| 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 | 48.8 | Very low | 55.8 | Low | 234 Ų | 234 | 131.9 Ų | 131.9 | 100% | 1.153 | 68% | 0.675 | S | S | * | * | 0 | 100.1 | 0 | -84.8 | -69 | 153 | 0 | 0 | 107.8 | S3 | M1-S3 PolarHBondContact O-N 2.86Š| |||
| 2 | D | 50.3 | Low | 56.7 | Low | 143 Ų | 143 | 124.3 Ų | 124.3 | 77% | 0.765 | 65% | 0.654 | S | S | * | * | trans | -76.2 | 109.4 | -167.4 | -60.6 | -61.1 | 0 | 0 | 0 | 112.6 | N4 | D2-N4 PolarHBondContact O-N 2.78Å; D2-N4 VanDerWaalsContact O-N 3.09Å | ||
| 3 | S | 57.1 | Low | 58 | Low | 99 Ų | 99 | 124.1 Ų | 124.1 | 69% | 0.692 | 64% | 0.644 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.5 | 0.2 | 176.6 | 50.3 | 0 | 0 | 0 | 0 | 114.3 | M1 | M1-S3 PolarHBondContact O-N 2.86Š|
| 4 | N | 53.4 | Low | 59.4 | Low | 104 Ų | 104 | 125.6 Ų | 125.6 | 56% | 0.556 | 64% | 0.644 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.4 | -12.4 | 179.9 | -74.1 | -37.3 | 0 | 0 | 0 | 114.4 | D2 | D2-N4 PolarHBondContact O-N 2.78Å; D2-N4 VanDerWaalsContact O-N 3.09Å |
| 5 | A | 54.3 | Low | 60.6 | Low | 80 Ų | 80 | 130.2 Ų | 130.2 | 66% | 0.661 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -70 | -30.4 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113 | ||
| 6 | R | 54.2 | Low | 61.9 | Low | 200 Ų | 200 | 133.8 Ų | 133.8 | 76% | 0.755 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -72.3 | -36.5 | -176.6 | -123 | -177.1 | -178.2 | -153 | 1.6 | 112.9 | K8 S9 H10 | R6-K8 PolarHBondContact O-N 2.95Å; R6-S9 PolarHBondContact O-N 2.91Å; R6-S9 PolarHBondContact O-OG 3.09Å; R6-H10 PolarHBondContact O-CD2 3.4Å; R6-H10 VanDerWaalsContact O-CD2 3.23Å |
| 7 | K | 55.2 | Low | 63 | Low | 145 Ų | 145 | 132.5 Ų | 132.5 | 63% | 0.63 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -66.3 | -36.8 | -174.4 | -71.3 | -178.1 | 179.3 | 175.8 | 0 | 113.6 | S9 H10 | K7-S9 VanDerWaalsContact C-N 3.26Å; K7-S9 PolarHBondContact O-N 2.98Å; K7-H10 PolarHBondContact O-N 3.11Å |
| 8 | K | 55.1 | Low | 64.3 | Low | 172 Ų | 172 | 131.6 Ų | 131.6 | 75% | 0.748 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -63.8 | -31.3 | 179.9 | -64.3 | -178.4 | -179.1 | -178.9 | 0 | 112.6 | R6 | R6-K8 PolarHBondContact O-N 2.95Å |
| 9 | S | 60.1 | Low | 65.4 | Low | 54 Ų | 54 | 127.1 Ų | 127.1 | 38% | 0.378 | 63% | 0.629 | S | S | . | * | H | α-helix | trans | -71.3 | -30.1 | 179.1 | 77.8 | 0 | 0 | 0 | 0 | 113.8 | R6 K7 K13 | R6-S9 PolarHBondContact O-N 2.91Å; R6-S9 PolarHBondContact O-OG 3.09Å; K7-S9 VanDerWaalsContact C-N 3.26Å; K7-S9 PolarHBondContact O-N 2.98Å; S9-K13 WeakPolarHBondContact O-CG 3.4Å; S9-K13 PolarHBondContact O-N 3.35Å |
| 10 | H | 60.1 | Low | 66.3 | Low | 100 Ų | 100 | 127.9 Ų | 127.9 | 46% | 0.463 | 63% | 0.631 | S | S | . | * | H | α-helix | trans | -76.1 | -34.3 | -179.8 | -72.7 | -78.5 | 0 | 0 | 0 | 112.3 | R6 K7 K13 K14 | R6-H10 PolarHBondContact O-CD2 3.4Å; R6-H10 VanDerWaalsContact O-CD2 3.23Å; K7-H10 PolarHBondContact O-N 3.11Å; H10-K13 PolarHBondContact O-N 2.91Å; H10-K14 WeakPolarHBondContact O-CG 2.85Å; H10-K14 PolarHBondContact O-N 2.85Å |
| 11 | L | 65.3 | Low | 67.1 | Low | 120 Ų | 120 | 128 Ų | 128 | 63% | 0.628 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -66.3 | -43.1 | 178.1 | -66.7 | 171.8 | 0 | 0 | 0 | 111.7 | K13 K14 W15 | L11-K13 VanDerWaalsContact C-N 3.32Å; L11-K13 PolarHBondContact O-N 3.3Å; L11-K14 PolarHBondContact O-N 3.28Å; L11-W15 PolarHBondContact O-N 3.38Å; L11-W15 VanDerWaalsContact O-N 3.15Å |
| 12 | G | 66.9 | Low | 68.8 | Low | 41 Ų | 41 | 121.1 Ų | 121.1 | 42% | 0.423 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -65.2 | -33.3 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | R16 | G12-R16 WeakPolarHBondContact O-CB 3.36Å; G12-R16 PolarHBondContact O-N 3.48Å; G12-R16 VanDerWaalsContact O-N 3.09Å |
| 13 | K | 73.2 | Confident | 70.3 | Confident | 121 Ų | 121 | 121.1 Ų | 121.1 | 53% | 0.526 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -66.5 | -41.5 | 174.2 | -71.3 | 173.8 | -176.6 | -176.6 | 0 | 111.7 | S9 H10 L11 R16 I17 | S9-K13 WeakPolarHBondContact O-CG 3.4Å; S9-K13 PolarHBondContact O-N 3.35Å; H10-K13 PolarHBondContact O-N 2.91Å; L11-K13 VanDerWaalsContact C-N 3.32Å; L11-K13 PolarHBondContact O-N 3.3Å; K13-R16 PolarHBondContact O-N 2.89Å; K13-I17 WeakPolarHBondContact O-CG1 3.32Å; K13-I17 PolarHBondContact O-N 3.19Å; K13-I17 VanDerWaalsContact O-N 3.09Å |
| 14 | K | 77.1 | Confident | 71.4 | Confident | 146 Ų | 146 | 119.2 Ų | 119.2 | 64% | 0.635 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -62.1 | -46.8 | 177.1 | -71.5 | 178.9 | 178.1 | -171 | 0 | 112.1 | H10 L11 R16 I17 Q18 | H10-K14 WeakPolarHBondContact O-CG 2.85Å; H10-K14 PolarHBondContact O-N 2.85Å; L11-K14 PolarHBondContact O-N 3.28Å; K14-R16 VanDerWaalsContact C-N 3.35Å; K14-R16 PolarHBondContact O-N 2.91Å; K14-I17 PolarHBondContact O-N 2.8Å; K14-Q18 WeakPolarHBondContact O-CB 3.28Å; K14-Q18 PolarHBondContact O-N 3.07Å |
| 15 | W | 77.6 | Confident | 72.5 | Confident | 194 Ų | 194 | 122.1 Ų | 122.1 | 74% | 0.735 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -62.5 | -41.7 | 176.7 | 179.9 | 10.7 | 0 | 0 | 0 | 111.6 | L11 I17 Q18 A19 | L11-W15 PolarHBondContact O-N 3.38Å; L11-W15 VanDerWaalsContact O-N 3.15Å; W15-I17 PolarHBondContact O-N 3.08Å; W15-Q18 PolarHBondContact O-N 3.02Å; W15-A19 WeakPolarHBondContact O-CB 3.49Å; W15-A19 PolarHBondContact O-N 2.83Å |
| 16 | R | 82 | Confident | 73.8 | Confident | 187 Ų | 187 | 126.8 Ų | 126.8 | 71% | 0.706 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -59.2 | -44.6 | 177.1 | -171.1 | -177.6 | -64.3 | 175.4 | -1.6 | 112.6 | G12 K13 K14 A19 Q20 | G12-R16 WeakPolarHBondContact O-CB 3.36Å; G12-R16 PolarHBondContact O-N 3.48Å; G12-R16 VanDerWaalsContact O-N 3.09Å; K13-R16 PolarHBondContact O-N 2.89Å; K14-R16 VanDerWaalsContact C-N 3.35Å; K14-R16 PolarHBondContact O-N 2.91Å; R16-A19 PolarHBondContact O-N 2.9Å; R16-Q20 WeakPolarHBondContact O-CB 3.38Å; R16-Q20 PolarHBondContact O-N 2.62Å |
| 17 | I | 81.3 | Confident | 74.8 | Confident | 113 Ų | 113 | 121.9 Ų | 121.9 | 58% | 0.579 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -62.9 | -46.2 | 177.1 | -66.5 | 164.1 | 0 | 0 | 0 | 110.1 | K13 K14 W15 A19 Q20 E21 | K13-I17 WeakPolarHBondContact O-CG1 3.32Å; K13-I17 PolarHBondContact O-N 3.19Å; K13-I17 VanDerWaalsContact O-N 3.09Å; K14-I17 PolarHBondContact O-N 2.8Å; W15-I17 PolarHBondContact O-N 3.08Å; I17-A19 VanDerWaalsContact C-N 3.33Å; I17-A19 PolarHBondContact O-N 3.21Å; I17-Q20 PolarHBondContact O-N 3.44Å; I17-E21 WeakPolarHBondContact O-CB 2.94Å; I17-E21 PolarHBondContact O-N 2.69Å |
| 18 | Q | 85.1 | Confident | 75.9 | Confident | 115 Ų | 115 | 120.3 Ų | 120.3 | 54% | 0.537 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -62.7 | -37.7 | 178.5 | -168.9 | -179.4 | 20.9 | 0 | 0 | 112.6 | K14 W15 N22 | K14-Q18 WeakPolarHBondContact O-CB 3.28Å; K14-Q18 PolarHBondContact O-N 3.07Å; W15-Q18 PolarHBondContact O-N 3.02Å; Q18-N22 WeakPolarHBondContact O-CB 3.36Å; Q18-N22 VanDerWaalsContact O-CG 3.32Å; Q18-N22 PolarHBondContact O-N 3.28Å; Q18-N22 PolarHBondContact O-ND2 3.36Å |
| 19 | A | 85.3 | Confident | 76.4 | Confident | 47 Ų | 47 | 120.6 Ų | 120.6 | 39% | 0.388 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -67.1 | -41.7 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | W15 R16 I17 N22 F23 | W15-A19 WeakPolarHBondContact O-CB 3.49Å; W15-A19 PolarHBondContact O-N 2.83Å; R16-A19 PolarHBondContact O-N 2.9Å; I17-A19 VanDerWaalsContact C-N 3.33Å; I17-A19 PolarHBondContact O-N 3.21Å; A19-N22 PolarHBondContact O-N 3.21Å; A19-F23 WeakPolarHBondContact O-CB 3.46Å; A19-F23 PolarHBondContact O-N 3.04Å |
| 20 | Q | 83.6 | Confident | 76.6 | Confident | 142 Ų | 142 | 127.6 Ų | 127.6 | 66% | 0.664 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -65.9 | -40.5 | 176.4 | -175.4 | 177.7 | -30.9 | 0 | 0 | 111.9 | R16 I17 F23 A24 | R16-Q20 WeakPolarHBondContact O-CB 3.38Å; R16-Q20 PolarHBondContact O-N 2.62Å; I17-Q20 PolarHBondContact O-N 3.44Å; Q20-F23 PolarHBondContact O-N 3.3Å; Q20-A24 WeakPolarHBondContact O-CB 3.43Å; Q20-A24 PolarHBondContact O-N 3.05Å |
| 21 | E | 82.6 | Confident | 76.5 | Confident | 132 Ų | 132 | 130.2 Ų | 130.2 | 62% | 0.617 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -64.8 | -45.3 | 175.9 | -173.2 | -177.5 | 179.1 | 0 | 0 | 111.7 | I17 F23 A24 K25 | I17-E21 WeakPolarHBondContact O-CB 2.94Å; I17-E21 PolarHBondContact O-N 2.69Å; E21-F23 VanDerWaalsContact C-N 3.29Å; E21-F23 PolarHBondContact O-N 3.41Å; E21-A24 PolarHBondContact O-N 3.5Å; E21-K25 WeakPolarHBondContact O-CB 3.49Å; E21-K25 PolarHBondContact O-N 3.25Å |
| 22 | N | 84.6 | Confident | 76.1 | Confident | 89 Ų | 89 | 129.2 Ų | 129.2 | 48% | 0.476 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -60.9 | -38.8 | 174.9 | -80.1 | -48 | 0 | 0 | 0 | 112.2 | Q18 A19 K25 K26 | Q18-N22 WeakPolarHBondContact O-CB 3.36Å; Q18-N22 VanDerWaalsContact O-CG 3.32Å; Q18-N22 PolarHBondContact O-N 3.28Å; Q18-N22 PolarHBondContact O-ND2 3.36Å; A19-N22 PolarHBondContact O-N 3.21Å; N22-K25 PolarHBondContact O-N 3.49Å; N22-K26 WeakPolarHBondContact O-CG 3.13Å; N22-K26 PolarHBondContact O-N 2.97Å |
| 23 | F | 83.1 | Confident | 75.4 | Confident | 143 Ų | 143 | 130.3 Ų | 130.3 | 63% | 0.627 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -64.8 | -47.3 | 174.6 | 178.7 | -96.8 | 0 | 0 | 0 | 111.6 | A19 Q20 E21 K25 K26 F27 | A19-F23 WeakPolarHBondContact O-CB 3.46Å; A19-F23 PolarHBondContact O-N 3.04Å; Q20-F23 PolarHBondContact O-N 3.3Å; E21-F23 VanDerWaalsContact C-N 3.29Å; E21-F23 PolarHBondContact O-N 3.41Å; F23-K25 VanDerWaalsContact C-N 3.27Å; F23-K25 PolarHBondContact O-N 3.33Å; F23-K26 PolarHBondContact O-N 3.33Å; F23-F27 PolarHBondContact O-N 3.39Å |
| 24 | A | 79.2 | Confident | 74.6 | Confident | 58 Ų | 58 | 130.9 Ų | 130.9 | 48% | 0.479 | 63% | 0.632 | S | S | . | * | H | α-helix | trans | -60.7 | -36.6 | 178 | 0 | 0 | 0 | 0 | 0 | 112.2 | Q20 E21 K26 F27 | Q20-A24 WeakPolarHBondContact O-CB 3.43Å; Q20-A24 PolarHBondContact O-N 3.05Å; E21-A24 PolarHBondContact O-N 3.5Å; A24-K26 VanDerWaalsContact C-N 3.26Å; A24-K26 PolarHBondContact O-N 2.93Å; A24-F27 PolarHBondContact O-N 3.26Å |
| 25 | K | 76.2 | Confident | 73.5 | Confident | 165 Ų | 165 | 130 Ų | 130 | 72% | 0.717 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -65 | -27.7 | 175.3 | -173.4 | 174.5 | -179.4 | 177.3 | 0 | 113.4 | E21 N22 F23 | E21-K25 WeakPolarHBondContact O-CB 3.49Å; E21-K25 PolarHBondContact O-N 3.25Å; N22-K25 PolarHBondContact O-N 3.49Å; F23-K25 VanDerWaalsContact C-N 3.27Å; F23-K25 PolarHBondContact O-N 3.33Å |
| 26 | K | 82.7 | Confident | 72.7 | Confident | 179 Ų | 179 | 127 Ų | 127 | 78% | 0.778 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -88.2 | -13 | 179.3 | -66.1 | -67.7 | 179.8 | 179.2 | 0 | 113 | N22 F23 A24 | N22-K26 WeakPolarHBondContact O-CG 3.13Å; N22-K26 PolarHBondContact O-N 2.97Å; F23-K26 PolarHBondContact O-N 3.33Å; A24-K26 VanDerWaalsContact C-N 3.26Å; A24-K26 PolarHBondContact O-N 2.93Å |
| 27 | F | 74.4 | Confident | 71.8 | Confident | 97 Ų | 97 | 123.4 Ų | 123.4 | 43% | 0.425 | 63% | 0.634 | S | S | . | * | S | Bend | trans | -74.1 | 127.1 | 179.1 | -153.9 | -107.3 | 0 | 0 | 0 | 110 | F23 A24 Y29 | F23-F27 PolarHBondContact O-N 3.39Å; A24-F27 PolarHBondContact O-N 3.26Å; F27-Y29 HydrophobicContact CD1-CD2 4.08Å; F27-Y29 AromaticContact CE1-CD2 3.6Å; F27-Y29 HydrophobicContact CE1-CD2 3.6Å; F27-Y29 HydrophobicContact CE1-CG 4.26Å; F27-Y29 HydrophobicContact CZ-CD2 4.31Å; F27-Y29 PolarHBondContact O-N 2.89Å |
| 28 | P | 79.1 | Confident | 70.9 | Confident | 112 Ų | 112 | 124.4 Ų | 124.4 | 73% | 0.727 | 64% | 0.641 | S | S | * | * | S | Bend | trans | -60.6 | -17.5 | -177 | -24.3 | 33.3 | 0 | 0 | 0 | 114.5 | ||
| 29 | Y | 65.4 | Low | 69.6 | Low | 178 Ų | 178 | 122.8 Ų | 122.8 | 70% | 0.698 | 64% | 0.64 | S | S | * | * | S | Bend | trans | -105.9 | 101 | 176.6 | -56.1 | -82 | 0 | 0 | 0 | 108.9 | F27 F31 | F27-Y29 HydrophobicContact CD1-CD2 4.08Å; F27-Y29 AromaticContact CE1-CD2 3.6Å; F27-Y29 HydrophobicContact CE1-CD2 3.6Å; F27-Y29 HydrophobicContact CE1-CG 4.26Å; F27-Y29 HydrophobicContact CZ-CD2 4.31Å; F27-Y29 PolarHBondContact O-N 2.89Å; Y29-F31 PolarHBondContact O-N 3.36Å |
| 30 | R | 63.7 | Low | 68.7 | Low | 201 Ų | 201 | 127.6 Ų | 127.6 | 76% | 0.758 | 66% | 0.655 | S | S | * | * | trans | -71.2 | 119.6 | 176.4 | -65.7 | -175.7 | 179.4 | 179.3 | 2.3 | 108.4 | S32 | R30-S32 PolarHBondContact O-N 2.92Å; R30-S32 PolarHBondContact O-OG 2.99Å | ||
| 31 | F | 57.8 | Low | 67.6 | Low | 154 Ų | 154 | 125.5 Ų | 125.5 | 68% | 0.675 | 65% | 0.653 | S | S | * | * | trans | -67.3 | 35.2 | 164.5 | -83.7 | -78.8 | 0 | 0 | 0 | 112.1 | Y29 G33 L34 | Y29-F31 PolarHBondContact O-N 3.36Å; F31-G33 PolarHBondContact O-N 3.24Å; F31-L34 HydrophobicContact CB-CD1 4.4Å; F31-L34 HydrophobicContact CD1-CB 4.43Å; F31-L34 HydrophobicContact CD1-CD1 3.19Å; F31-L34 HydrophobicContact CD1-CG 3.75Å; F31-L34 HydrophobicContact CE1-CD1 3.55Å; F31-L34 HydrophobicContact CE1-CG 4.36Å; F31-L34 HydrophobicContact CG-CD1 4.05Å; F31-L34 PolarHBondContact O-N 3.39Å | ||
| 32 | S | 56.5 | Low | 66.6 | Low | 100 Ų | 100 | 125.8 Ų | 125.8 | 70% | 0.699 | 66% | 0.658 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.5 | 3.3 | 177.6 | 45.9 | 0 | 0 | 0 | 0 | 113.7 | R30 | R30-S32 PolarHBondContact O-N 2.92Å; R30-S32 PolarHBondContact O-OG 2.99Å |
| 33 | G | 53.5 | Low | 65.5 | Low | 63 Ų | 63 | 125.3 Ų | 125.3 | 65% | 0.649 | 65% | 0.653 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -109.4 | 0.6 | 169.8 | 0 | 0 | 0 | 0 | 0 | 114.8 | F31 | F31-G33 PolarHBondContact O-N 3.24Š|
| 34 | L | 56.9 | Low | 64.4 | Low | 133 Ų | 133 | 123.5 Ų | 123.5 | 70% | 0.696 | 66% | 0.656 | S | S | * | * | S | Bend | trans | -90.6 | -10.1 | 171.4 | -85.8 | -179.1 | 0 | 0 | 0 | 113.1 | F31 E36 | F31-L34 HydrophobicContact CB-CD1 4.4Å; F31-L34 HydrophobicContact CD1-CB 4.43Å; F31-L34 HydrophobicContact CD1-CD1 3.19Å; F31-L34 HydrophobicContact CD1-CG 3.75Å; F31-L34 HydrophobicContact CE1-CD1 3.55Å; F31-L34 HydrophobicContact CE1-CG 4.36Å; F31-L34 HydrophobicContact CG-CD1 4.05Å; F31-L34 PolarHBondContact O-N 3.39Å; L34-E36 PolarHBondContact O-N 3.24Å |
| 35 | T | 53 | Low | 63.3 | Low | 128 Ų | 128 | 128.4 Ų | 128.4 | 79% | 0.785 | 66% | 0.662 | S | S | * | * | trans | -95.1 | 57.1 | 164.1 | -42.3 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 36 | E | 59.8 | Low | 62.3 | Low | 130 Ų | 130 | 125.7 Ų | 125.7 | 61% | 0.607 | 65% | 0.652 | S | S | * | * | trans | -75 | 134.4 | 160.8 | -134.9 | -157.7 | 174.4 | 0 | 0 | 107.1 | L34 D38 P39 | L34-E36 PolarHBondContact O-N 3.24Å; E36-D38 PolarHBondContact O-N 2.98Å; E36-P39 WeakPolarHBondContact OE2-CG 3.33Å | ||
| 37 | P | 63.2 | Low | 61 | Low | 113 Ų | 113 | 122.2 Ų | 122.2 | 73% | 0.734 | 65% | 0.645 | S | S | * | * | trans | -58.5 | 123.9 | 162.8 | 26 | -32.5 | 0 | 0 | 0 | 107.6 | P39 | P37-P39 VanDerWaalsContact O-CD 3.28Å; P37-P39 WeakPolarHBondContact O-CD 3.47Å | ||
| 38 | D | 62.3 | Low | 59.9 | Low | 133 Ų | 133 | 121.4 Ų | 121.4 | 71% | 0.711 | 65% | 0.648 | S | S | * | * | trans | -14.9 | 98.6 | 173 | -172.7 | 33.6 | 0 | 0 | 0 | 113.8 | E36 E40 | E36-D38 PolarHBondContact O-N 2.98Å; D38-E40 PolarHBondContact O-N 2.9Å | ||
| 39 | P | 59.4 | Low | 58.8 | Low | 81 Ų | 81 | 124.7 Ų | 124.7 | 53% | 0.526 | 65% | 0.651 | S | S | . | * | trans | -70.7 | 109.2 | 152.6 | 30.4 | -28.5 | 0 | 0 | 0 | 104.4 | E36 P37 | E36-P39 WeakPolarHBondContact OE2-CG 3.33Å; P37-P39 VanDerWaalsContact O-CD 3.28Å; P37-P39 WeakPolarHBondContact O-CD 3.47Å | ||
| 40 | E | 65.4 | Low | 58.4 | Low | 149 Ų | 149 | 121.6 Ų | 121.6 | 70% | 0.696 | 65% | 0.647 | S | S | * | * | trans | -22.7 | 124.9 | 164.5 | 179.5 | -177.4 | -163.9 | 0 | 0 | 109.6 | D38 L42 | D38-E40 PolarHBondContact O-N 2.9Å; E40-L42 PolarHBondContact O-N 2.84Å | ||
| 41 | P | 60.2 | Low | 58 | Low | 97 Ų | 97 | 118.4 Ų | 118.4 | 63% | 0.63 | 64% | 0.644 | S | S | * | * | trans | -66.6 | 84.6 | -169.7 | 26.1 | -34 | 0 | 0 | 0 | 109.5 | H43 | P41-H43 VanDerWaalsContact C-N 3.34Å; P41-H43 PolarHBondContact O-N 2.92Å | ||
| 42 | L | 62.8 | Low | 58 | Low | 139 Ų | 139 | 117.4 Ų | 117.4 | 73% | 0.728 | 65% | 0.646 | S | S | * | * | trans | -63.3 | 105.6 | 169 | -72.9 | 176.5 | 0 | 0 | 0 | 105 | E40 P44 | E40-L42 PolarHBondContact O-N 2.84Å; L42-P44 VanDerWaalsContact O-CD 3.32Å; L42-P44 WeakPolarHBondContact O-CD 3.5Å; L42-P44 VanDerWaalsContact O-N 3.13Å | ||
| 43 | H | 60 | Low | 58 | Low | 78 Ų | 78 | 118.5 Ų | 118.5 | 36% | 0.361 | 65% | 0.648 | S | S | . | * | trans | -52.3 | 120.1 | 179.7 | -78 | -40.3 | 0 | 0 | 0 | 109.1 | P41 W45 E46 | P41-H43 VanDerWaalsContact C-N 3.34Å; P41-H43 PolarHBondContact O-N 2.92Å; H43-W45 HydrophobicContact CB-CD2 3.69Å; H43-W45 HydrophobicContact CB-CE3 4.26Å; H43-W45 HydrophobicContact CB-CG 4.1Å; H43-W45 HydrophobicContact CB-CH2 4.22Å; H43-W45 HydrophobicContact CB-CZ2 3.66Å; H43-W45 HydrophobicContact CB-CZ3 4.48Å; H43-W45 AromaticContact CD2-CE2 3.96Å; H43-W45 AromaticContact CD2-CZ2 3.71Å; H43-W45 AromaticContact CD2-NE1 3.88Å; H43-W45 AromaticContact CE1-CH2 3.68Å; H43-W45 AromaticContact CE1-CZ2 3.36Å; H43-W45 WeakPolarHBondContact CE1-CZ2 3.33Å; H43-W45 AromaticContact CG-CE2 3.37Å; H43-W45 AromaticContact CG-CH2 3.78Å; H43-W45 AromaticContact CG-CZ2 3.16Å; H43-W45 AromaticContact CG-NE1 3.6Å; H43-W45 AromaticContact ND1-CE2 3.66Å; H43-W45 AromaticContact ND1-CH2 3.13Å; H43-W45 WeakPolarHBondContact ND1-CH2 3.42Å; H43-W45 AromaticContact ND1-CZ2 2.94Å; H43-W45 WeakPolarHBondContact ND1-CZ2 3.36Å; H43-W45 AromaticContact ND1-CZ3 3.99Å; H43-W45 AromaticContact NE2-CZ2 3.79Å; H43-W45 PolarHBondContact O-N 3.22Å; H43-E46 IonicContact CD2-OE2 4Å; H43-E46 PolarHBondContact O-N 3.06Å | ||
| 44 | P | 60.1 | Low | 58.2 | Low | 106 Ų | 106 | 121.3 Ų | 121.3 | 69% | 0.688 | 65% | 0.652 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.6 | -21.8 | -178.4 | -27.4 | 34.1 | 0 | 0 | 0 | 113.4 | L42 | L42-P44 VanDerWaalsContact O-CD 3.32Å; L42-P44 WeakPolarHBondContact O-CD 3.5Å; L42-P44 VanDerWaalsContact O-N 3.13Å |
| 45 | W | 57.8 | Low | 58.4 | Low | 161 Ų | 161 | 120.2 Ų | 120.2 | 61% | 0.61 | 64% | 0.644 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.6 | -14.8 | 177.7 | 54.2 | 83.3 | 0 | 0 | 0 | 114.8 | H43 V47 T48 | H43-W45 HydrophobicContact CB-CD2 3.69Å; H43-W45 HydrophobicContact CB-CE3 4.26Å; H43-W45 HydrophobicContact CB-CG 4.1Å; H43-W45 HydrophobicContact CB-CH2 4.22Å; H43-W45 HydrophobicContact CB-CZ2 3.66Å; H43-W45 HydrophobicContact CB-CZ3 4.48Å; H43-W45 AromaticContact CD2-CE2 3.96Å; H43-W45 AromaticContact CD2-CZ2 3.71Å; H43-W45 AromaticContact CD2-NE1 3.88Å; H43-W45 AromaticContact CE1-CH2 3.68Å; H43-W45 AromaticContact CE1-CZ2 3.36Å; H43-W45 WeakPolarHBondContact CE1-CZ2 3.33Å; H43-W45 AromaticContact CG-CE2 3.37Å; H43-W45 AromaticContact CG-CH2 3.78Å; H43-W45 AromaticContact CG-CZ2 3.16Å; H43-W45 AromaticContact CG-NE1 3.6Å; H43-W45 AromaticContact ND1-CE2 3.66Å; H43-W45 AromaticContact ND1-CH2 3.13Å; H43-W45 WeakPolarHBondContact ND1-CH2 3.42Å; H43-W45 AromaticContact ND1-CZ2 2.94Å; H43-W45 WeakPolarHBondContact ND1-CZ2 3.36Å; H43-W45 AromaticContact ND1-CZ3 3.99Å; H43-W45 AromaticContact NE2-CZ2 3.79Å; H43-W45 PolarHBondContact O-N 3.22Å; W45-V47 VanDerWaalsContact C-N 3.29Å; W45-V47 PolarHBondContact O-N 3.4Å; W45-T48 VanDerWaalsContact C-OG1 3.29Å; W45-T48 WeakPolarHBondContact CA-OG1 3.43Å; W45-T48 WeakPolarHBondContact O-CB 3.48Å; W45-T48 PolarHBondContact O-N 3.33Å; W45-T48 PolarHBondContact O-OG1 3.4Å |
| 46 | E | 54.7 | Low | 58.9 | Low | 108 Ų | 108 | 119 Ų | 119 | 51% | 0.505 | 63% | 0.632 | S | S | . | * | G | 310 helix | trans | -75.5 | -17.6 | 177.2 | -94.9 | 167 | 161 | 0 | 0 | 113.6 | H43 T48 | H43-E46 IonicContact CD2-OE2 4Å; H43-E46 PolarHBondContact O-N 3.06Å; E46-T48 PolarHBondContact O-N 3.09Å |
| 47 | V | 56 | Low | 58.9 | Low | 106 Ų | 106 | 118.2 Ų | 118.2 | 64% | 0.642 | 64% | 0.638 | S | S | * | * | G | 310 helix | trans | -78.6 | -5.5 | 172.8 | -171.2 | 0 | 0 | 0 | 0 | 112 | W45 K49 N50 | W45-V47 VanDerWaalsContact C-N 3.29Å; W45-V47 PolarHBondContact O-N 3.4Å; V47-K49 VanDerWaalsContact C-N 3.28Å; V47-K49 PolarHBondContact O-N 3.45Å; V47-N50 PolarHBondContact O-OD1 3.36Å |
| 48 | T | 51.4 | Low | 58.7 | Low | 79 Ų | 79 | 119.8 Ų | 119.8 | 49% | 0.485 | 64% | 0.64 | S | S | . | * | G | 310 helix | trans | -86.2 | 12.4 | -175.1 | -22.7 | 0 | 0 | 0 | 0 | 113.7 | W45 E46 L51 | W45-T48 VanDerWaalsContact C-OG1 3.29Å; W45-T48 WeakPolarHBondContact CA-OG1 3.43Å; W45-T48 WeakPolarHBondContact O-CB 3.48Å; W45-T48 PolarHBondContact O-N 3.33Å; W45-T48 PolarHBondContact O-OG1 3.4Å; E46-T48 PolarHBondContact O-N 3.09Å; T48-L51 HydrophobicContact CG2-CD1 3.61Å |
| 49 | K | 54.2 | Low | 58.6 | Low | 181 Ų | 181 | 119.3 Ų | 119.3 | 79% | 0.787 | 63% | 0.633 | S | S | * | * | G | 310 helix | trans | -92.1 | -1.5 | 179.9 | -65.5 | -170.3 | -177.8 | 174.5 | 0 | 113.8 | V47 | V47-K49 VanDerWaalsContact C-N 3.28Å; V47-K49 PolarHBondContact O-N 3.45Å |
| 50 | N | 57.8 | Low | 58.6 | Low | 114 Ų | 114 | 122.2 Ų | 122.2 | 61% | 0.61 | 64% | 0.638 | S | S | * | * | trans | -136.9 | 30 | -175.3 | 43.4 | -58.2 | 0 | 0 | 0 | 112.7 | V47 N52 | V47-N50 PolarHBondContact O-OD1 3.36Å; N50-N52 PolarHBondContact O-N 3.09Å | ||
| 51 | L | 55.6 | Low | 58.4 | Low | 134 Ų | 134 | 126 Ų | 126 | 70% | 0.702 | 65% | 0.646 | S | S | * | * | trans | -75.2 | 55.1 | 160 | -86.7 | 151.3 | 0 | 0 | 0 | 110.2 | T48 T53 | T48-L51 HydrophobicContact CG2-CD1 3.61Å; L51-T53 PolarHBondContact O-N 3.25Å | ||
| 52 | N | 56.8 | Low | 58.6 | Low | 133 Ų | 133 | 128 Ų | 128 | 71% | 0.711 | 65% | 0.65 | S | S | * | * | trans | -69.6 | 95.2 | 156.8 | -73.5 | -26.2 | 0 | 0 | 0 | 106 | N50 V54 | N50-N52 PolarHBondContact O-N 3.09Å; N52-V54 PolarHBondContact O-N 3.15Å | ||
| 53 | T | 58 | Low | 58.9 | Low | 122 Ų | 122 | 126.9 Ų | 126.9 | 75% | 0.748 | 65% | 0.649 | S | S | * | * | trans | 36.1 | 63.2 | 143.7 | 36.9 | 0 | 0 | 0 | 0 | 114.5 | L51 E55 | L51-T53 PolarHBondContact O-N 3.25Å; T53-E55 PolarHBondContact O-N 3.04Å | ||
| 54 | V | 56.5 | Low | 59.5 | Low | 122 Ų | 122 | 128.3 Ų | 128.3 | 74% | 0.739 | 67% | 0.665 | S | S | * | * | trans | -72.5 | 81.5 | 158.1 | -179.4 | 0 | 0 | 0 | 0 | 105.9 | N52 L56 | N52-V54 PolarHBondContact O-N 3.15Å; V54-L56 PolarHBondContact O-N 3.18Å; V54-L56 VanDerWaalsContact O-N 3.09Å | ||
| 55 | E | 62.1 | Low | 60 | Low | 110 Ų | 110 | 129.5 Ų | 129.5 | 51% | 0.514 | 67% | 0.671 | S | S | . | * | trans | -56.4 | 113.5 | 167.1 | -80.3 | -175 | 136.5 | 0 | 0 | 107.4 | T53 K60 | T53-E55 PolarHBondContact O-N 3.04Å; E55-K60 WeakPolarHBondContact OE2-CE 3.41Å; E55-K60 IonicContact OE2-NZ 2.78Å; E55-K60 PolarHBondContact OE2-NZ 3.23Å | ||
| 56 | L | 62.7 | Low | 60.8 | Low | 102 Ų | 102 | 131.8 Ų | 131.8 | 53% | 0.534 | 68% | 0.679 | S | S | . | * | trans | -60.4 | 133.3 | 174.9 | -68.3 | 171.3 | 0 | 0 | 0 | 107.7 | V54 L58 Q59 | V54-L56 PolarHBondContact O-N 3.18Å; V54-L56 VanDerWaalsContact O-N 3.09Å; L56-L58 PolarHBondContact O-N 3.42Å; L56-Q59 HydrophobicContact CB-CG 4.34Å; L56-Q59 PolarHBondContact O-N 3.27Å | ||
| 57 | P | 60.6 | Low | 61.7 | Low | 115 Ų | 115 | 131.6 Ų | 131.6 | 75% | 0.747 | 69% | 0.69 | S | S | * | * | G | 310 helix | trans | -52.4 | -23.9 | -177 | -26.7 | 32.2 | 0 | 0 | 0 | 114 | ||
| 58 | L | 57.9 | Low | 62.5 | Low | 146 Ų | 146 | 134 Ų | 134 | 76% | 0.764 | 70% | 0.698 | S | S | * | * | G | 310 helix | trans | -76.3 | -15.5 | -179.2 | -70.6 | 164.1 | 0 | 0 | 0 | 114.5 | L56 | L56-L58 PolarHBondContact O-N 3.42Š|
| 59 | Q | 60.8 | Low | 63.1 | Low | 123 Ų | 123 | 135.7 Ų | 135.7 | 58% | 0.575 | 71% | 0.71 | S | S | * | * | G | 310 helix | trans | -83.4 | -12.4 | -176.6 | -68.8 | 177.5 | -36.4 | 0 | 0 | 113.4 | L56 | L56-Q59 HydrophobicContact CB-CG 4.34Å; L56-Q59 PolarHBondContact O-N 3.27Å |
| 60 | K | 59.6 | Low | 63.5 | Low | 142 Ų | 142 | 133 Ų | 133 | 62% | 0.617 | 71% | 0.708 | S | S | * | * | G | 310 helix | trans | -83.4 | -9 | -174.4 | -63.9 | -169.9 | 177.1 | -168.9 | 0 | 115.4 | E55 | E55-K60 WeakPolarHBondContact OE2-CE 3.41Å; E55-K60 IonicContact OE2-NZ 2.78Å; E55-K60 PolarHBondContact OE2-NZ 3.23Å |
| 61 | R | 60.8 | Low | 63.8 | Low | 229 Ų | 229 | 139.6 Ų | 139.6 | 86% | 0.864 | 72% | 0.724 | S | S | * | * | S | Bend | trans | -130.1 | 10.8 | -174.8 | -58.9 | -176.5 | 93.1 | 178.8 | 7.6 | 114.4 | V63 | R61-V63 PolarHBondContact O-N 3.43Å; R61-V63 VanDerWaalsContact O-N 3.11Å |
| 62 | L | 63.6 | Low | 64.1 | Low | 137 Ų | 137 | 136.8 Ų | 136.8 | 72% | 0.717 | 73% | 0.728 | S | S | * | * | trans | -79.7 | 96.9 | 173 | -64.5 | 178.1 | 0 | 0 | 0 | 108.6 | P64 | L62-P64 WeakPolarHBondContact O-CD 3.45Š| ||
| 63 | V | 71 | Confident | 64.1 | Low | 116 Ų | 116 | 138.5 Ų | 138.5 | 70% | 0.703 | 74% | 0.736 | S | S | * | * | trans | -64.5 | 128.1 | 162.3 | -179.3 | 0 | 0 | 0 | 0 | 106.6 | R61 T65 | R61-V63 PolarHBondContact O-N 3.43Å; R61-V63 VanDerWaalsContact O-N 3.11Å; V63-T65 PolarHBondContact O-N 3.15Å | ||
| 64 | P | 71.8 | Confident | 63.9 | Low | 109 Ų | 109 | 136.4 Ų | 136.4 | 71% | 0.708 | 74% | 0.739 | S | S | * | * | trans | -56.3 | 102.1 | 169.6 | -22.7 | 33.4 | 0 | 0 | 0 | 108.3 | L62 R66 | L62-P64 WeakPolarHBondContact O-CD 3.45Å; P64-R66 PolarHBondContact O-N 3.32Å; P64-R66 VanDerWaalsContact O-N 3.08Å | ||
| 65 | T | 70.9 | Confident | 63.7 | Low | 131 Ų | 131 | 134.5 Ų | 134.5 | 80% | 0.804 | 74% | 0.736 | S | S | * | * | S | Bend | trans | -67.2 | -9.3 | 179.4 | 38 | 0 | 0 | 0 | 0 | 112.1 | V63 | V63-T65 PolarHBondContact O-N 3.15Š|
| 66 | R | 73.8 | Confident | 63.2 | Low | 208 Ų | 208 | 134.3 Ų | 134.3 | 79% | 0.785 | 75% | 0.747 | S | S | * | * | S | Bend | trans | -163.7 | 133.7 | 174 | 44.9 | -170.3 | 161.1 | -136.7 | -3.2 | 108.3 | P64 I68 | P64-R66 PolarHBondContact O-N 3.32Å; P64-R66 VanDerWaalsContact O-N 3.08Å; R66-I68 PolarHBondContact O-N 2.97Å |
| 67 | S | 73.7 | Confident | 62.7 | Low | 105 Ų | 105 | 136.4 Ų | 136.4 | 73% | 0.734 | 76% | 0.759 | S | S | * | * | P | Polyproline II helix | trans | -62 | 130.1 | 167.4 | 52.1 | 0 | 0 | 0 | 0 | 108.8 | P69 | S67-P69 WeakPolarHBondContact O-CD 3.35Š|
| 68 | I | 72.7 | Confident | 62.1 | Low | 156 Ų | 156 | 140 Ų | 140 | 80% | 0.8 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -65.5 | 121.8 | 167 | -59.9 | 171 | 0 | 0 | 0 | 105.9 | R66 V70 | R66-I68 PolarHBondContact O-N 2.97Å; I68-V70 PolarHBondContact O-N 3.41Å |
| 69 | P | 64.8 | Low | 61.7 | Low | 114 Ų | 114 | 140.3 Ų | 140.3 | 74% | 0.74 | 76% | 0.764 | S | S | * | * | P | Polyproline II helix | trans | -60.7 | 130.4 | -179.4 | 23.6 | -31.9 | 0 | 0 | 0 | 109.2 | S67 R71 | S67-P69 WeakPolarHBondContact O-CD 3.35Å; P69-R71 PolarHBondContact O-N 2.99Å |
| 70 | V | 62.8 | Low | 61 | Low | 124 Ų | 124 | 138.9 Ų | 138.9 | 75% | 0.752 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -60.2 | 122.3 | 175.5 | 176.9 | 0 | 0 | 0 | 0 | 107.6 | I68 G72 | I68-V70 PolarHBondContact O-N 3.41Å; V70-G72 PolarHBondContact O-N 2.9Å |
| 71 | R | 62.6 | Low | 60.4 | Low | 253 Ų | 253 | 138 Ų | 138 | 96% | 0.955 | 78% | 0.776 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.8 | 103.7 | 174.8 | -177.7 | -177.4 | -100.7 | -177.6 | -6.6 | 108 | P69 | P69-R71 PolarHBondContact O-N 2.99Š|
| 72 | G | 63.7 | Low | 59.9 | Low | 75 Ų | 75 | 132.3 Ų | 132.3 | 77% | 0.773 | 77% | 0.772 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 131.4 | 1.2 | 169.6 | 0 | 0 | 0 | 0 | 0 | 117.9 | V70 | V70-G72 PolarHBondContact O-N 2.9Š|
| 73 | L | 56.2 | Low | 59.3 | Low | 169 Ų | 169 | 131 Ų | 131 | 89% | 0.885 | 77% | 0.774 | S | S | * | * | S | Bend | trans | -132.8 | 88.6 | 176.5 | -150.4 | 72.9 | 0 | 0 | 0 | 110.2 | ||
| 74 | G | 53.9 | Low | 58.2 | Low | 78 Ų | 78 | 130.8 Ų | 130.8 | 80% | 0.804 | 78% | 0.777 | S | S | * | * | trans | 122.9 | 37.7 | -178.6 | 0 | 0 | 0 | 0 | 0 | 114.6 | S76 | G74-S76 PolarHBondContact O-N 2.88Š| ||
| 75 | A | 52.1 | Low | 57.4 | Low | 83 Ų | 83 | 131 Ų | 131 | 69% | 0.686 | 78% | 0.78 | S | S | * | * | trans | -65.9 | 104.1 | 163.8 | 0 | 0 | 0 | 0 | 0 | 107.6 | D77 | A75-D77 PolarHBondContact O-N 2.88Š| ||
| 76 | S | 51.4 | Low | 56.2 | Low | 105 Ų | 105 | 130 Ų | 130 | 73% | 0.734 | 78% | 0.776 | S | S | * | * | trans | -50 | 127 | 160.7 | -178.7 | 0 | 0 | 0 | 0 | 107 | G74 F78 | G74-S76 PolarHBondContact O-N 2.88Å; S76-F78 PolarHBondContact O-N 3.26Å | ||
| 77 | D | 52.3 | Low | 55.7 | Low | 147 Ų | 147 | 123.9 Ų | 123.9 | 79% | 0.786 | 77% | 0.77 | S | S | * | * | trans | -45.5 | 108.5 | -178.6 | -63.6 | -54.1 | 0 | 0 | 0 | 109.5 | A75 I79 | A75-D77 PolarHBondContact O-N 2.88Å; D77-I79 PolarHBondContact O-N 2.8Å | ||
| 78 | F | 47.2 | Very low | 55 | Low | 189 Ų | 189 | 125.1 Ų | 125.1 | 83% | 0.829 | 78% | 0.775 | S | S | * | * | trans | -62.7 | 93.1 | 167.2 | -90.5 | -97.5 | 0 | 0 | 0 | 106 | S76 S80 | S76-F78 PolarHBondContact O-N 3.26Å; F78-S80 PolarHBondContact O-N 3.27Å | ||
| 79 | I | 50.1 | Low | 54.5 | Low | 154 Ų | 154 | 124.9 Ų | 124.9 | 79% | 0.79 | 78% | 0.775 | S | S | * | * | trans | -61.5 | 96 | 153.7 | -61 | 178.7 | 0 | 0 | 0 | 104.2 | D77 P81 | D77-I79 PolarHBondContact O-N 2.8Å; I79-P81 WeakPolarHBondContact O-CD 3.45Å | ||
| 80 | S | 46.8 | Very low | 54.6 | Low | 93 Ų | 93 | 125 Ų | 125 | 65% | 0.65 | 78% | 0.776 | S | S | * | * | trans | -54.3 | 114.4 | 163.5 | -66.2 | 0 | 0 | 0 | 0 | 107.2 | F78 S82 | F78-S80 PolarHBondContact O-N 3.27Å; S80-S82 PolarHBondContact O-N 3.46Å | ||
| 81 | P | 46 | Very low | 54.8 | Low | 124 Ų | 124 | 123.1 Ų | 123.1 | 81% | 0.805 | 77% | 0.773 | S | S | * | * | trans | -76.2 | 86.2 | 158.5 | 29.2 | -19.3 | 0 | 0 | 0 | 105.2 | I79 S83 | I79-P81 WeakPolarHBondContact O-CD 3.45Å; P81-S83 PolarHBondContact O-N 3.05Å | ||
| 82 | S | 51.3 | Low | 55.1 | Low | 109 Ų | 109 | 116.4 Ų | 116.4 | 76% | 0.762 | 76% | 0.762 | S | S | * | * | trans | -56.9 | 132.4 | 158.1 | -173.9 | 0 | 0 | 0 | 0 | 107.6 | S80 | S80-S82 PolarHBondContact O-N 3.46Š| ||
| 83 | S | 50.9 | Low | 55 | Low | 110 Ų | 110 | 124 Ų | 124 | 77% | 0.769 | 77% | 0.768 | S | S | * | * | trans | 63.4 | 74.8 | 155.1 | 179.3 | 0 | 0 | 0 | 0 | 116.6 | P81 | P81-S83 PolarHBondContact O-N 3.05Š| ||
| 84 | S | 47.9 | Very low | 55.4 | Low | 110 Ų | 110 | 120.8 Ų | 120.8 | 77% | 0.769 | 76% | 0.757 | S | S | * | * | trans | -144.3 | 110.2 | 135 | -174.2 | 0 | 0 | 0 | 0 | 107.8 | P86 | S84-P86 WeakPolarHBondContact O-CD 3.43Å; S84-P86 VanDerWaalsContact O-N 3.15Å | ||
| 85 | C | 54.1 | Low | 56 | Low | 115 Ų | 115 | 120.7 Ų | 120.7 | 78% | 0.777 | 74% | 0.742 | S | S | * | * | trans | -47.1 | 122.6 | 166.7 | -59.7 | 0 | 0 | 0 | 0 | 108.1 | A87 | C85-A87 PolarHBondContact O-N 3.31Š| ||
| 86 | P | 45.3 | Very low | 56.8 | Low | 108 Ų | 108 | 122.8 Ų | 122.8 | 70% | 0.701 | 75% | 0.749 | S | S | * | * | trans | -62.1 | 133.9 | 162.2 | 26.6 | -28.7 | 0 | 0 | 0 | 106 | S84 | S84-P86 WeakPolarHBondContact O-CD 3.43Å; S84-P86 VanDerWaalsContact O-N 3.15Å | ||
| 87 | A | 63 | Low | 57.4 | Low | 80 Ų | 80 | 126.1 Ų | 126.1 | 66% | 0.661 | 76% | 0.757 | S | S | * | * | trans | -43.5 | 145.4 | 167.8 | 0 | 0 | 0 | 0 | 0 | 109.6 | C85 L89 | C85-A87 PolarHBondContact O-N 3.31Å; A87-L89 PolarHBondContact O-N 3.32Å | ||
| 88 | P | 59.9 | Low | 57.9 | Low | 131 Ų | 131 | 121.4 Ų | 121.4 | 85% | 0.851 | 74% | 0.736 | S | S | * | * | trans | -54.1 | 111.3 | -177.6 | -19.7 | 29.7 | 0 | 0 | 0 | 108.7 | ||||
| 89 | L | 62.3 | Low | 59.3 | Low | 151 Ų | 151 | 117.3 Ų | 117.3 | 79% | 0.791 | 72% | 0.722 | S | S | * | * | P | Polyproline II helix | trans | -55.1 | 130.6 | 173.4 | -73.8 | 166 | 0 | 0 | 0 | 106.6 | A87 A91 | A87-L89 PolarHBondContact O-N 3.32Å; L89-A91 PolarHBondContact O-N 2.77Å; L89-A91 VanDerWaalsContact O-N 3.1Å |
| 90 | P | 67.4 | Low | 60.7 | Low | 118 Ų | 118 | 117 Ų | 117 | 77% | 0.766 | 72% | 0.721 | S | S | * | * | P | Polyproline II helix | trans | -55.9 | 125.5 | 176.8 | 20.5 | -29.2 | 0 | 0 | 0 | 107.8 | ||
| 91 | A | 67.3 | Low | 62.3 | Low | 84 Ų | 84 | 122 Ų | 122 | 69% | 0.694 | 73% | 0.726 | S | S | * | * | P | Polyproline II helix | trans | -49.3 | 134.1 | -179.8 | 0 | 0 | 0 | 0 | 0 | 109.1 | L89 R93 | L89-A91 PolarHBondContact O-N 2.77Å; L89-A91 VanDerWaalsContact O-N 3.1Å; A91-R93 PolarHBondContact O-N 3.36Å; A91-R93 VanDerWaalsContact O-N 3.1Å |
| 92 | P | 67.6 | Low | 64.1 | Low | 111 Ų | 111 | 120.6 Ų | 120.6 | 72% | 0.721 | 71% | 0.709 | S | S | * | * | P | Polyproline II helix | trans | -56.3 | 123.7 | 179.6 | 21.2 | -30.2 | 0 | 0 | 0 | 108.4 | ||
| 93 | R | 61.8 | Low | 65.5 | Low | 235 Ų | 235 | 118.3 Ų | 118.3 | 89% | 0.887 | 69% | 0.687 | S | S | * | * | P | Polyproline II helix | trans | -54.3 | 132.1 | 176.7 | -82 | -178.2 | -111.9 | -163.7 | -3.7 | 108.2 | A91 | A91-R93 PolarHBondContact O-N 3.36Å; A91-R93 VanDerWaalsContact O-N 3.1Å |
| 94 | P | 64.1 | Low | 67.1 | Low | 101 Ų | 101 | 117.8 Ų | 117.8 | 66% | 0.656 | 67% | 0.672 | S | S | * | * | P | Polyproline II helix | trans | -58 | 135.4 | 177.1 | 23.5 | -31.3 | 0 | 0 | 0 | 108.5 | ||
| 95 | P | 66.1 | Low | 68.9 | Low | 77 Ų | 77 | 116.6 Ų | 116.6 | 50% | 0.5 | 66% | 0.656 | S | S | . | * | P | Polyproline II helix | trans | -59.3 | 146 | 179 | -12.5 | 24.1 | 0 | 0 | 0 | 109.5 | L97 | P95-L97 PolarHBondContact O-N 3.46Š|
| 96 | P | 69.3 | Low | 70.3 | Confident | 127 Ų | 127 | 115 Ų | 115 | 83% | 0.825 | 64% | 0.639 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.5 | 115.8 | 179.6 | 24.5 | -32 | 0 | 0 | 0 | 109.2 | C98 | P96-C98 PolarHBondContact O-N 2.88Š|
| 97 | L | 63.8 | Low | 72 | Confident | 174 Ų | 174 | 111.8 Ų | 111.8 | 91% | 0.911 | 62% | 0.619 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 36.5 | 74.1 | 171.1 | -65.9 | 166.1 | 0 | 0 | 0 | 114.2 | P95 N99 | P95-L97 PolarHBondContact O-N 3.46Å; L97-N99 PolarHBondContact O-N 3.48Å |
| 98 | C | 64 | Low | 72.8 | Confident | 49 Ų | 49 | 117.2 Ų | 117.2 | 33% | 0.331 | 62% | 0.623 | S | S | . | * | trans | -62.4 | 134.2 | 170.6 | -52 | 0 | 0 | 0 | 0 | 109.9 | P96 L100 | P96-C98 PolarHBondContact O-N 2.88Å; C98-L100 PolarHBondContact O-N 2.94Å | ||
| 99 | N | 75.4 | Confident | 74 | Confident | 102 Ų | 102 | 119 Ų | 119 | 55% | 0.545 | 61% | 0.612 | S | S | . | * | trans | -57.1 | 140.2 | 172 | -69.2 | -60.7 | 0 | 0 | 0 | 109.9 | L97 W101 E102 L103 | L97-N99 PolarHBondContact O-N 3.48Å; N99-W101 PolarHBondContact O-N 2.87Å; N99-E102 HydrophobicContact CB-CG 4.24Å; N99-E102 PolarHBondContact ND2-OE1 3.33Å; N99-E102 WeakPolarHBondContact O-CB 3.39Å; N99-E102 PolarHBondContact O-N 3.36Å; N99-L103 PolarHBondContact O-N 3.13Å | ||
| 100 | L | 80.8 | Confident | 75 | Confident | 147 Ų | 147 | 116.5 Ų | 116.5 | 77% | 0.77 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -54.3 | -29 | -179.3 | -70.9 | 172.2 | 0 | 0 | 0 | 113.1 | C98 K104 | C98-L100 PolarHBondContact O-N 2.94Å; L100-K104 WeakPolarHBondContact O-CB 3.47Å; L100-K104 PolarHBondContact O-N 3.22Å; L100-K104 VanDerWaalsContact O-N 3.13Å |
| 101 | W | 79.9 | Confident | 75.3 | Confident | 200 Ų | 200 | 115.4 Ų | 115.4 | 76% | 0.758 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -69.4 | -38.9 | 175.5 | -76.7 | 109.2 | 0 | 0 | 0 | 113.8 | N99 L103 K104 L105 | N99-W101 PolarHBondContact O-N 2.87Å; W101-L103 VanDerWaalsContact C-N 3.35Å; W101-K104 HydrophobicContact CE3-CD 4.41Å; W101-K104 HydrophobicContact CZ3-CD 4.3Å; W101-K104 PolarHBondContact O-N 3.39Å; W101-L105 PolarHBondContact O-N 3.48Å |
| 102 | E | 84.2 | Confident | 75.6 | Confident | 93 Ų | 93 | 121.9 Ų | 121.9 | 44% | 0.435 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -66.4 | -42.3 | 176.4 | -69.5 | 165.4 | -149.3 | 0 | 0 | 110.1 | N99 K104 L105 L106 | N99-E102 HydrophobicContact CB-CG 4.24Å; N99-E102 PolarHBondContact ND2-OE1 3.33Å; N99-E102 WeakPolarHBondContact O-CB 3.39Å; N99-E102 PolarHBondContact O-N 3.36Å; E102-K104 VanDerWaalsContact C-N 3.29Å; E102-K104 PolarHBondContact O-N 3.01Å; E102-L105 PolarHBondContact O-N 3.47Å; E102-L105 VanDerWaalsContact O-N 3.15Å; E102-L106 WeakPolarHBondContact O-CB 3.28Å; E102-L106 VanDerWaalsContact O-CG 3.28Å; E102-L106 WeakPolarHBondContact O-CG 3.43Å; E102-L106 PolarHBondContact O-N 2.81Å |
| 103 | L | 80.5 | Confident | 75.5 | Confident | 61 Ų | 61 | 122.2 Ų | 122.2 | 32% | 0.319 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -59.9 | -41.2 | 175.6 | -161 | 70 | 0 | 0 | 0 | 111.7 | N99 W101 L106 S107 L114 | N99-L103 PolarHBondContact O-N 3.13Å; W101-L103 VanDerWaalsContact C-N 3.35Å; L103-L106 PolarHBondContact O-N 2.83Å; L103-S107 WeakPolarHBondContact O-CB 3.34Å; L103-S107 PolarHBondContact O-N 3.28Å; L103-L114 HydrophobicContact CD1-CD1 3.56Å; L103-L114 HydrophobicContact CG-CD1 4.19Å |
| 104 | K | 83.4 | Confident | 75.6 | Confident | 100 Ų | 100 | 112 Ų | 112 | 44% | 0.435 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -69.8 | -30.9 | 177.2 | -171.4 | 175.1 | -179.7 | 176.6 | 0 | 113.1 | L100 W101 E102 S107 R108 | L100-K104 WeakPolarHBondContact O-CB 3.47Å; L100-K104 PolarHBondContact O-N 3.22Å; L100-K104 VanDerWaalsContact O-N 3.13Å; W101-K104 HydrophobicContact CE3-CD 4.41Å; W101-K104 HydrophobicContact CZ3-CD 4.3Å; W101-K104 PolarHBondContact O-N 3.39Å; E102-K104 VanDerWaalsContact C-N 3.29Å; E102-K104 PolarHBondContact O-N 3.01Å; K104-S107 PolarHBondContact O-OG 3.13Å; K104-R108 WeakPolarHBondContact O-CG 3.16Å; K104-R108 PolarHBondContact O-N 3.17Å |
| 105 | L | 86.9 | Confident | 75.6 | Confident | 84 Ų | 84 | 110.1 Ų | 110.1 | 44% | 0.44 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -73.6 | -43.8 | 175.1 | -173.9 | 65.4 | 0 | 0 | 0 | 110.8 | W101 E102 R108 R109 | W101-L105 PolarHBondContact O-N 3.48Å; E102-L105 PolarHBondContact O-N 3.47Å; E102-L105 VanDerWaalsContact O-N 3.15Å; L105-R108 PolarHBondContact O-N 3.09Å; L105-R109 WeakPolarHBondContact O-CG 3.48Å; L105-R109 PolarHBondContact O-N 3.49Å |
| 106 | L | 82.9 | Confident | 75.3 | Confident | 81 Ų | 81 | 114.6 Ų | 114.6 | 42% | 0.424 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -65.6 | -38.7 | 177.1 | -68.7 | 172.7 | 0 | 0 | 0 | 111.6 | E102 L103 R108 R109 F110 | E102-L106 WeakPolarHBondContact O-CB 3.28Å; E102-L106 VanDerWaalsContact O-CG 3.28Å; E102-L106 WeakPolarHBondContact O-CG 3.43Å; E102-L106 PolarHBondContact O-N 2.81Å; L103-L106 PolarHBondContact O-N 2.83Å; L106-R108 VanDerWaalsContact C-N 3.25Å; L106-R108 PolarHBondContact O-N 3.37Å; L106-R109 PolarHBondContact O-N 3.1Å; L106-F110 HydrophobicContact CD2-CD2 4.26Å; L106-F110 HydrophobicContact CD2-CE2 4.47Å; L106-F110 PolarHBondContact O-N 2.93Å |
| 107 | S | 81.1 | Confident | 74.9 | Confident | 41 Ų | 41 | 112.6 Ų | 112.6 | 29% | 0.287 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -59.9 | -36.9 | 175.8 | 77.2 | 0 | 0 | 0 | 0 | 112.8 | L103 K104 P111 | L103-S107 WeakPolarHBondContact O-CB 3.34Å; L103-S107 PolarHBondContact O-N 3.28Å; K104-S107 PolarHBondContact O-OG 3.13Å; S107-P111 WeakPolarHBondContact O-CA 3.5Å |
| 108 | R | 80.8 | Confident | 74.8 | Confident | 194 Ų | 194 | 110.4 Ų | 110.4 | 73% | 0.732 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -75.8 | -38.3 | 178.1 | -73.9 | -179 | 168.7 | -157.6 | -4.9 | 112.8 | K104 L105 L106 | K104-R108 WeakPolarHBondContact O-CG 3.16Å; K104-R108 PolarHBondContact O-N 3.17Å; L105-R108 PolarHBondContact O-N 3.09Å; L106-R108 VanDerWaalsContact C-N 3.25Å; L106-R108 PolarHBondContact O-N 3.37Å |
| 109 | R | 84.1 | Confident | 74.6 | Confident | 168 Ų | 168 | 112.4 Ų | 112.4 | 63% | 0.634 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -79 | -36 | -178.7 | -71 | -178.8 | 179.2 | -175.8 | 0.1 | 112.5 | L105 L106 | L105-R109 WeakPolarHBondContact O-CG 3.48Å; L105-R109 PolarHBondContact O-N 3.49Å; L106-R109 PolarHBondContact O-N 3.1Å |
| 110 | F | 82.8 | Confident | 73.2 | Confident | 99 Ų | 99 | 111 Ų | 111 | 43% | 0.434 | 54% | 0.542 | S | S | . | . | trans | -135.5 | 70.5 | -173.1 | -54.7 | -71.9 | 0 | 0 | 0 | 111.9 | L106 R112 Q113 | L106-F110 HydrophobicContact CD2-CD2 4.26Å; L106-F110 HydrophobicContact CD2-CE2 4.47Å; L106-F110 PolarHBondContact O-N 2.93Å; F110-R112 PolarHBondContact O-N 3.44Å; F110-R112 VanDerWaalsContact O-N 3.17Å; F110-Q113 HydrophobicContact CB-CB 4.02Å; F110-Q113 HydrophobicContact CB-CG 4.09Å; F110-Q113 PolarHBondContact O-N 3.3Å; F110-Q113 VanDerWaalsContact O-N 3.13Å | ||
| 111 | P | 74.9 | Confident | 71.6 | Confident | 95 Ų | 95 | 109.6 Ų | 109.6 | 62% | 0.617 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -60.8 | -30.6 | -174.1 | 20.5 | -31.6 | 0 | 0 | 0 | 113.7 | S107 | S107-P111 WeakPolarHBondContact O-CA 3.5Å |
| 112 | R | 72.1 | Confident | 69.9 | Low | 220 Ų | 220 | 108.5 Ų | 108.5 | 83% | 0.83 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -77.1 | -27.2 | 179.5 | -64.8 | -176.4 | -177 | -176.2 | 0.6 | 113.7 | F110 F116 | F110-R112 PolarHBondContact O-N 3.44Å; F110-R112 VanDerWaalsContact O-N 3.17Å; R112-F116 VanDerWaalsContact O-CD2 3.3Å; R112-F116 WeakPolarHBondContact O-CD2 3.3Å; R112-F116 WeakPolarHBondContact O-CE2 3.45Å |
| 113 | Q | 67 | Low | 68 | Low | 118 Ų | 118 | 110.2 Ų | 110.2 | 55% | 0.551 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -80.3 | -30 | -174.9 | -68 | 179.5 | -26.8 | 0 | 0 | 112.1 | F110 A115 F116 | F110-Q113 HydrophobicContact CB-CB 4.02Å; F110-Q113 HydrophobicContact CB-CG 4.09Å; F110-Q113 PolarHBondContact O-N 3.3Å; F110-Q113 VanDerWaalsContact O-N 3.13Å; Q113-A115 VanDerWaalsContact C-N 3.35Å; Q113-A115 PolarHBondContact O-N 3.07Å; Q113-F116 PolarHBondContact O-N 2.98Å |
| 114 | L | 63.9 | Low | 66.3 | Low | 22 Ų | 22 | 116.2 Ų | 116.2 | 12% | 0.115 | 59% | 0.585 | C | S | . | * | H | α-helix | trans | -73.5 | -25.9 | -179 | -164 | 69 | 0 | 0 | 0 | 113.5 | L103 F116 L117 L118 | L103-L114 HydrophobicContact CD1-CD1 3.56Å; L103-L114 HydrophobicContact CG-CD1 4.19Å; L114-F116 PolarHBondContact O-N 3.33Å; L114-L117 HydrophobicContact CD1-CB 4.31Å; L114-L117 HydrophobicContact CD1-CD1 4.03Å; L114-L117 PolarHBondContact O-N 3.11Å; L114-L117 VanDerWaalsContact O-N 3.11Å; L114-L118 HydrophobicContact CD2-CD1 4.06Å; L114-L118 HydrophobicContact CG-CD1 3.88Å; L114-L118 HydrophobicContact CG-CG 4.23Å; L114-L118 PolarHBondContact O-N 2.85Å |
| 115 | A | 62.9 | Low | 64.3 | Low | 60 Ų | 60 | 116.3 Ų | 116.3 | 50% | 0.496 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -57.8 | -36.5 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | Q113 S119 | Q113-A115 VanDerWaalsContact C-N 3.35Å; Q113-A115 PolarHBondContact O-N 3.07Å; A115-S119 WeakPolarHBondContact O-CB 3.11Å; A115-S119 PolarHBondContact O-N 3.1Å |
| 116 | F | 61.2 | Low | 62.1 | Low | 171 Ų | 171 | 118.5 Ų | 118.5 | 75% | 0.75 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -70 | -34.4 | 176.3 | -67.4 | -83.5 | 0 | 0 | 0 | 113 | R112 Q113 L114 | R112-F116 VanDerWaalsContact O-CD2 3.3Å; R112-F116 WeakPolarHBondContact O-CD2 3.3Å; R112-F116 WeakPolarHBondContact O-CE2 3.45Å; Q113-F116 PolarHBondContact O-N 2.98Å; L114-F116 PolarHBondContact O-N 3.33Å |
| 117 | L | 60.7 | Low | 60.1 | Low | 85 Ų | 85 | 116.9 Ų | 116.9 | 45% | 0.445 | 63% | 0.625 | S | S | . | * | H | α-helix | trans | -75.7 | -36.2 | 178.8 | -70.4 | 171.9 | 0 | 0 | 0 | 112.5 | L114 | L114-L117 HydrophobicContact CD1-CB 4.31Å; L114-L117 HydrophobicContact CD1-CD1 4.03Å; L114-L117 PolarHBondContact O-N 3.11Å; L114-L117 VanDerWaalsContact O-N 3.11Å |
| 118 | L | 61.9 | Low | 58.3 | Low | 129 Ų | 129 | 121.5 Ų | 121.5 | 68% | 0.675 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -81.9 | -18.6 | 178.7 | -68.8 | 168.9 | 0 | 0 | 0 | 113.3 | L114 A120 | L114-L118 HydrophobicContact CD2-CD1 4.06Å; L114-L118 HydrophobicContact CG-CD1 3.88Å; L114-L118 HydrophobicContact CG-CG 4.23Å; L114-L118 PolarHBondContact O-N 2.85Å; L118-A120 VanDerWaalsContact C-N 3.28Å; L118-A120 PolarHBondContact O-N 3.27Å |
| 119 | S | 58.7 | Low | 56.2 | Low | 91 Ų | 91 | 120.7 Ų | 120.7 | 64% | 0.636 | 66% | 0.658 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.9 | 4.9 | 179.3 | -167.2 | 0 | 0 | 0 | 0 | 113.6 | A115 P121 | A115-S119 WeakPolarHBondContact O-CB 3.11Å; A115-S119 PolarHBondContact O-N 3.1Å; S119-P121 WeakPolarHBondContact O-CD 3.14Å; S119-P121 VanDerWaalsContact O-N 3.11Å |
| 120 | A | 45.9 | Very low | 54.5 | Low | 73 Ų | 73 | 119 Ų | 119 | 60% | 0.603 | 67% | 0.667 | S | S | * | * | trans | -61.4 | 111.8 | 171.7 | 0 | 0 | 0 | 0 | 0 | 109 | L118 H122 | L118-A120 VanDerWaalsContact C-N 3.28Å; L118-A120 PolarHBondContact O-N 3.27Å; A120-H122 PolarHBondContact O-N 3.47Å | ||
| 121 | P | 47.2 | Very low | 52.8 | Low | 116 Ų | 116 | 119.6 Ų | 119.6 | 75% | 0.753 | 68% | 0.683 | S | S | * | * | trans | -66.6 | 127.7 | 179.4 | -11.1 | 26.4 | 0 | 0 | 0 | 107.9 | S119 T123 | S119-P121 WeakPolarHBondContact O-CD 3.14Å; S119-P121 VanDerWaalsContact O-N 3.11Å; P121-T123 PolarHBondContact O-N 2.87Å | ||
| 122 | H | 44.8 | Very low | 51.5 | Low | 178 Ų | 178 | 124 Ų | 124 | 82% | 0.824 | 70% | 0.696 | S | S | * | * | trans | -52.5 | 100.3 | 164.8 | -147.9 | -61.4 | 0 | 0 | 0 | 107.6 | A120 K124 | A120-H122 PolarHBondContact O-N 3.47Å; H122-K124 VanDerWaalsContact C-N 3.34Å; H122-K124 PolarHBondContact O-N 2.88Å | ||
| 123 | T | 44.4 | Very low | 50.1 | Low | 129 Ų | 129 | 118.4 Ų | 118.4 | 79% | 0.791 | 70% | 0.696 | S | S | * | * | trans | -61.7 | 105.2 | 167.8 | 44.7 | 0 | 0 | 0 | 0 | 106 | P121 A125 | P121-T123 PolarHBondContact O-N 2.87Å; T123-A125 PolarHBondContact O-N 2.99Å | ||
| 124 | K | 44.1 | Very low | 49 | Very low | 186 Ų | 186 | 123 Ų | 123 | 81% | 0.809 | 71% | 0.714 | S | S | * | * | trans | -52.3 | 120.2 | 168.8 | -72.8 | -127.7 | 177.2 | -175.9 | 0 | 107.2 | H122 T126 | H122-K124 VanDerWaalsContact C-N 3.34Å; H122-K124 PolarHBondContact O-N 2.88Å; K124-T126 PolarHBondContact O-N 3.18Å | ||
| 125 | A | 41.8 | Very low | 48 | Very low | 102 Ų | 102 | 125.1 Ų | 125.1 | 84% | 0.843 | 74% | 0.741 | S | S | * | * | trans | -60.5 | 105.5 | 163.8 | 0 | 0 | 0 | 0 | 0 | 107.1 | T123 G127 | T123-A125 PolarHBondContact O-N 2.99Å; A125-G127 PolarHBondContact O-N 3.23Å | ||
| 126 | T | 40.3 | Very low | 47.4 | Very low | 130 Ų | 130 | 128.4 Ų | 128.4 | 80% | 0.798 | 76% | 0.758 | S | S | * | * | trans | -57.8 | 116.9 | 166 | -56.6 | 0 | 0 | 0 | 0 | 107.2 | K124 | K124-T126 PolarHBondContact O-N 3.18Š| ||
| 127 | G | 40.6 | Very low | 47.1 | Very low | 48 Ų | 48 | 125.6 Ų | 125.6 | 50% | 0.495 | 76% | 0.759 | S | S | . | * | trans | -60.5 | 157.6 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | A125 Q129 | A125-G127 PolarHBondContact O-N 3.23Å; G127-Q129 PolarHBondContact O-N 3.1Å; G127-Q129 VanDerWaalsContact O-N 3.1Å | ||
| 128 | P | 43.5 | Very low | 46.4 | Very low | 137 Ų | 137 | 133.4 Ų | 133.4 | 89% | 0.89 | 78% | 0.783 | S | S | * | * | trans | -68.5 | 113.7 | 174.6 | 27.5 | -29.6 | 0 | 0 | 0 | 108.6 | T130 | P128-T130 PolarHBondContact O-N 3.09Š| ||
| 129 | Q | 37.4 | Very low | 45.6 | Very low | 177 Ų | 177 | 130.5 Ų | 130.5 | 83% | 0.827 | 78% | 0.784 | S | S | * | * | trans | -67.6 | 124.1 | 166.7 | -78.6 | -143.6 | 44.7 | 0 | 0 | 109.2 | G127 S131 | G127-Q129 PolarHBondContact O-N 3.1Å; G127-Q129 VanDerWaalsContact O-N 3.1Å; Q129-S131 PolarHBondContact O-N 3.44Å; Q129-S131 VanDerWaalsContact O-N 3.09Å | ||
| 130 | T | 48.8 | Very low | 44.7 | Very low | 134 Ų | 134 | 138 Ų | 138 | 82% | 0.822 | 80% | 0.798 | S | S | * | * | trans | -52.5 | 103.7 | 161.7 | -44.7 | 0 | 0 | 0 | 0 | 109.2 | P128 | P128-T130 PolarHBondContact O-N 3.09Š| ||
| 131 | S | 46.8 | Very low | 44.9 | Very low | 111 Ų | 111 | 143.9 Ų | 143.9 | 78% | 0.776 | 84% | 0.835 | S | S | * | * | trans | -96.5 | 100.3 | 165.1 | 63.8 | 0 | 0 | 0 | 0 | 108.6 | Q129 A133 | Q129-S131 PolarHBondContact O-N 3.44Å; Q129-S131 VanDerWaalsContact O-N 3.09Å; S131-A133 PolarHBondContact O-N 3.32Å | ||
| 132 | E | 46.9 | Very low | 44.8 | Very low | 188 Ų | 188 | 145.3 Ų | 145.3 | 88% | 0.879 | 84% | 0.84 | S | S | * | * | trans | -51.2 | 122.2 | 157.7 | -79.3 | -170.4 | 106.2 | 0 | 0 | 109.5 | ||||
| 133 | A | 42.4 | Very low | 44.8 | Very low | 102 Ų | 102 | 143.6 Ų | 143.6 | 84% | 0.843 | 84% | 0.84 | S | S | * | * | trans | -106.7 | 105.7 | 164.4 | 0 | 0 | 0 | 0 | 0 | 108 | S131 | S131-A133 PolarHBondContact O-N 3.32Š| ||
| 134 | K | 45.5 | Very low | 44.8 | Very low | 214 Ų | 214 | 144.4 Ų | 144.4 | 93% | 0.93 | 84% | 0.843 | S | S | * | * | trans | -83.7 | 121.5 | 176.7 | -177.4 | 177.7 | -176.9 | -175.9 | 0 | 110.4 | ||||
| 135 | G | 42.8 | Very low | 44.9 | Very low | 66 Ų | 66 | 141.9 Ų | 141.9 | 68% | 0.68 | 85% | 0.845 | S | S | * | * | trans | 128.4 | 163.6 | 148.1 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 136 | P | 48.8 | Very low | 45.1 | Very low | 129 Ų | 129 | 144.4 Ų | 144.4 | 84% | 0.838 | 85% | 0.845 | S | S | * | * | cis | -128.9 | 163.3 | -39.7 | 36.5 | -22.1 | 0 | 0 | 0 | 113.4 | ||||
| 137 | S | 55.5 | Low | 45.4 | Very low | 113 Ų | 113 | 145.4 Ų | 145.4 | 79% | 0.79 | 85% | 0.848 | S | S | * | * | trans | 7.1 | 119.8 | 153.2 | -174.1 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 138 | R | 45.3 | Very low | 45.7 | Very low | 248 Ų | 248 | 152.4 Ų | 152.4 | 94% | 0.936 | 87% | 0.874 | S | S | * | * | trans | -144.6 | 120.1 | 135.7 | -69.6 | -163.8 | -170.8 | -136.4 | 0.1 | 109.8 | ||||
| 139 | G | 45.5 | Very low | 45.9 | Very low | 68 Ų | 68 | 153.5 Ų | 153.5 | 70% | 0.701 | 87% | 0.873 | S | S | * | * | trans | -71.1 | 163.4 | 175 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 140 | R | 40 | Very low | 46.6 | Very low | 248 Ų | 248 | 151.6 Ų | 151.6 | 94% | 0.936 | 88% | 0.876 | S | S | * | * | trans | -164.5 | 114.3 | 151.4 | -104.7 | 164.1 | -173.7 | -100.4 | 2.2 | 107.3 | ||||
| 141 | S | 51.2 | Low | 46.4 | Very low | 198 Ų | 198 | 153.2 Ų | 153.2 | 100% | 1.385 | 88% | 0.881 | S | S | * | * | trans | -69.6 | 0 | 149.6 | -71.5 | 0 | 0 | 0 | 0 | 109.6 |
Retrieved 141 of 141 residues in 59.2 ms
(Link to these results)