.12Å |
| 18 | L | 96 | Very high | 90.4 | Very high | 109 Ų | 109 | 124.3 Ų | 124.3 | 57% | 0.571 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -61 | -43.2 | 173.9 | -68.5 | 173.8 | 0 | 0 | 0 | 111.5 | Q14 R20 R21 W22 | Q14-L18 WeakPolarHBondContact O-CG 3.46Å; Q14-L18 PolarHBondContact O-N 3.37Å; L18-R20 PolarHBondContact O-N 2.86Å; L18-R21 PolarHBondContact O-N 2.75Å; L18-W22 WeakPolarHBondContact O-CB 3.32Å; L18-W22 PolarHBondContact O-N 3.18Å |
| 19 | R | 94.6 | Very high | 89.3 | Confident | 145 Ų | 145 | 123.2 Ų | 123.2 | 55% | 0.547 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -64.1 | -39.5 | 179.1 | -175.4 | 58.7 | 175.3 | 176.4 | 1.1 | 112.3 | L15 R16 E17 L23 | L15-R19 VanDerWaalsContact O-CB 3.23Å; L15-R19 WeakPolarHBondContact O-CB 3.3Å; L15-R19 PolarHBondContact O-N 3.13Å; R16-R19 PolarHBondContact O-N 2.92Å; E17-R19 VanDerWaalsContact C-N 3.33Å; E17-R19 PolarHBondContact O-N 3.2Å; R19-L23 HydrophobicContact CG-CD1 4.01Å; R19-L23 HydrophobicContact CG-CG 4.45Å; R19-L23 WeakPolarHBondContact O-CB 3.48Å; R19-L23 VanDerWaalsContact O-CG 3.23Å; R19-L23 WeakPolarHBondContact O-CG 3.38Å; R19-L23 PolarHBondContact O-N 2.91Å |
| 20 | R | 93.5 | Very high | 88 | Confident | 188 Ų | 188 | 123.3 Ų | 123.3 | 71% | 0.709 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -65.2 | -42.6 | 177 | -76.9 | 176.1 | 178.5 | -177.4 | -0.7 | 112 | R16 E17 L18 K24 | R16-R20 WeakPolarHBondContact O-CB 3.33Å; R16-R20 WeakPolarHBondContact O-CG 3.1Å; R16-R20 PolarHBondContact O-N 3.19Å; E17-R20 PolarHBondContact O-N 3.34Å; L18-R20 PolarHBondContact O-N 2.86Å; R20-K24 WeakPolarHBondContact O-CB 3.44Å; R20-K24 PolarHBondContact O-N 3.38Å |
| 21 | R | 92.9 | Very high | 86.5 | Confident | 166 Ų | 166 | 129.2 Ų | 129.2 | 63% | 0.626 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -64.2 | -47.3 | 175.7 | -71.4 | 177.8 | -176.9 | 170.7 | 3.4 | 111.2 | E17 L18 L23 K24 D25 | E17-R21 PolarHBondContact O-N 3.3Å; E17-R21 VanDerWaalsContact O-N 3.12Å; L18-R21 PolarHBondContact O-N 2.75Å; R21-L23 PolarHBondContact O-N 2.86Å; R21-K24 WeakPolarHBondContact O-CB 3.2Å; R21-K24 PolarHBondContact O-N 3.26Å; R21-K24 VanDerWaalsContact O-N 3.14Å; R21-D25 PolarHBondContact O-N 3.36Å |
| 22 | W | 90.6 | Very high | 85.1 | Confident | 150 Ų | 150 | 127.4 Ų | 127.4 | 57% | 0.568 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -57.6 | -45.6 | 176.3 | -179.1 | -92.1 | 0 | 0 | 0 | 112.8 | L18 K24 D25 Q26 | L18-W22 WeakPolarHBondContact O-CB 3.32Å; L18-W22 PolarHBondContact O-N 3.18Å; W22-K24 VanDerWaalsContact C-N 3.31Å; W22-K24 PolarHBondContact O-N 2.92Å; W22-D25 PolarHBondContact O-N 3.41Å; W22-Q26 WeakPolarHBondContact O-CG 3.23Å; W22-Q26 PolarHBondContact O-N 3.25Å; W22-Q26 VanDerWaalsContact O-N 3.14Å |
| 23 | L | 88.8 | Confident | 83.4 | Confident | 85 Ų | 85 | 130.8 Ų | 130.8 | 45% | 0.445 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -64.5 | -36.2 | 178.2 | -74.2 | 170.2 | 0 | 0 | 0 | 112.3 | R19 R21 D25 Q26 E27 | R19-L23 HydrophobicContact CG-CD1 4.01Å; R19-L23 HydrophobicContact CG-CG 4.45Å; R19-L23 WeakPolarHBondContact O-CB 3.48Å; R19-L23 VanDerWaalsContact O-CG 3.23Å; R19-L23 WeakPolarHBondContact O-CG 3.38Å; R19-L23 PolarHBondContact O-N 2.91Å; R21-L23 PolarHBondContact O-N 2.86Å; L23-D25 VanDerWaalsContact C-N 3.35Å; L23-Q26 WeakPolarHBondContact O-CB 3.16Å; L23-Q26 PolarHBondContact O-N 3.33Å; L23-E27 PolarHBondContact O-N 2.97Å |
| 24 | K | 87.1 | Confident | 81.9 | Confident | 145 Ų | 145 | 130.9 Ų | 130.9 | 63% | 0.63 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -65.8 | -38.3 | 174.2 | -173.1 | 178 | -179.8 | -179.4 | 0 | 111.8 | R20 R21 W22 Q26 E27 | R20-K24 WeakPolarHBondContact O-CB 3.44Å; R20-K24 PolarHBondContact O-N 3.38Å; R21-K24 WeakPolarHBondContact O-CB 3.2Å; R21-K24 PolarHBondContact O-N 3.26Å; R21-K24 VanDerWaalsContact O-N 3.14Å; W22-K24 VanDerWaalsContact C-N 3.31Å; W22-K24 PolarHBondContact O-N 2.92Å; K24-Q26 PolarHBondContact O-N 3.43Å; K24-E27 WeakPolarHBondContact O-CB 3.38Å; K24-E27 PolarHBondContact O-N 3.42Å; K24-E27 VanDerWaalsContact O-N 3.1Å |
| 25 | D | 86.1 | Confident | 80.9 | Confident | 120 Ų | 120 | 132.9 Ų | 132.9 | 64% | 0.642 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -71.5 | -14.6 | 176.1 | -63.8 | -22.2 | 0 | 0 | 0 | 112.8 | R21 W22 L23 | R21-D25 PolarHBondContact O-N 3.36Å; W22-D25 PolarHBondContact O-N 3.41Å; L23-D25 VanDerWaalsContact C-N 3.35Å |
| 26 | Q | 80.2 | Confident | 79.8 | Confident | 117 Ų | 117 | 133.8 Ų | 133.8 | 55% | 0.547 | 64% | 0.642 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -85 | -10.3 | 170.5 | -66.2 | -63.8 | -79 | 0 | 0 | 113.3 | W22 L23 K24 L28 | W22-Q26 WeakPolarHBondContact O-CG 3.23Å; W22-Q26 PolarHBondContact O-N 3.25Å; W22-Q26 VanDerWaalsContact O-N 3.14Å; L23-Q26 WeakPolarHBondContact O-CB 3.16Å; L23-Q26 PolarHBondContact O-N 3.33Å; K24-Q26 PolarHBondContact O-N 3.43Å; Q26-L28 VanDerWaalsContact C-N 3.31Å; Q26-L28 PolarHBondContact O-N 2.99Å |
| 27 | E | 77.8 | Confident | 78.8 | Confident | 153 Ų | 153 | 131.3 Ų | 131.3 | 72% | 0.715 | 65% | 0.647 | S | S | * | * | S | Bend | trans | -70 | 95 | 169.9 | -65.4 | -179.2 | 179.7 | 0 | 0 | 107.9 | L23 K24 S29 | L23-E27 PolarHBondContact O-N 2.97Å; K24-E27 WeakPolarHBondContact O-CB 3.38Å; K24-E27 PolarHBondContact O-N 3.42Å; K24-E27 VanDerWaalsContact O-N 3.1Å; E27-S29 PolarHBondContact O-N 3.3Å |
| 28 | L | 67.2 | Low | 77.9 | Confident | 142 Ų | 142 | 136 Ų | 136 | 74% | 0.743 | 67% | 0.669 | S | S | * | * | trans | -56.3 | 127.1 | 178.4 | -126.6 | 76.7 | 0 | 0 | 0 | 109.1 | Q26 | Q26-L28 VanDerWaalsContact C-N 3.31Å; Q26-L28 PolarHBondContact O-N 2.99Å | ||
| 29 | S | 68 | Low | 77.1 | Confident | 64 Ų | 64 | 140.1 Ų | 140.1 | 45% | 0.448 | 68% | 0.683 | S | S | . | * | trans | -57.7 | 147.1 | 164.7 | -171.7 | 0 | 0 | 0 | 0 | 108.3 | E27 R31 | E27-S29 PolarHBondContact O-N 3.3Å; S29-R31 CarbonylContact O-C 3.55Å; S29-R31 PolarHBondContact O-N 3.35Å | ||
| 30 | P | 64.4 | Low | 76.5 | Confident | 128 Ų | 128 | 137 Ų | 137 | 83% | 0.831 | 68% | 0.675 | S | S | * | * | S | Bend | trans | -54.9 | -8.7 | 174.1 | -25.7 | 34.3 | 0 | 0 | 0 | 114.6 | E32 | P30-E32 PolarHBondContact O-N 3.21Š|
| 31 | R | 63 | Low | 76.3 | Confident | 213 Ų | 213 | 129.7 Ų | 129.7 | 80% | 0.804 | 66% | 0.658 | S | S | * | * | trans | -75.6 | 77.6 | 170.4 | -65 | -173.1 | 175.7 | 113.4 | -1 | 110.1 | S29 | S29-R31 CarbonylContact O-C 3.55Å; S29-R31 PolarHBondContact O-N 3.35Å | ||
| 32 | E | 63.1 | Low | 76.2 | Confident | 135 Ų | 135 | 127.5 Ų | 127.5 | 63% | 0.631 | 67% | 0.666 | S | S | * | * | trans | -55.9 | 138.5 | 153.1 | -68.4 | 178.6 | 169.5 | 0 | 0 | 108.6 | P30 V34 | P30-E32 PolarHBondContact O-N 3.21Å; E32-V34 HydrophobicContact CB-CG2 3.73Å; E32-V34 PolarHBondContact O-N 3.38Å | ||
| 33 | P | 60 | Low | 76.2 | Confident | 131 Ų | 131 | 126 Ų | 126 | 85% | 0.851 | 67% | 0.666 | S | S | * | * | trans | -69.4 | 77.2 | 157.3 | 30.6 | -31 | 0 | 0 | 0 | 106.7 | L35 | P33-L35 PolarHBondContact O-N 2.92Š| ||
| 34 | V | 64.3 | Low | 76.2 | Confident | 105 Ų | 105 | 126.8 Ų | 126.8 | 64% | 0.636 | 67% | 0.668 | S | S | * | * | P | Polyproline II helix | trans | -64.1 | 122.2 | 173.3 | -163.5 | 0 | 0 | 0 | 0 | 105.3 | E32 | E32-V34 HydrophobicContact CB-CG2 3.73Å; E32-V34 PolarHBondContact O-N 3.38Å |
| 35 | L | 73.8 | Confident | 76.3 | Confident | 147 Ų | 147 | 125.6 Ų | 125.6 | 77% | 0.77 | 66% | 0.662 | S | S | * | * | P | Polyproline II helix | trans | -48.2 | 139.5 | 166.2 | -68.6 | 173 | 0 | 0 | 0 | 107.5 | P33 P37 | P33-L35 PolarHBondContact O-N 2.92Å; L35-P37 VanDerWaalsContact O-N 3.14Å |
| 36 | P | 73.5 | Confident | 76.6 | Confident | 113 Ų | 113 | 125.2 Ų | 125.2 | 73% | 0.734 | 66% | 0.655 | S | S | * | * | P | Polyproline II helix | trans | -51.7 | 131.6 | 179.5 | 22.9 | -33 | 0 | 0 | 0 | 107.8 | Q38 | P36-Q38 PolarHBondContact O-N 3.41Š|
| 37 | P | 73.9 | Confident | 77 | Confident | 113 Ų | 113 | 125.3 Ų | 125.3 | 73% | 0.734 | 65% | 0.651 | S | S | * | * | P | Polyproline II helix | trans | -53.7 | 139.2 | -178.6 | 22 | -32.7 | 0 | 0 | 0 | 108.2 | L35 K39 | L35-P37 VanDerWaalsContact O-N 3.14Å; P37-K39 PolarHBondContact O-N 3.15Å; P37-K39 VanDerWaalsContact O-N 3.13Å |
| 38 | Q | 78.1 | Confident | 77.4 | Confident | 187 Ų | 187 | 121.7 Ų | 121.7 | 87% | 0.874 | 64% | 0.636 | S | S | * | * | P | Polyproline II helix | trans | -50.6 | 126.6 | -178.8 | -169.7 | 169.2 | 27.8 | 0 | 0 | 109 | P36 M40 | P36-Q38 PolarHBondContact O-N 3.41Å; Q38-M40 PolarHBondContact O-N 2.95Å |
| 39 | K | 78.8 | Confident | 78.4 | Confident | 196 Ų | 196 | 122.2 Ų | 122.2 | 85% | 0.852 | 63% | 0.632 | S | S | * | * | trans | -64.5 | 100.8 | -175.6 | -73.4 | -177.1 | -179.2 | 178 | 0 | 108.7 | P37 G41 | P37-K39 PolarHBondContact O-N 3.15Å; P37-K39 VanDerWaalsContact O-N 3.13Å; K39-G41 PolarHBondContact O-N 3.26Å | ||
| 40 | M | 82.4 | Confident | 79.3 | Confident | 80 Ų | 80 | 121.1 Ų | 121.1 | 39% | 0.394 | 62% | 0.62 | S | S | . | * | trans | -56.9 | 136.3 | 169.8 | -70.3 | 178.6 | 148.9 | 0 | 0 | 109.7 | Q38 E44 K45 N48 | Q38-M40 PolarHBondContact O-N 2.95Å; M40-E44 HydrophobicContact CB-CB 4.25Å; M40-E44 HydrophobicContact CB-CG 4.29Å; M40-E44 HydrophobicContact CE-CG 4.18Å; M40-E44 HydrophobicContact CG-CG 4.22Å; M40-E44 HydrophobicContact SD-CG 4.29Å; M40-K45 HydrophobicContact CB-CG 3.75Å; M40-K45 WeakPolarHBondContact O-CE 3.48Å; M40-N48 WeakPolarHBondContact CE-ND2 3.49Å; M40-N48 PolarHBondContact SD-ND2 3.47Å | ||
| 41 | G | 89.1 | Confident | 80.2 | Confident | 34 Ų | 34 | 118.8 Ų | 118.8 | 35% | 0.351 | 60% | 0.6 | S | S | . | * | trans | -63 | 162 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | K39 M43 E44 K45 | K39-G41 PolarHBondContact O-N 3.26Å; G41-M43 PolarHBondContact O-N 3.48Å; G41-E44 PolarHBondContact O-N 2.89Å; G41-K45 PolarHBondContact O-N 2.94Å | ||
| 42 | P | 90.7 | Very high | 81.2 | Confident | 120 Ų | 120 | 115.5 Ų | 115.5 | 78% | 0.779 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -54 | -37.5 | 179.1 | -27.1 | 35.2 | 0 | 0 | 0 | 113.8 | F46 | P42-F46 WeakPolarHBondContact O-CB 3.43Å; P42-F46 PolarHBondContact O-N 3.44Å |
| 43 | M | 90.5 | Very high | 82 | Confident | 119 Ų | 119 | 114 Ų | 114 | 59% | 0.586 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -68.8 | -40.5 | 179.9 | -166.1 | 67 | -174.9 | 0 | 0 | 112.9 | G41 F46 W47 | G41-M43 PolarHBondContact O-N 3.48Å; M43-F46 WeakPolarHBondContact O-CB 3.48Å; M43-F46 PolarHBondContact O-N 2.92Å; M43-W47 HydrophobicContact CE-CZ2 4.04Å; M43-W47 VanDerWaalsContact O-CD1 3.24Å; M43-W47 PolarHBondContact O-N 2.92Å |
| 44 | E | 87.9 | Confident | 82.6 | Confident | 100 Ų | 100 | 115.5 Ų | 115.5 | 47% | 0.467 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -71 | -40.6 | -179.8 | -170.6 | 176.7 | -165.2 | 0 | 0 | 110.8 | M40 G41 F46 W47 N48 | M40-E44 HydrophobicContact CB-CB 4.25Å; M40-E44 HydrophobicContact CB-CG 4.29Å; M40-E44 HydrophobicContact CE-CG 4.18Å; M40-E44 HydrophobicContact CG-CG 4.22Å; M40-E44 HydrophobicContact SD-CG 4.29Å; G41-E44 PolarHBondContact O-N 2.89Å; E44-F46 VanDerWaalsContact C-N 3.27Å; E44-F46 PolarHBondContact O-N 3.47Å; E44-W47 PolarHBondContact O-N 2.88Å; E44-N48 WeakPolarHBondContact O-CB 3.37Å; E44-N48 VanDerWaalsContact O-CG 3.29Å; E44-N48 PolarHBondContact O-N 3.46Å; E44-N48 PolarHBondContact O-ND2 3.31Å |
| 45 | K | 90.1 | Very high | 83.3 | Confident | 120 Ų | 120 | 112.4 Ų | 112.4 | 52% | 0.522 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -58.1 | -41.4 | 170 | -71.4 | -179.9 | 175.2 | 173.7 | 0 | 112 | M40 G41 K49 | M40-K45 HydrophobicContact CB-CG 3.75Å; M40-K45 WeakPolarHBondContact O-CE 3.48Å; G41-K45 PolarHBondContact O-N 2.94Å; K45-K49 WeakPolarHBondContact O-CB 3.32Å; K45-K49 PolarHBondContact O-N 3.35Å |
| 46 | F | 91.2 | Very high | 83.3 | Confident | 112 Ų | 112 | 109.1 Ų | 109.1 | 49% | 0.491 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -62 | -52.8 | 176.7 | 171.6 | -93.6 | 0 | 0 | 0 | 111.5 | P42 M43 E44 N48 K49 F50 | P42-F46 WeakPolarHBondContact O-CB 3.43Å; P42-F46 PolarHBondContact O-N 3.44Å; M43-F46 WeakPolarHBondContact O-CB 3.48Å; M43-F46 PolarHBondContact O-N 2.92Å; E44-F46 VanDerWaalsContact C-N 3.27Å; E44-F46 PolarHBondContact O-N 3.47Å; F46-N48 VanDerWaalsContact C-N 3.35Å; F46-N48 PolarHBondContact O-N 3.36Å; F46-K49 PolarHBondContact O-N 3.12Å; F46-F50 HydrophobicContact CZ-CD2 4.41Å; F46-F50 VanDerWaalsContact O-CB 3.23Å; F46-F50 WeakPolarHBondContact O-CB 3.33Å; F46-F50 PolarHBondContact O-N 3.05Å |
| 47 | W | 88.8 | Confident | 83.6 | Confident | 120 Ų | 120 | 111.5 Ų | 111.5 | 46% | 0.455 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -62.7 | -39.9 | -179.9 | -77.4 | 118.1 | 0 | 0 | 0 | 112.9 | M43 E44 F50 L51 | M43-W47 HydrophobicContact CE-CZ2 4.04Å; M43-W47 VanDerWaalsContact O-CD1 3.24Å; M43-W47 PolarHBondContact O-N 2.92Å; E44-W47 PolarHBondContact O-N 2.88Å; W47-F50 AromaticContact CE3-CD1 3.96Å; W47-F50 HydrophobicContact CE3-CD1 3.96Å; W47-F50 AromaticContact CZ3-CD1 3.95Å; W47-F50 HydrophobicContact CZ3-CD1 3.95Å; W47-F50 HydrophobicContact CZ3-CE1 4.11Å; W47-F50 WeakPolarHBondContact O-CB 3.32Å; W47-F50 PolarHBondContact O-N 2.94Å; W47-L51 WeakPolarHBondContact O-CB 3.48Å; W47-L51 WeakPolarHBondContact O-CG 3.23Å; W47-L51 PolarHBondContact O-N 2.95Å |
| 48 | N | 87.4 | Confident | 83.9 | Confident | 76 Ų | 76 | 109.4 Ų | 109.4 | 41% | 0.406 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -61.6 | -48.5 | 176.3 | -74.3 | -26.5 | 0 | 0 | 0 | 111.4 | M40 E44 F46 F50 L51 E52 | M40-N48 WeakPolarHBondContact CE-ND2 3.49Å; M40-N48 PolarHBondContact SD-ND2 3.47Å; E44-N48 WeakPolarHBondContact O-CB 3.37Å; E44-N48 VanDerWaalsContact O-CG 3.29Å; E44-N48 PolarHBondContact O-N 3.46Å; E44-N48 PolarHBondContact O-ND2 3.31Å; F46-N48 VanDerWaalsContact C-N 3.35Å; F46-N48 PolarHBondContact O-N 3.36Å; N48-F50 VanDerWaalsContact C-N 3.27Å; N48-F50 PolarHBondContact O-N 3.36Å; N48-L51 PolarHBondContact O-N 2.89Å; N48-E52 VanDerWaalsContact O-CB 3.3Å; N48-E52 WeakPolarHBondContact O-CB 3.49Å; N48-E52 PolarHBondContact O-N 3.23Å |
| 49 | K | 87.4 | Confident | 83.7 | Confident | 153 Ų | 153 | 104.8 Ų | 104.8 | 67% | 0.665 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -65.5 | -31.9 | 176 | -168.7 | 174.2 | -174.6 | 178.9 | 0 | 112.5 | K45 F46 | K45-K49 WeakPolarHBondContact O-CB 3.32Å; K45-K49 PolarHBondContact O-N 3.35Å; F46-K49 PolarHBondContact O-N 3.12Å |
| 50 | F | 86.5 | Confident | 83.2 | Confident | 42 Ų | 42 | 102.6 Ų | 102.6 | 18% | 0.184 | 50% | 0.497 | C | S | . | . | H | α-helix | trans | -68.3 | -43.5 | 176.4 | -177.5 | -96.8 | 0 | 0 | 0 | 111.4 | F46 W47 N48 W57 R58 | F46-F50 HydrophobicContact CZ-CD2 4.41Å; F46-F50 VanDerWaalsContact O-CB 3.23Å; F46-F50 WeakPolarHBondContact O-CB 3.33Å; F46-F50 PolarHBondContact O-N 3.05Å; W47-F50 AromaticContact CE3-CD1 3.96Å; W47-F50 HydrophobicContact CE3-CD1 3.96Å; W47-F50 AromaticContact CZ3-CD1 3.95Å; W47-F50 HydrophobicContact CZ3-CD1 3.95Å; W47-F50 HydrophobicContact CZ3-CE1 4.11Å; W47-F50 WeakPolarHBondContact O-CB 3.32Å; W47-F50 PolarHBondContact O-N 2.94Å; N48-F50 VanDerWaalsContact C-N 3.27Å; N48-F50 PolarHBondContact O-N 3.36Å; F50-W57 HydrophobicContact CE1-CZ3 4.45Å; F50-W57 AromaticContact CE2-CH2 3.64Å; F50-W57 HydrophobicContact CE2-CH2 3.64Å; F50-W57 HydrophobicContact CE2-CZ2 4.46Å; F50-W57 HydrophobicContact CE2-CZ3 4.21Å; F50-W57 AromaticContact CZ-CH2 3.41Å; F50-W57 HydrophobicContact CZ-CH2 3.41Å; F50-W57 VanDerWaalsContact CZ-CH2 3.41Å; F50-W57 HydrophobicContact CZ-CZ2 4.36Å; F50-W57 AromaticContact CZ-CZ3 3.5Å; F50-W57 HydrophobicContact CZ-CZ3 3.5Å; F50-R58 HydrophobicContact CD1-CG 4.49Å; F50-R58 HydrophobicContact CE1-CB 4.02Å; F50-R58 HydrophobicContact CE1-CG 3.81Å; F50-R58 HydrophobicContact CE2-CG 4.46Å; F50-R58 HydrophobicContact CZ-CB 4.5Å; F50-R58 HydrophobicContact CZ-CG 3.81Å; F50-R58 WeakPolarHBondContact O-CD 3.35Å; F50-R58 PolarHBondContact O-NH1 3.04Å |
| 51 | L | 84.3 | Confident | 82.9 | Confident | 78 Ų | 78 | 104.3 Ų | 104.3 | 41% | 0.408 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -85.7 | -17.1 | -178.2 | -65.4 | 175.5 | 0 | 0 | 0 | 114.4 | W47 N48 N53 R58 | W47-L51 WeakPolarHBondContact O-CB 3.48Å; W47-L51 WeakPolarHBondContact O-CG 3.23Å; W47-L51 PolarHBondContact O-N 2.95Å; N48-L51 PolarHBondContact O-N 2.89Å; L51-N53 VanDerWaalsContact C-N 3.25Å; L51-N53 PolarHBondContact O-N 3.32Å; L51-R58 HydrophobicContact CD2-CB 4.39Å; L51-R58 WeakPolarHBondContact CD2-O 3.43Å |
| 52 | E | 84.4 | Confident | 82.4 | Confident | 144 Ų | 144 | 110.3 Ų | 110.3 | 67% | 0.673 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -54.3 | -42.8 | 175.6 | -177.5 | 176.6 | -168 | 0 | 0 | 111.6 | N48 K54 | N48-E52 VanDerWaalsContact O-CB 3.3Å; N48-E52 WeakPolarHBondContact O-CB 3.49Å; N48-E52 PolarHBondContact O-N 3.23Å; E52-K54 PolarHBondContact O-N 3.1Å |
| 53 | N | 78.6 | Confident | 81.9 | Confident | 105 Ų | 105 | 109.6 Ų | 109.6 | 56% | 0.561 | 52% | 0.516 | S | S | * | . | S | Bend | trans | -75.8 | 105.7 | 169.7 | -74.5 | -42.3 | 0 | 0 | 0 | 109.5 | L51 S55 | L51-N53 VanDerWaalsContact C-N 3.25Å; L51-N53 PolarHBondContact O-N 3.32Å; N53-S55 PolarHBondContact O-N 3.14Å |
| 54 | K | 72.3 | Confident | 81.5 | Confident | 162 Ų | 162 | 113.5 Ų | 113.5 | 70% | 0.704 | 53% | 0.526 | S | S | * | . | trans | -68.4 | 46.5 | -179.1 | -54.7 | -177.4 | -178.9 | 176.5 | 0 | 113.6 | E52 K59 | E52-K54 PolarHBondContact O-N 3.1Å; K54-K59 HydrophobicContact CB-CD 4.34Å | ||
| 55 | S | 80.7 | Confident | 81.2 | Confident | 40 Ų | 40 | 111.3 Ų | 111.3 | 28% | 0.28 | 53% | 0.53 | S | S | . | . | trans | -72.1 | 133.6 | 174.1 | -168 | 0 | 0 | 0 | 0 | 109.6 | N53 W57 R58 K59 | N53-S55 PolarHBondContact O-N 3.14Å; S55-W57 VanDerWaalsContact C-N 3.27Å; S55-W57 PolarHBondContact O-N 2.98Å; S55-W57 PolarHBondContact OG-NE1 3.49Å; S55-W57 VanDerWaalsContact OG-NE1 3.13Å; S55-R58 WeakPolarHBondContact O-CB 3.4Å; S55-R58 PolarHBondContact O-N 3.45Å; S55-K59 PolarHBondContact O-N 3.14Å | ||
| 56 | P | 73.6 | Confident | 80.9 | Confident | 78 Ų | 78 | 112.8 Ų | 112.8 | 51% | 0.506 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -55.5 | -37 | -174.3 | -29.4 | 35.5 | 0 | 0 | 0 | 114.5 | R58 K59 M60 E61 | P56-R58 VanDerWaalsContact C-N 3.27Å; P56-R58 PolarHBondContact O-N 3.22Å; P56-K59 PolarHBondContact O-N 2.9Å; P56-M60 PolarHBondContact O-N 3.28Å; P56-E61 PolarHBondContact O-N 2.78Å |
| 57 | W | 78.8 | Confident | 80.7 | Confident | 163 Ų | 163 | 112.6 Ų | 112.6 | 62% | 0.617 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -68.7 | -25.4 | 177.9 | 73.4 | -94.8 | 0 | 0 | 0 | 113.2 | F50 S55 | F50-W57 HydrophobicContact CE1-CZ3 4.45Å; F50-W57 AromaticContact CE2-CH2 3.64Å; F50-W57 HydrophobicContact CE2-CH2 3.64Å; F50-W57 HydrophobicContact CE2-CZ2 4.46Å; F50-W57 HydrophobicContact CE2-CZ3 4.21Å; F50-W57 AromaticContact CZ-CH2 3.41Å; F50-W57 HydrophobicContact CZ-CH2 3.41Å; F50-W57 VanDerWaalsContact CZ-CH2 3.41Å; F50-W57 HydrophobicContact CZ-CZ2 4.36Å; F50-W57 AromaticContact CZ-CZ3 3.5Å; F50-W57 HydrophobicContact CZ-CZ3 3.5Å; S55-W57 VanDerWaalsContact C-N 3.27Å; S55-W57 PolarHBondContact O-N 2.98Å; S55-W57 PolarHBondContact OG-NE1 3.49Å; S55-W57 VanDerWaalsContact OG-NE1 3.13Å |
| 58 | R | 80.3 | Confident | 80.7 | Confident | 68 Ų | 68 | 114.8 Ų | 114.8 | 26% | 0.257 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -80.9 | -34.5 | 176.8 | -61.3 | -169.8 | -177.5 | -159.2 | -3.7 | 112.1 | F50 L51 S55 P56 M60 | F50-R58 HydrophobicContact CD1-CG 4.49Å; F50-R58 HydrophobicContact CE1-CB 4.02Å; F50-R58 HydrophobicContact CE1-CG 3.81Å; F50-R58 HydrophobicContact CE2-CG 4.46Å; F50-R58 HydrophobicContact CZ-CB 4.5Å; F50-R58 HydrophobicContact CZ-CG 3.81Å; F50-R58 WeakPolarHBondContact O-CD 3.35Å; F50-R58 PolarHBondContact O-NH1 3.04Å; L51-R58 HydrophobicContact CD2-CB 4.39Å; L51-R58 WeakPolarHBondContact CD2-O 3.43Å; S55-R58 WeakPolarHBondContact O-CB 3.4Å; S55-R58 PolarHBondContact O-N 3.45Å; P56-R58 VanDerWaalsContact C-N 3.27Å; P56-R58 PolarHBondContact O-N 3.22Å; R58-M60 VanDerWaalsContact C-N 3.34Å |
| 59 | K | 73.6 | Confident | 80.9 | Confident | 90 Ų | 90 | 119.9 Ų | 119.9 | 39% | 0.391 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -85.7 | -4.6 | 177.1 | -75.8 | -170.7 | 168.5 | -168.2 | 0 | 114.2 | K54 S55 P56 E61 | K54-K59 HydrophobicContact CB-CD 4.34Å; S55-K59 PolarHBondContact O-N 3.14Å; P56-K59 PolarHBondContact O-N 2.9Å; K59-E61 HydrophobicContact CB-CG 3.96Å; K59-E61 VanDerWaalsContact CD-OE1 3.28Å; K59-E61 WeakPolarHBondContact CD-OE1 3.23Å; K59-E61 PolarHBondContact O-N 3.32Å |
| 60 | M | 69.3 | Low | 81 | Confident | 150 Ų | 150 | 121.8 Ų | 121.8 | 74% | 0.739 | 59% | 0.592 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 48.4 | 38.2 | -171.6 | -57.8 | -164.4 | -144.8 | 0 | 0 | 112.2 | P56 R58 K62 | P56-M60 PolarHBondContact O-N 3.28Å; R58-M60 VanDerWaalsContact C-N 3.34Å; M60-K62 VanDerWaalsContact C-N 3.33Å; M60-K62 PolarHBondContact O-N 2.81Å |
| 61 | E | 75.3 | Confident | 81.1 | Confident | 116 Ų | 116 | 124.5 Ų | 124.5 | 54% | 0.542 | 62% | 0.616 | S | S | . | * | trans | -71.4 | 96.2 | 171.2 | -74.5 | 173.5 | -166.3 | 0 | 0 | 106.7 | P56 K59 P63 | P56-E61 PolarHBondContact O-N 2.78Å; K59-E61 HydrophobicContact CB-CG 3.96Å; K59-E61 VanDerWaalsContact CD-OE1 3.28Å; K59-E61 WeakPolarHBondContact CD-OE1 3.23Å; K59-E61 PolarHBondContact O-N 3.32Å; E61-P63 WeakPolarHBondContact O-CD 3.38Å | ||
| 62 | K | 78.9 | Confident | 81.4 | Confident | 160 Ų | 160 | 130.2 Ų | 130.2 | 70% | 0.696 | 63% | 0.632 | S | S | * | * | trans | -82.7 | 107.1 | 177.8 | -66.5 | -176.5 | -177.7 | -179.9 | 0 | 108 | M60 Y64 G65 | M60-K62 VanDerWaalsContact C-N 3.33Å; M60-K62 PolarHBondContact O-N 2.81Å; K62-Y64 PolarHBondContact O-N 3.38Å; K62-G65 PolarHBondContact O-N 3.22Å | ||
| 63 | P | 79.7 | Confident | 81.7 | Confident | 106 Ų | 106 | 128.1 Ų | 128.1 | 69% | 0.688 | 63% | 0.625 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.5 | 136.5 | 169.6 | 27.2 | -33.9 | 0 | 0 | 0 | 107.6 | E61 G65 | E61-P63 WeakPolarHBondContact O-CD 3.38Å; P63-G65 PolarHBondContact O-N 3.18Å |
| 64 | Y | 82.1 | Confident | 82.3 | Confident | 201 Ų | 201 | 128.8 Ų | 128.8 | 79% | 0.788 | 62% | 0.622 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 64.4 | 19 | -174.9 | -42.9 | -77.6 | 0 | 0 | 0 | 115 | K62 I66 V67 | K62-Y64 PolarHBondContact O-N 3.38Å; Y64-I66 PolarHBondContact O-N 3.29Å; Y64-V67 HydrophobicContact CD1-CG2 4.16Å; Y64-V67 HydrophobicContact CG-CG2 4.42Å; Y64-V67 WeakPolarHBondContact O-CG2 3.41Å |
| 65 | G | 81.6 | Confident | 83.2 | Confident | 54 Ų | 54 | 123.7 Ų | 123.7 | 56% | 0.557 | 61% | 0.606 | S | S | * | * | S | Bend | trans | -61.1 | -30.9 | 172.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | K62 P63 | K62-G65 PolarHBondContact O-N 3.22Å; P63-G65 PolarHBondContact O-N 3.18Å |
| 66 | I | 85 | Confident | 83.4 | Confident | 150 Ų | 150 | 124 Ų | 124 | 77% | 0.769 | 62% | 0.616 | S | S | * | * | S | Bend | trans | -127 | 120.3 | 169.2 | -58.3 | 171.1 | 0 | 0 | 0 | 106.1 | Y64 E68 | Y64-I66 PolarHBondContact O-N 3.29Å; I66-E68 HydrophobicContact CG2-CG 4.34Å |
| 67 | V | 86.7 | Confident | 84.3 | Confident | 109 Ų | 109 | 123.5 Ų | 123.5 | 66% | 0.661 | 61% | 0.608 | S | S | * | * | trans | -121.2 | 115.7 | 174.3 | -177.8 | 0 | 0 | 0 | 0 | 107.8 | Y64 | Y64-V67 HydrophobicContact CD1-CG2 4.16Å; Y64-V67 HydrophobicContact CG-CG2 4.42Å; Y64-V67 WeakPolarHBondContact O-CG2 3.41Å | ||
| 68 | E | 88.8 | Confident | 84.7 | Confident | 165 Ų | 165 | 119.7 Ų | 119.7 | 77% | 0.771 | 60% | 0.603 | S | S | * | * | P | Polyproline II helix | trans | -94.9 | 149.2 | 175.2 | -65.5 | -177.8 | 175.2 | 0 | 0 | 110.2 | I66 | I66-E68 HydrophobicContact CG2-CG 4.34Š|
| 69 | K | 91.8 | Very high | 85.1 | Confident | 184 Ų | 184 | 119.2 Ų | 119.2 | 80% | 0.8 | 61% | 0.606 | S | S | * | * | P | Polyproline II helix | trans | -71.2 | 134.1 | 170.5 | -178 | 174.6 | 174.8 | 158.7 | 0 | 108.3 | S71 | K69-S71 PolarHBondContact O-N 3.02Š|
| 70 | K | 89.7 | Confident | 85.7 | Confident | 193 Ų | 193 | 123.1 Ų | 123.1 | 84% | 0.839 | 63% | 0.63 | S | S | * | * | P | Polyproline II helix | trans | -51.3 | 137.4 | 171.3 | -64.2 | -173.4 | 177 | -172.3 | 0 | 110.3 | ||
| 71 | S | 88.4 | Confident | 86.6 | Confident | 98 Ų | 98 | 125 Ų | 125 | 69% | 0.685 | 64% | 0.636 | S | S | * | * | P | Polyproline II helix | trans | -54.9 | 148 | 176.5 | 44.3 | 0 | 0 | 0 | 0 | 110.7 | K69 | K69-S71 PolarHBondContact O-N 3.02Š|
| 72 | R | 90.8 | Very high | 87.3 | Confident | 199 Ų | 199 | 123.4 Ų | 123.4 | 75% | 0.751 | 64% | 0.635 | S | S | * | * | P | Polyproline II helix | trans | -70.4 | 142.6 | 169.2 | -68.3 | -176 | -171.3 | -178.2 | 1.5 | 108 | F74 | R72-F74 HydrophobicContact CB-CE2 3.98Å; R72-F74 HydrophobicContact CB-CZ 4.32Å |
| 73 | I | 89.8 | Confident | 87.7 | Confident | 100 Ų | 100 | 118.2 Ų | 118.2 | 51% | 0.513 | 63% | 0.627 | S | S | . | * | trans | -127.9 | 129.7 | -172.5 | -69.9 | -176.5 | 0 | 0 | 0 | 107.1 | I86 | I73-I86 HydrophobicContact CB-CD1 4.29Å; I73-I86 HydrophobicContact CG2-CD1 2.8Å; I73-I86 HydrophobicContact CG2-CG1 4.28Å | ||
| 74 | F | 90.9 | Very high | 88.1 | Confident | 118 Ų | 118 | 119.2 Ų | 119.2 | 52% | 0.518 | 62% | 0.623 | S | S | . | * | trans | -121.6 | 158.1 | -176.6 | -67.2 | -75.4 | 0 | 0 | 0 | 112.3 | R72 G76 D77 | R72-F74 HydrophobicContact CB-CE2 3.98Å; R72-F74 HydrophobicContact CB-CZ 4.32Å; F74-G76 PolarHBondContact O-N 3.05Å; F74-D77 PolarHBondContact N-OD2 2.97Å; F74-D77 VanDerWaalsContact O-CB 3.3Å; F74-D77 WeakPolarHBondContact O-CB 3.45Å; F74-D77 PolarHBondContact O-N 3.34Å | ||
| 75 | P | 91.1 | Very high | 88.4 | Confident | 56 Ų | 56 | 114.2 Ų | 114.2 | 36% | 0.364 | 61% | 0.613 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -54.2 | 128 | 171.2 | -20.6 | 30.1 | 0 | 0 | 0 | 111.4 | P87 M89 | P75-P87 WeakPolarHBondContact CB-O 3.39Å; P75-M89 HydrophobicContact CG-CB 4.49Å; P75-M89 HydrophobicContact CG-CE 4.27Å; P75-M89 HydrophobicContact CG-CG 3.65Å; P75-M89 HydrophobicContact CG-SD 4.3Å |
| 76 | G | 85.4 | Confident | 88.8 | Confident | 46 Ų | 46 | 113.4 Ų | 113.4 | 47% | 0.474 | 60% | 0.595 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 93.7 | -12.2 | -174.3 | 0 | 0 | 0 | 0 | 0 | 115.5 | F74 I86 | F74-G76 PolarHBondContact O-N 3.05Å; G76-I86 PolarHBondContact N-O 3.36Å |
| 77 | D | 91.8 | Very high | 89.1 | Confident | 67 Ų | 67 | 111 Ų | 111 | 36% | 0.358 | 59% | 0.589 | S | S | . | * | trans | -66.1 | 148.4 | 174.1 | -72.4 | -15.3 | 0 | 0 | 0 | 111.1 | F74 V85 I86 | F74-D77 PolarHBondContact N-OD2 2.97Å; F74-D77 VanDerWaalsContact O-CB 3.3Å; F74-D77 WeakPolarHBondContact O-CB 3.45Å; F74-D77 PolarHBondContact O-N 3.34Å; D77-V85 WeakPolarHBondContact O-CA 3.41Å; D77-I86 HydrophobicContact CB-CD1 4.28Å; D77-I86 WeakPolarHBondContact O-CG1 3.34Å; D77-I86 PolarHBondContact O-N 2.96Å | ||
| 78 | T | 87.9 | Confident | 89.1 | Confident | 83 Ų | 83 | 111.1 Ų | 111.1 | 51% | 0.509 | 59% | 0.592 | S | S | . | * | B | Isolated β-bridge | trans | -108.2 | 127 | 175.4 | -48.7 | 0 | 0 | 0 | 0 | 110.2 | L80 E84 V85 | T78-L80 PolarHBondContact O-N 2.83Å; T78-E84 WeakPolarHBondContact CA-O 3.4Å; T78-V85 HydrophobicContact CG2-CG2 4.28Å |
| 79 | I | 88.9 | Confident | 88.9 | Confident | 59 Ų | 59 | 109.7 Ų | 109.7 | 30% | 0.303 | 59% | 0.587 | S | S | . | * | trans | -77.5 | 114.4 | 174.8 | -58.8 | 173.4 | 0 | 0 | 0 | 108.2 | E81 T82 G83 E84 | I79-E81 HydrophobicContact CG2-CB 4.35Å; I79-E81 PolarHBondContact O-N 3.32Å; I79-T82 WeakPolarHBondContact CB-OG1 3.42Å; I79-T82 HydrophobicContact CG2-CG2 4.29Å; I79-T82 WeakPolarHBondContact CG2-OG1 3.43Å; I79-T82 PolarHBondContact O-N 3.48Å; I79-G83 VanDerWaalsContact O-CA 3.3Å; I79-G83 WeakPolarHBondContact O-CA 3.35Å; I79-G83 PolarHBondContact O-N 3.19Å; I79-E84 PolarHBondContact N-O 3.49Å | ||
| 80 | L | 86.8 | Confident | 88.5 | Confident | 172 Ų | 172 | 109.8 Ų | 109.8 | 90% | 0.901 | 59% | 0.588 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.6 | -31.4 | -176.6 | -65.8 | 176.5 | 0 | 0 | 0 | 113.6 | T78 | T78-L80 PolarHBondContact O-N 2.83Š|
| 81 | E | 87.8 | Confident | 88.1 | Confident | 188 Ų | 188 | 109.4 Ų | 109.4 | 88% | 0.879 | 59% | 0.589 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.2 | -33.1 | -178 | -62.3 | 179.8 | 177.9 | 0 | 0 | 112.9 | I79 | I79-E81 HydrophobicContact CG2-CB 4.35Å; I79-E81 PolarHBondContact O-N 3.32Å |
| 82 | T | 89.1 | Confident | 87.7 | Confident | 83 Ų | 83 | 112.6 Ų | 112.6 | 51% | 0.509 | 59% | 0.591 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -111 | -17.7 | -175.2 | 62 | 0 | 0 | 0 | 0 | 113.6 | I79 E84 | I79-T82 WeakPolarHBondContact CB-OG1 3.42Å; I79-T82 HydrophobicContact CG2-CG2 4.29Å; I79-T82 WeakPolarHBondContact CG2-OG1 3.43Å; I79-T82 PolarHBondContact O-N 3.48Å; T82-E84 PolarHBondContact O-N 3.17Å; T82-E84 PolarHBondContact OG1-N 3.32Å |
| 83 | G | 87.4 | Confident | 87.2 | Confident | 52 Ų | 52 | 108.5 Ų | 108.5 | 54% | 0.536 | 59% | 0.59 | S | S | . | * | trans | 70.9 | 5.5 | -171.6 | 0 | 0 | 0 | 0 | 0 | 114.1 | I79 | I79-G83 VanDerWaalsContact O-CA 3.3Å; I79-G83 WeakPolarHBondContact O-CA 3.35Å; I79-G83 PolarHBondContact O-N 3.19Å | ||
| 84 | E | 87.5 | Confident | 86.4 | Confident | 127 Ų | 127 | 110.4 Ų | 110.4 | 59% | 0.593 | 60% | 0.601 | S | S | * | * | P | Polyproline II helix | trans | -76.1 | 131.9 | -178.3 | -67.4 | 179.5 | 167.1 | 0 | 0 | 111.1 | T78 I79 T82 | T78-E84 WeakPolarHBondContact CA-O 3.4Å; I79-E84 PolarHBondContact N-O 3.49Å; T82-E84 PolarHBondContact O-N 3.17Å; T82-E84 PolarHBondContact OG1-N 3.32Å |
| 85 | V | 89.8 | Confident | 85.8 | Confident | 95 Ų | 95 | 112.9 Ų | 112.9 | 58% | 0.576 | 61% | 0.614 | S | S | * | * | B | Isolated β-bridge | trans | -93.2 | 133.2 | 174.4 | -177.4 | 0 | 0 | 0 | 0 | 109.1 | D77 T78 | D77-V85 WeakPolarHBondContact O-CA 3.41Å; T78-V85 HydrophobicContact CG2-CG2 4.28Å |
| 86 | I | 90.4 | Very high | 84.5 | Confident | 37 Ų | 37 | 118.6 Ų | 118.6 | 19% | 0.19 | 64% | 0.636 | C | S | . | * | P | Polyproline II helix | trans | -78 | 130.1 | -174.8 | -64.9 | -177.1 | 0 | 0 | 0 | 110.3 | I73 G76 D77 | I73-I86 HydrophobicContact CB-CD1 4.29Å; I73-I86 HydrophobicContact CG2-CD1 2.8Å; I73-I86 HydrophobicContact CG2-CG1 4.28Å; G76-I86 PolarHBondContact N-O 3.36Å; D77-I86 HydrophobicContact CB-CD1 4.28Å; D77-I86 WeakPolarHBondContact O-CG1 3.34Å; D77-I86 PolarHBondContact O-N 2.96Å |
| 87 | P | 89.4 | Confident | 82.8 | Confident | 99 Ų | 99 | 128.4 Ų | 128.4 | 64% | 0.643 | 67% | 0.669 | S | S | * | * | P | Polyproline II helix | trans | -61 | 142.7 | -174.1 | 23.3 | -33.6 | 0 | 0 | 0 | 111.5 | P75 | P75-P87 WeakPolarHBondContact CB-O 3.39Š|
| 88 | P | 86.9 | Confident | 82.4 | Confident | 112 Ų | 112 | 131.5 Ų | 131.5 | 73% | 0.727 | 68% | 0.684 | S | S | * | * | P | Polyproline II helix | trans | -61.2 | 152.3 | 175.8 | 26.8 | -33.8 | 0 | 0 | 0 | 111 | ||
| 89 | M | 85.8 | Confident | 82.1 | Confident | 136 Ų | 136 | 134 Ų | 134 | 67% | 0.67 | 69% | 0.694 | S | S | * | * | P | Polyproline II helix | trans | -64.3 | 148.6 | 170.2 | -81.1 | -176.6 | -56.5 | 0 | 0 | 110.4 | P75 E91 | P75-M89 HydrophobicContact CG-CB 4.49Å; P75-M89 HydrophobicContact CG-CE 4.27Å; P75-M89 HydrophobicContact CG-CG 3.65Å; P75-M89 HydrophobicContact CG-SD 4.3Å; M89-E91 PolarHBondContact O-N 3.06Å |
| 90 | K | 83.7 | Confident | 81.7 | Confident | 186 Ų | 186 | 138.2 Ų | 138.2 | 81% | 0.809 | 72% | 0.715 | S | S | * | * | P | Polyproline II helix | trans | -59.3 | 133.9 | 173 | -170.6 | 173.7 | -178 | 178.5 | 0 | 109.4 | F92 | K90-F92 WeakPolarHBondContact O-CD2 3.18Å; K90-F92 PolarHBondContact O-N 2.93Å |
| 91 | E | 80.7 | Confident | 81.4 | Confident | 185 Ų | 185 | 136.2 Ų | 136.2 | 86% | 0.864 | 70% | 0.704 | S | S | * | * | P | Polyproline II helix | trans | -58 | 125.9 | 178 | -64.8 | 178.6 | -178.5 | 0 | 0 | 110.1 | M89 | M89-E91 PolarHBondContact O-N 3.06Š|
| 92 | F | 80.4 | Confident | 81 | Confident | 164 Ų | 164 | 132.9 Ų | 132.9 | 72% | 0.719 | 69% | 0.694 | S | S | * | * | P | Polyproline II helix | trans | -90.4 | 137 | 170.5 | -66.3 | -80.9 | 0 | 0 | 0 | 108.2 | K90 D94 | K90-F92 WeakPolarHBondContact O-CD2 3.18Å; K90-F92 PolarHBondContact O-N 2.93Å; F92-D94 PolarHBondContact O-N 3.38Å |
| 93 | P | 80.3 | Confident | 80.5 | Confident | 114 Ų | 114 | 136.3 Ų | 136.3 | 74% | 0.74 | 71% | 0.706 | S | S | * | * | trans | -61.3 | 114.5 | 174.6 | 24.2 | -30.9 | 0 | 0 | 0 | 108.9 | Q95 | P93-Q95 PolarHBondContact O-N 2.8Š| ||
| 94 | D | 73.4 | Confident | 80 | Confident | 140 Ų | 140 | 142.3 Ų | 142.3 | 75% | 0.749 | 72% | 0.718 | S | S | * | * | trans | -70.2 | 123.6 | -178.1 | -156.8 | -3 | 0 | 0 | 0 | 109.4 | F92 | F92-D94 PolarHBondContact O-N 3.38Š| ||
| 95 | Q | 76.6 | Confident | 79.4 | Confident | 169 Ų | 169 | 143.5 Ų | 143.5 | 79% | 0.79 | 73% | 0.728 | S | S | * | * | trans | -103 | 11.8 | -179.1 | -68.2 | -172.5 | -2.5 | 0 | 0 | 112.5 | P93 H97 | P93-Q95 PolarHBondContact O-N 2.8Å; Q95-H97 PolarHBondContact O-N 3.13Å; Q95-H97 VanDerWaalsContact O-N 3.1Å | ||
| 96 | H | 63.9 | Low | 78.5 | Confident | 177 Ų | 177 | 147.5 Ų | 147.5 | 82% | 0.819 | 74% | 0.74 | S | S | * | * | trans | -76.9 | 98.1 | 174.9 | -93.4 | -74.3 | 0 | 0 | 0 | 111.2 | ||||
| 97 | H | 50.8 | Low | 77.4 | Confident | 251 Ų | 251 | 157.5 Ų | 157.5 | 100% | 1.162 | 79% | 0.79 | S | S | * | * | trans | -75.3 | 0 | 164.1 | -73.6 | -75.4 | 0 | 0 | 0 | 112.1 | Q95 | Q95-H97 PolarHBondContact O-N 3.13Å; Q95-H97 VanDerWaalsContact O-N 3.1Å |
Retrieved 97 of 97 residues in 121.3 ms
(Link to these results)