| 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 | 38.5 | Very low | 66.8 | Low | 248 Ų | 248 | 112.6 Ų | 112.6 | 100% | 1.222 | 66% | 0.657 | S | S | * | * | 0 | 103.1 | 0 | -80.9 | 178.2 | 137.2 | 0 | 0 | 107.7 | |||||
| 2 | A | 54 | Low | 68.5 | Low | 103 Ų | 103 | 110.3 Ų | 110.3 | 85% | 0.851 | 64% | 0.638 | S | S | * | * | trans | -79.3 | 140.4 | -178.1 | 0 | 0 | 0 | 0 | 0 | 110.4 | I4 | A2-I4 PolarHBondContact O-N 2.96Å; A2-I4 VanDerWaalsContact O-N 3.11Å | ||
| 3 | S | 58.7 | Low | 69.9 | Low | 90 Ų | 90 | 112.2 Ų | 112.2 | 63% | 0.629 | 63% | 0.634 | S | S | * | * | trans | -64 | 98.5 | -168.1 | -163.4 | 0 | 0 | 0 | 0 | 112.6 | D5 | S3-D5 PolarHBondContact O-N 3.06Š| ||
| 4 | I | 64.4 | Low | 71.2 | Confident | 150 Ų | 150 | 113.4 Ų | 113.4 | 77% | 0.769 | 63% | 0.629 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.8 | -16.4 | 172.4 | -164.3 | 67.8 | 0 | 0 | 0 | 111.8 | A2 A6 | A2-I4 PolarHBondContact O-N 2.96Å; A2-I4 VanDerWaalsContact O-N 3.11Å; I4-A6 VanDerWaalsContact C-N 3.35Å; I4-A6 PolarHBondContact O-N 3.12Å |
| 5 | D | 65.3 | Low | 72.2 | Confident | 90 Ų | 90 | 113.7 Ų | 113.7 | 48% | 0.481 | 62% | 0.624 | S | S | . | * | H | α-helix | trans | -77.2 | -14.1 | -173.9 | -57.5 | -25.8 | 0 | 0 | 0 | 114.5 | S3 K9 | S3-D5 PolarHBondContact O-N 3.06Å; D5-K9 WeakPolarHBondContact O-CB 3.32Å; D5-K9 VanDerWaalsContact O-CD 3.29Å; D5-K9 WeakPolarHBondContact O-CD 2.85Å; D5-K9 WeakPolarHBondContact O-CG 3.48Å; D5-K9 PolarHBondContact O-N 3.49Å |
| 6 | A | 65.7 | Low | 73 | Confident | 61 Ų | 61 | 110.4 Ų | 110.4 | 50% | 0.504 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -76.6 | -40.3 | -169.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | I4 S10 | I4-A6 VanDerWaalsContact C-N 3.35Å; I4-A6 PolarHBondContact O-N 3.12Å; A6-S10 PolarHBondContact O-N 3.49Å |
| 7 | A | 65.7 | Low | 73.8 | Confident | 77 Ų | 77 | 111.6 Ų | 111.6 | 64% | 0.636 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -68.4 | -43.7 | 179.9 | 0 | 0 | 0 | 0 | 0 | 111.2 | K9 S10 E11 | A7-K9 PolarHBondContact O-N 3.14Å; A7-S10 WeakPolarHBondContact O-CB 3.36Å; A7-S10 PolarHBondContact O-N 3.41Å; A7-S10 VanDerWaalsContact O-N 3.11Å; A7-E11 PolarHBondContact O-N 3.27Å |
| 8 | D | 75.8 | Confident | 74.7 | Confident | 100 Ų | 100 | 113.7 Ų | 113.7 | 54% | 0.535 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -62.3 | -41.9 | 178 | -169 | 27.4 | 0 | 0 | 0 | 111.5 | S10 E11 I12 | D8-S10 PolarHBondContact O-N 3.45Å; D8-E11 PolarHBondContact O-N 3.46Å; D8-I12 WeakPolarHBondContact O-CB 3.4Å; D8-I12 WeakPolarHBondContact O-CD1 3.01Å; D8-I12 WeakPolarHBondContact O-CG1 3.5Å; D8-I12 PolarHBondContact O-N 3.21Å |
| 9 | K | 80.2 | Confident | 75.3 | Confident | 119 Ų | 119 | 112.3 Ų | 112.3 | 52% | 0.517 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -58.3 | -32.2 | 174 | -76.8 | 169.7 | -171.5 | 175.4 | 0 | 113.7 | D5 A7 K13 | D5-K9 WeakPolarHBondContact O-CB 3.32Å; D5-K9 VanDerWaalsContact O-CD 3.29Å; D5-K9 WeakPolarHBondContact O-CD 2.85Å; D5-K9 WeakPolarHBondContact O-CG 3.48Å; D5-K9 PolarHBondContact O-N 3.49Å; A7-K9 PolarHBondContact O-N 3.14Å; K9-K13 WeakPolarHBondContact O-CB 3.27Å; K9-K13 WeakPolarHBondContact O-CD 3.44Å; K9-K13 WeakPolarHBondContact O-CG 3.43Å; K9-K13 PolarHBondContact O-N 3.33Å; K9-K13 VanDerWaalsContact O-N 3.16Å |
| 10 | S | 82.2 | Confident | 75.7 | Confident | 61 Ų | 61 | 115.6 Ų | 115.6 | 43% | 0.427 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -70.6 | -43.8 | 178.6 | 133.6 | 0 | 0 | 0 | 0 | 111.3 | A6 A7 D8 K13 K14 | A6-S10 PolarHBondContact O-N 3.49Å; A7-S10 WeakPolarHBondContact O-CB 3.36Å; A7-S10 PolarHBondContact O-N 3.41Å; A7-S10 VanDerWaalsContact O-N 3.11Å; D8-S10 PolarHBondContact O-N 3.45Å; S10-K13 PolarHBondContact O-N 3.34Å; S10-K14 PolarHBondContact O-N 3.02Å |
| 11 | E | 83.9 | Confident | 76.2 | Confident | 140 Ų | 140 | 113.9 Ų | 113.9 | 65% | 0.654 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -68.4 | -46.1 | 179.3 | -170.1 | 125.1 | -139.7 | 0 | 0 | 111 | A7 D8 K13 K14 E15 | A7-E11 PolarHBondContact O-N 3.27Å; D8-E11 PolarHBondContact O-N 3.46Å; E11-K13 VanDerWaalsContact C-N 3.25Å; E11-K13 PolarHBondContact O-N 3.13Å; E11-K14 PolarHBondContact O-N 2.82Å; E11-K14 VanDerWaalsContact O-N 3.1Å; E11-E15 PolarHBondContact O-N 3.1Å |
| 12 | I | 88 | Confident | 78.7 | Confident | 84 Ų | 84 | 109.5 Ų | 109.5 | 43% | 0.431 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -55 | -41.3 | 174.8 | -68.4 | 166.6 | 0 | 0 | 0 | 111.2 | D8 E15 S16 | D8-I12 WeakPolarHBondContact O-CB 3.4Å; D8-I12 WeakPolarHBondContact O-CD1 3.01Å; D8-I12 WeakPolarHBondContact O-CG1 3.5Å; D8-I12 PolarHBondContact O-N 3.21Å; I12-E15 PolarHBondContact O-N 3.17Å; I12-S16 VanDerWaalsContact O-CB 3.27Å; I12-S16 WeakPolarHBondContact O-CB 3.32Å; I12-S16 PolarHBondContact O-N 3.49Å; I12-S16 PolarHBondContact O-OG 3.4Å |
| 13 | K | 86.9 | Confident | 80.1 | Confident | 135 Ų | 135 | 111.1 Ų | 111.1 | 59% | 0.587 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -62 | -49.5 | 176.7 | -78.8 | 171.3 | -177 | -174.2 | 0 | 111.9 | K9 S10 E11 E15 S16 E17 | K9-K13 WeakPolarHBondContact O-CB 3.27Å; K9-K13 WeakPolarHBondContact O-CD 3.44Å; K9-K13 WeakPolarHBondContact O-CG 3.43Å; K9-K13 PolarHBondContact O-N 3.33Å; K9-K13 VanDerWaalsContact O-N 3.16Å; S10-K13 PolarHBondContact O-N 3.34Å; E11-K13 VanDerWaalsContact C-N 3.25Å; E11-K13 PolarHBondContact O-N 3.13Å; K13-E15 VanDerWaalsContact C-N 3.31Å; K13-E15 PolarHBondContact O-N 3.47Å; K13-S16 PolarHBondContact O-N 3.44Å; K13-S16 PolarHBondContact O-OG 3.08Å; K13-E17 WeakPolarHBondContact O-CG 3.35Å; K13-E17 PolarHBondContact O-N 3.41Å |
| 14 | K | 87.3 | Confident | 81.3 | Confident | 130 Ų | 130 | 112.5 Ų | 112.5 | 57% | 0.565 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -61.7 | -39.9 | 179.3 | -69.3 | 177.2 | -176.4 | 175.8 | 0 | 112 | S10 E11 K18 | S10-K14 PolarHBondContact O-N 3.02Å; E11-K14 PolarHBondContact O-N 2.82Å; E11-K14 VanDerWaalsContact O-N 3.1Å; K14-K18 WeakPolarHBondContact O-CG 3.43Å; K14-K18 PolarHBondContact O-N 3.49Å |
| 15 | E | 86.8 | Confident | 82 | Confident | 118 Ų | 118 | 107.2 Ų | 107.2 | 55% | 0.551 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -67.7 | -40.8 | 175.8 | -170.3 | 175.9 | -172.4 | 0 | 0 | 111.7 | E11 I12 K13 E17 K18 L19 | E11-E15 PolarHBondContact O-N 3.1Å; I12-E15 PolarHBondContact O-N 3.17Å; K13-E15 VanDerWaalsContact C-N 3.31Å; K13-E15 PolarHBondContact O-N 3.47Å; E15-E17 VanDerWaalsContact C-N 3.3Å; E15-E17 PolarHBondContact O-N 3.12Å; E15-K18 WeakPolarHBondContact O-CB 3.28Å; E15-K18 PolarHBondContact O-N 3.39Å; E15-L19 HydrophobicContact CG-CD1 4.48Å; E15-L19 PolarHBondContact O-N 3.39Å |
| 16 | S | 85 | Confident | 82.5 | Confident | 61 Ų | 61 | 108.5 Ų | 108.5 | 43% | 0.427 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -61.4 | -36.1 | 176.9 | 78.3 | 0 | 0 | 0 | 0 | 112.9 | I12 K13 L19 R20 | I12-S16 VanDerWaalsContact O-CB 3.27Å; I12-S16 WeakPolarHBondContact O-CB 3.32Å; I12-S16 PolarHBondContact O-N 3.49Å; I12-S16 PolarHBondContact O-OG 3.4Å; K13-S16 PolarHBondContact O-N 3.44Å; K13-S16 PolarHBondContact O-OG 3.08Å; S16-L19 PolarHBondContact O-N 3.1Å; S16-R20 WeakPolarHBondContact O-CB 3.09Å; S16-R20 PolarHBondContact O-N 2.78Å |
| 17 | E | 86.1 | Confident | 82.8 | Confident | 131 Ų | 131 | 110.4 Ų | 110.4 | 61% | 0.612 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -67.9 | -42 | 175.8 | -73.2 | 172.3 | -170.4 | 0 | 0 | 111.9 | K13 E15 L19 R20 A21 | K13-E17 WeakPolarHBondContact O-CG 3.35Å; K13-E17 PolarHBondContact O-N 3.41Å; E15-E17 VanDerWaalsContact C-N 3.3Å; E15-E17 PolarHBondContact O-N 3.12Å; E17-L19 VanDerWaalsContact C-N 3.3Å; E17-L19 PolarHBondContact O-N 2.67Å; E17-R20 PolarHBondContact O-N 3.15Å; E17-A21 PolarHBondContact O-N 3.35Å |
| 18 | K | 89.5 | Confident | 83.1 | Confident | 149 Ų | 149 | 113.4 Ų | 113.4 | 65% | 0.648 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -61.3 | -40.6 | 173.7 | -69.4 | 173.4 | -175.4 | 174.3 | 0 | 111.4 | K14 E15 A21 K22 | K14-K18 WeakPolarHBondContact O-CG 3.43Å; K14-K18 PolarHBondContact O-N 3.49Å; E15-K18 WeakPolarHBondContact O-CB 3.28Å; E15-K18 PolarHBondContact O-N 3.39Å; K18-A21 PolarHBondContact O-N 3.03Å; K18-K22 PolarHBondContact O-N 2.87Å |
| 19 | L | 85.7 | Confident | 82.8 | Confident | 86 Ų | 86 | 115.1 Ų | 115.1 | 45% | 0.45 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -66.6 | -40.7 | 175 | -73.6 | 171.6 | 0 | 0 | 0 | 111.7 | E15 S16 E17 A21 K22 Y23 | E15-L19 HydrophobicContact CG-CD1 4.48Å; E15-L19 PolarHBondContact O-N 3.39Å; S16-L19 PolarHBondContact O-N 3.1Å; E17-L19 VanDerWaalsContact C-N 3.3Å; E17-L19 PolarHBondContact O-N 2.67Å; L19-A21 VanDerWaalsContact C-N 3.29Å; L19-A21 PolarHBondContact O-N 2.84Å; L19-K22 PolarHBondContact O-N 3.39Å; L19-K22 VanDerWaalsContact O-N 3.16Å; L19-Y23 HydrophobicContact CD2-CE2 4.42Å; L19-Y23 WeakPolarHBondContact O-CD2 3.31Å; L19-Y23 PolarHBondContact O-N 3.06Å |
| 20 | R | 84.5 | Confident | 82.5 | Confident | 178 Ų | 178 | 111.6 Ų | 111.6 | 67% | 0.672 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -62.4 | -35.9 | 175.4 | -173.4 | 177 | 172.2 | 95.4 | -0.1 | 112.3 | S16 E17 Y23 | S16-R20 WeakPolarHBondContact O-CB 3.09Å; S16-R20 PolarHBondContact O-N 2.78Å; E17-R20 PolarHBondContact O-N 3.15Å; R20-Y23 CarbonylContact O-C 3.52Å; R20-Y23 PolarHBondContact O-N 2.65Å |
| 21 | A | 86.2 | Confident | 82.5 | Confident | 81 Ų | 81 | 111.2 Ų | 111.2 | 67% | 0.669 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -68.3 | -33.9 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | E17 K18 L19 | E17-A21 PolarHBondContact O-N 3.35Å; K18-A21 PolarHBondContact O-N 3.03Å; L19-A21 VanDerWaalsContact C-N 3.29Å; L19-A21 PolarHBondContact O-N 2.84Å |
| 22 | K | 90.3 | Very high | 82.4 | Confident | 156 Ų | 156 | 109.1 Ų | 109.1 | 68% | 0.678 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -71.5 | -27.9 | 176.4 | -74.1 | -174.2 | 177.2 | -176 | 0 | 113.6 | K18 L19 P24 | K18-K22 PolarHBondContact O-N 2.87Å; L19-K22 PolarHBondContact O-N 3.39Å; L19-K22 VanDerWaalsContact O-N 3.16Å; K22-P24 WeakPolarHBondContact O-CD 3.29Å |
| 23 | Y | 84.8 | Confident | 82.1 | Confident | 137 Ų | 137 | 109 Ų | 109 | 54% | 0.537 | 58% | 0.576 | S | S | . | * | S | Bend | trans | -126.9 | 70.4 | -175.2 | -55.7 | -76.6 | 0 | 0 | 0 | 112.3 | L19 R20 G25 L26 | L19-Y23 HydrophobicContact CD2-CE2 4.42Å; L19-Y23 WeakPolarHBondContact O-CD2 3.31Å; L19-Y23 PolarHBondContact O-N 3.06Å; R20-Y23 CarbonylContact O-C 3.52Å; R20-Y23 PolarHBondContact O-N 2.65Å; Y23-G25 PolarHBondContact O-N 3.31Å; Y23-G25 VanDerWaalsContact O-N 3.09Å; Y23-L26 HydrophobicContact CD2-CD2 4.48Å; Y23-L26 HydrophobicContact CG-CD2 4.24Å; Y23-L26 PolarHBondContact O-N 3.18Å |
| 24 | P | 82.9 | Confident | 82 | Confident | 118 Ų | 118 | 107 Ų | 107 | 77% | 0.766 | 57% | 0.572 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.9 | 113.5 | 175.4 | 27.4 | -33.5 | 0 | 0 | 0 | 109.7 | K22 | K22-P24 WeakPolarHBondContact O-CD 3.29Š|
| 25 | G | 78.9 | Confident | 81.8 | Confident | 39 Ų | 39 | 105.5 Ų | 105.5 | 40% | 0.402 | 57% | 0.567 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 102.1 | 0.1 | 176.7 | 0 | 0 | 0 | 0 | 0 | 116.4 | Y23 V27 N28 N29 | Y23-G25 PolarHBondContact O-N 3.31Å; Y23-G25 VanDerWaalsContact O-N 3.09Å; G25-V27 PolarHBondContact O-N 3.2Å; G25-N28 PolarHBondContact O-N 3.45Å; G25-N28 VanDerWaalsContact O-N 3.07Å; G25-N29 PolarHBondContact O-N 3.06Å; G25-N29 VanDerWaalsContact O-N 3.16Å |
| 26 | L | 75.8 | Confident | 81.5 | Confident | 118 Ų | 118 | 106.3 Ų | 106.3 | 62% | 0.618 | 57% | 0.565 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.1 | -30.9 | 179 | -174 | 59.7 | 0 | 0 | 0 | 113.3 | Y23 N28 | Y23-L26 HydrophobicContact CD2-CD2 4.48Å; Y23-L26 HydrophobicContact CG-CD2 4.24Å; Y23-L26 PolarHBondContact O-N 3.18Å; L26-N28 VanDerWaalsContact C-N 3.33Å |
| 27 | V | 72 | Confident | 81.3 | Confident | 101 Ų | 101 | 111.2 Ų | 111.2 | 61% | 0.612 | 57% | 0.574 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.7 | -21.9 | 179 | -56 | 0 | 0 | 0 | 0 | 113.1 | G25 | G25-V27 PolarHBondContact O-N 3.2Š|
| 28 | N | 71.6 | Confident | 81.2 | Confident | 139 Ų | 139 | 111.7 Ų | 111.7 | 74% | 0.743 | 58% | 0.58 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.5 | -20.6 | -177.6 | -55.9 | 65 | 0 | 0 | 0 | 112.1 | G25 L26 | G25-N28 PolarHBondContact O-N 3.45Å; G25-N28 VanDerWaalsContact O-N 3.07Å; L26-N28 VanDerWaalsContact C-N 3.33Å |
| 29 | N | 69.9 | Low | 80.8 | Confident | 136 Ų | 136 | 108.7 Ų | 108.7 | 73% | 0.727 | 58% | 0.578 | S | S | * | * | trans | -108.2 | 31.5 | -172.1 | -161.8 | 18.1 | 0 | 0 | 0 | 113.2 | G25 S31 | G25-N29 PolarHBondContact O-N 3.06Å; G25-N29 VanDerWaalsContact O-N 3.16Å; N29-S31 PolarHBondContact O-N 3.17Å | ||
| 30 | A | 74.7 | Confident | 80.2 | Confident | 45 Ų | 45 | 110.8 Ų | 110.8 | 37% | 0.372 | 58% | 0.583 | S | S | . | * | trans | -64.3 | 130.1 | 166 | 0 | 0 | 0 | 0 | 0 | 108.6 | S32 H35 | A30-S32 PolarHBondContact O-N 3.25Å; A30-H35 WeakPolarHBondContact CB-NE2 3.22Å | ||
| 31 | S | 82.2 | Confident | 79.8 | Confident | 54 Ų | 54 | 108.8 Ų | 108.8 | 38% | 0.378 | 59% | 0.586 | S | S | . | * | trans | -52.9 | 132.5 | -177.3 | 69.5 | 0 | 0 | 0 | 0 | 110.9 | N29 L33 L34 H35 | N29-S31 PolarHBondContact O-N 3.17Å; S31-L33 PolarHBondContact O-N 3.08Å; S31-L34 WeakPolarHBondContact O-CA 3.38Å; S31-L34 PolarHBondContact O-N 2.94Å; S31-L34 VanDerWaalsContact OG-CB 3.31Å; S31-L34 WeakPolarHBondContact OG-CB 3.27Å; S31-L34 VanDerWaalsContact OG-CG 3.27Å; S31-L34 WeakPolarHBondContact OG-CG 3.31Å; S31-L34 PolarHBondContact OG-N 3.45Å; S31-H35 PolarHBondContact O-N 2.88Å | ||
| 32 | S | 80.9 | Confident | 79.6 | Confident | 96 Ų | 96 | 110.5 Ų | 110.5 | 67% | 0.671 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -54.4 | -30.5 | 178.1 | 62.7 | 0 | 0 | 0 | 0 | 112 | A30 R36 | A30-S32 PolarHBondContact O-N 3.25Å; S32-R36 VanDerWaalsContact O-CB 3.22Å; S32-R36 WeakPolarHBondContact O-CB 3.1Å; S32-R36 PolarHBondContact O-N 3.22Å |
| 33 | L | 82.9 | Confident | 79.3 | Confident | 80 Ų | 80 | 111.4 Ų | 111.4 | 42% | 0.419 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -63.7 | -42.3 | 173.9 | -63.4 | 176.7 | 0 | 0 | 0 | 112.9 | S31 R37 | S31-L33 PolarHBondContact O-N 3.08Å; L33-R37 VanDerWaalsContact O-CG 3.31Å; L33-R37 WeakPolarHBondContact O-CG 3.23Å; L33-R37 PolarHBondContact O-N 3.4Å; L33-R37 VanDerWaalsContact O-N 3.08Å |
| 34 | L | 83.7 | Confident | 79.4 | Confident | 94 Ų | 94 | 114.5 Ų | 114.5 | 49% | 0.492 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -70 | -47.2 | 175.8 | -82.5 | 174.1 | 0 | 0 | 0 | 111.2 | S31 R36 R37 L38 | S31-L34 WeakPolarHBondContact O-CA 3.38Å; S31-L34 PolarHBondContact O-N 2.94Å; S31-L34 VanDerWaalsContact OG-CB 3.31Å; S31-L34 WeakPolarHBondContact OG-CB 3.27Å; S31-L34 VanDerWaalsContact OG-CG 3.27Å; S31-L34 WeakPolarHBondContact OG-CG 3.31Å; S31-L34 PolarHBondContact OG-N 3.45Å; L34-R36 VanDerWaalsContact C-N 3.29Å; L34-R36 PolarHBondContact O-N 2.85Å; L34-R37 CarbonylContact O-C 3.57Å; L34-R37 WeakPolarHBondContact O-CA 3.46Å; L34-R37 PolarHBondContact O-N 2.75Å; L34-L38 WeakPolarHBondContact O-CG 3.46Å; L34-L38 PolarHBondContact O-N 3.38Å |
| 35 | H | 82.6 | Confident | 79.6 | Confident | 99 Ų | 99 | 113.2 Ų | 113.2 | 46% | 0.458 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -55.5 | -46.8 | 174.8 | -90.4 | -55.9 | 0 | 0 | 0 | 111.2 | A30 S31 R37 L38 S39 | A30-H35 WeakPolarHBondContact CB-NE2 3.22Å; S31-H35 PolarHBondContact O-N 2.88Å; H35-R37 PolarHBondContact O-N 2.83Å; H35-L38 PolarHBondContact O-N 2.99Å; H35-S39 WeakPolarHBondContact O-CB 3.5Å; H35-S39 PolarHBondContact O-N 3.37Å; H35-S39 PolarHBondContact O-OG 3.27Å |
| 36 | R | 81.7 | Confident | 80.1 | Confident | 134 Ų | 134 | 116.2 Ų | 116.2 | 51% | 0.506 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -59.8 | -33.8 | 174.9 | -176.1 | 176.6 | 69.7 | -167.5 | 2.3 | 112.7 | S32 L34 K40 | S32-R36 VanDerWaalsContact O-CB 3.22Å; S32-R36 WeakPolarHBondContact O-CB 3.1Å; S32-R36 PolarHBondContact O-N 3.22Å; L34-R36 VanDerWaalsContact C-N 3.29Å; L34-R36 PolarHBondContact O-N 2.85Å; R36-K40 HydrophobicContact CG-CD 4.16Å; R36-K40 VanDerWaalsContact CG-CE 3.46Å; R36-K40 VanDerWaalsContact O-CB 3.23Å; R36-K40 WeakPolarHBondContact O-CB 2.95Å; R36-K40 WeakPolarHBondContact O-CD 3.16Å; R36-K40 WeakPolarHBondContact O-CG 3.39Å; R36-K40 PolarHBondContact O-N 2.72Å |
| 37 | R | 81.3 | Confident | 80.8 | Confident | 165 Ų | 165 | 114.7 Ų | 114.7 | 62% | 0.623 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -77 | -39.2 | 178.2 | -78.8 | 175.3 | 169.6 | 118.6 | -5.2 | 112.6 | L33 L34 H35 | L33-R37 VanDerWaalsContact O-CG 3.31Å; L33-R37 WeakPolarHBondContact O-CG 3.23Å; L33-R37 PolarHBondContact O-N 3.4Å; L33-R37 VanDerWaalsContact O-N 3.08Å; L34-R37 CarbonylContact O-C 3.57Å; L34-R37 WeakPolarHBondContact O-CA 3.46Å; L34-R37 PolarHBondContact O-N 2.75Å; H35-R37 PolarHBondContact O-N 2.83Å |
| 38 | L | 83.2 | Confident | 81.9 | Confident | 140 Ų | 140 | 111.4 Ų | 111.4 | 73% | 0.733 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -77.4 | -40.1 | -179.9 | -67.7 | 173.5 | 0 | 0 | 0 | 112.2 | L34 H35 K40 | L34-L38 WeakPolarHBondContact O-CG 3.46Å; L34-L38 PolarHBondContact O-N 3.38Å; H35-L38 PolarHBondContact O-N 2.99Å; L38-K40 PolarHBondContact O-N 3.48Å |
| 39 | S | 80.3 | Confident | 82.9 | Confident | 86 Ų | 86 | 107.6 Ų | 107.6 | 60% | 0.601 | 56% | 0.558 | S | S | * | * | S | Bend | trans | -72.5 | -18.8 | 174.4 | -58.4 | 0 | 0 | 0 | 0 | 112.6 | H35 N41 | H35-S39 WeakPolarHBondContact O-CB 3.5Å; H35-S39 PolarHBondContact O-N 3.37Å; H35-S39 PolarHBondContact O-OG 3.27Å; S39-N41 PolarHBondContact O-N 3.09Å; S39-N41 VanDerWaalsContact O-N 3.12Å; S39-N41 PolarHBondContact O-OD1 2.89Å |
| 40 | K | 74 | Confident | 84 | Confident | 130 Ų | 130 | 107.3 Ų | 107.3 | 57% | 0.565 | 55% | 0.548 | S | S | * | . | S | Bend | trans | -73.4 | 102.5 | 168.8 | -84.5 | 171.1 | -175.8 | -175.3 | 0 | 108 | R36 L38 V42 | R36-K40 HydrophobicContact CG-CD 4.16Å; R36-K40 VanDerWaalsContact CG-CE 3.46Å; R36-K40 VanDerWaalsContact O-CB 3.23Å; R36-K40 WeakPolarHBondContact O-CB 2.95Å; R36-K40 WeakPolarHBondContact O-CD 3.16Å; R36-K40 WeakPolarHBondContact O-CG 3.39Å; R36-K40 PolarHBondContact O-N 2.72Å; L38-K40 PolarHBondContact O-N 3.48Å; K40-V42 PolarHBondContact O-N 3.27Å |
| 41 | N | 76.7 | Confident | 84.7 | Confident | 137 Ų | 137 | 110.5 Ų | 110.5 | 73% | 0.733 | 56% | 0.559 | S | S | * | * | trans | -48.9 | 139.4 | 163.6 | -58.1 | 70.7 | 0 | 0 | 0 | 109 | S39 K43 | S39-N41 PolarHBondContact O-N 3.09Å; S39-N41 VanDerWaalsContact O-N 3.12Å; S39-N41 PolarHBondContact O-OD1 2.89Å; N41-K43 VanDerWaalsContact C-N 3.31Å; N41-K43 PolarHBondContact O-N 3.37Å | ||
| 42 | V | 82.4 | Confident | 85 | Confident | 116 Ų | 116 | 113 Ų | 113 | 70% | 0.703 | 57% | 0.566 | S | S | * | * | trans | -57.1 | 99.8 | 170 | 178.4 | 0 | 0 | 0 | 0 | 107 | K40 Y44 | K40-V42 PolarHBondContact O-N 3.27Å; V42-Y44 HydrophobicContact CG1-CE1 4.35Å; V42-Y44 PolarHBondContact O-N 3.06Å | ||
| 43 | K | 83.2 | Confident | 85.2 | Confident | 176 Ų | 176 | 111.3 Ų | 111.3 | 77% | 0.765 | 56% | 0.557 | S | S | * | * | trans | -80.2 | 106.9 | 174.6 | -72.4 | -177.7 | 60.6 | 66.2 | 0 | 106.2 | N41 F45 | N41-K43 VanDerWaalsContact C-N 3.31Å; N41-K43 PolarHBondContact O-N 3.37Å; K43-F45 PolarHBondContact O-N 3.23Å | ||
| 44 | Y | 87.3 | Confident | 85.2 | Confident | 202 Ų | 202 | 115.6 Ų | 115.6 | 79% | 0.792 | 57% | 0.573 | S | S | * | * | P | Polyproline II helix | trans | -60.9 | 135.4 | 160.4 | -59.1 | -76.3 | 0 | 0 | 0 | 107.6 | V42 D46 | V42-Y44 HydrophobicContact CG1-CE1 4.35Å; V42-Y44 PolarHBondContact O-N 3.06Å; Y44-D46 PolarHBondContact O-N 2.88Å |
| 45 | F | 85.6 | Confident | 85.1 | Confident | 91 Ų | 91 | 115.2 Ų | 115.2 | 40% | 0.399 | 58% | 0.578 | S | S | . | * | P | Polyproline II helix | trans | -81.6 | 118.2 | -174.7 | -171.4 | -81.9 | 0 | 0 | 0 | 108 | K43 D49 Y50 A53 | K43-F45 PolarHBondContact O-N 3.23Å; F45-D49 HydrophobicContact CD1-CB 3.82Å; F45-D49 HydrophobicContact CD2-CB 3.83Å; F45-D49 HydrophobicContact CE1-CB 3.37Å; F45-D49 HydrophobicContact CE2-CB 3.45Å; F45-D49 VanDerWaalsContact CE2-CB 3.45Å; F45-D49 HydrophobicContact CG-CB 4.03Å; F45-D49 HydrophobicContact CZ-CB 3.24Å; F45-D49 VanDerWaalsContact CZ-O 3.29Å; F45-D49 WeakPolarHBondContact CZ-O 3.46Å; F45-Y50 AromaticContact CD1-CD1 3.78Å; F45-Y50 HydrophobicContact CD1-CD1 3.78Å; F45-Y50 AromaticContact CD1-CD2 3.67Å; F45-Y50 HydrophobicContact CD1-CD2 3.67Å; F45-Y50 AromaticContact CD1-CE1 3.49Å; F45-Y50 HydrophobicContact CD1-CE1 3.49Å; F45-Y50 VanDerWaalsContact CD1-CE1 3.49Å; F45-Y50 AromaticContact CD1-CE2 3.38Å; F45-Y50 HydrophobicContact CD1-CE2 3.38Å; F45-Y50 AromaticContact CD1-CG 3.85Å; F45-Y50 HydrophobicContact CD1-CG 3.85Å; F45-Y50 AromaticContact CD1-CZ 3.26Å; F45-Y50 AromaticContact CE1-CD1 3.07Å; F45-Y50 HydrophobicContact CE1-CD1 3.07Å; F45-Y50 AromaticContact CE1-CD2 3.4Å; F45-Y50 HydrophobicContact CE1-CD2 3.4Å; F45-Y50 VanDerWaalsContact CE1-CD2 3.4Å; F45-Y50 AromaticContact CE1-CE1 3.28Å; F45-Y50 HydrophobicContact CE1-CE1 3.28Å; F45-Y50 AromaticContact CE1-CE2 3.6Å; F45-Y50 HydrophobicContact CE1-CE2 3.6Å; F45-Y50 AromaticContact CE1-CG 3.12Å; F45-Y50 HydrophobicContact CE1-CG 3.12Å; F45-Y50 AromaticContact CE1-CZ 3.52Å; F45-Y50 HydrophobicContact CG-CE1 4.34Å; F45-Y50 VanDerWaalsContact CZ-CA 3.46Å; F45-Y50 AromaticContact CZ-CD1 3.63Å; F45-Y50 HydrophobicContact CZ-CD1 3.63Å; F45-Y50 AromaticContact CZ-CE1 3.95Å; F45-Y50 HydrophobicContact CZ-CE1 3.95Å; F45-Y50 AromaticContact CZ-CG 3.97Å; F45-Y50 HydrophobicContact CZ-CG 3.97Å; F45-A53 HydrophobicContact CZ-CB 4.2Å |
| 46 | D | 89.7 | Confident | 84.5 | Confident | 101 Ų | 101 | 119 Ų | 119 | 54% | 0.54 | 59% | 0.588 | S | S | . | * | P | Polyproline II helix | trans | -71.9 | 150.1 | 179.1 | -172.3 | 5.3 | 0 | 0 | 0 | 109.5 | Y44 G48 D49 | Y44-D46 PolarHBondContact O-N 2.88Å; D46-G48 PolarHBondContact O-N 3.05Å; D46-G48 VanDerWaalsContact O-N 3.09Å; D46-D49 PolarHBondContact N-OD2 2.95Å; D46-D49 VanDerWaalsContact N-OD2 3.13Å; D46-D49 WeakPolarHBondContact O-CB 3.39Å; D46-D49 PolarHBondContact O-N 3.08Å |
| 47 | S | 92 | Very high | 83.6 | Confident | 87 Ų | 87 | 117.1 Ų | 117.1 | 61% | 0.608 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -48.7 | -32.4 | 169 | 62 | 0 | 0 | 0 | 0 | 113 | ||
| 48 | G | 93.9 | Very high | 82.6 | Confident | 31 Ų | 31 | 117.3 Ų | 117.3 | 32% | 0.32 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -70 | -33.1 | 174.1 | 0 | 0 | 0 | 0 | 0 | 114.4 | D46 Y50 N51 | D46-G48 PolarHBondContact O-N 3.05Å; D46-G48 VanDerWaalsContact O-N 3.09Å; G48-Y50 PolarHBondContact O-N 3.25Å; G48-N51 PolarHBondContact O-N 3.28Å |
| 49 | D | 93 | Very high | 81.2 | Confident | 59 Ų | 59 | 116.6 Ų | 116.6 | 32% | 0.316 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -64.8 | -28.1 | 179.1 | -68.8 | -35.7 | 0 | 0 | 0 | 110.7 | F45 D46 N51 M52 A53 | F45-D49 HydrophobicContact CD1-CB 3.82Å; F45-D49 HydrophobicContact CD2-CB 3.83Å; F45-D49 HydrophobicContact CE1-CB 3.37Å; F45-D49 HydrophobicContact CE2-CB 3.45Å; F45-D49 VanDerWaalsContact CE2-CB 3.45Å; F45-D49 HydrophobicContact CG-CB 4.03Å; F45-D49 HydrophobicContact CZ-CB 3.24Å; F45-D49 VanDerWaalsContact CZ-O 3.29Å; F45-D49 WeakPolarHBondContact CZ-O 3.46Å; D46-D49 PolarHBondContact N-OD2 2.95Å; D46-D49 VanDerWaalsContact N-OD2 3.13Å; D46-D49 WeakPolarHBondContact O-CB 3.39Å; D46-D49 PolarHBondContact O-N 3.08Å; D49-N51 VanDerWaalsContact C-N 3.28Å; D49-N51 PolarHBondContact O-N 2.9Å; D49-M52 PolarHBondContact O-N 3.13Å; D49-A53 WeakPolarHBondContact O-CB 3.34Å; D49-A53 PolarHBondContact O-N 3.48Å |
| 50 | Y | 93.1 | Very high | 80 | Confident | 131 Ų | 131 | 120.4 Ų | 120.4 | 51% | 0.514 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -66.9 | -39.2 | -174.8 | -81.6 | -56.3 | 0 | 0 | 0 | 109.1 | F45 G48 A53 K54 | F45-Y50 AromaticContact CD1-CD1 3.78Å; F45-Y50 HydrophobicContact CD1-CD1 3.78Å; F45-Y50 AromaticContact CD1-CD2 3.67Å; F45-Y50 HydrophobicContact CD1-CD2 3.67Å; F45-Y50 AromaticContact CD1-CE1 3.49Å; F45-Y50 HydrophobicContact CD1-CE1 3.49Å; F45-Y50 VanDerWaalsContact CD1-CE1 3.49Å; F45-Y50 AromaticContact CD1-CE2 3.38Å; F45-Y50 HydrophobicContact CD1-CE2 3.38Å; F45-Y50 AromaticContact CD1-CG 3.85Å; F45-Y50 HydrophobicContact CD1-CG 3.85Å; F45-Y50 AromaticContact CD1-CZ 3.26Å; F45-Y50 AromaticContact CE1-CD1 3.07Å; F45-Y50 HydrophobicContact CE1-CD1 3.07Å; F45-Y50 AromaticContact CE1-CD2 3.4Å; F45-Y50 HydrophobicContact CE1-CD2 3.4Å; F45-Y50 VanDerWaalsContact CE1-CD2 3.4Å; F45-Y50 AromaticContact CE1-CE1 3.28Å; F45-Y50 HydrophobicContact CE1-CE1 3.28Å; F45-Y50 AromaticContact CE1-CE2 3.6Å; F45-Y50 HydrophobicContact CE1-CE2 3.6Å; F45-Y50 AromaticContact CE1-CG 3.12Å; F45-Y50 HydrophobicContact CE1-CG 3.12Å; F45-Y50 AromaticContact CE1-CZ 3.52Å; F45-Y50 HydrophobicContact CG-CE1 4.34Å; F45-Y50 VanDerWaalsContact CZ-CA 3.46Å; F45-Y50 AromaticContact CZ-CD1 3.63Å; F45-Y50 HydrophobicContact CZ-CD1 3.63Å; F45-Y50 AromaticContact CZ-CE1 3.95Å; F45-Y50 HydrophobicContact CZ-CE1 3.95Å; F45-Y50 AromaticContact CZ-CG 3.97Å; F45-Y50 HydrophobicContact CZ-CG 3.97Å; G48-Y50 PolarHBondContact O-N 3.25Å; Y50-A53 PolarHBondContact O-N 3Å; Y50-K54 VanDerWaalsContact O-CB 3.32Å; Y50-K54 WeakPolarHBondContact O-CB 3.41Å; Y50-K54 VanDerWaalsContact O-CG 3.28Å; Y50-K54 WeakPolarHBondContact O-CG 3.49Å; Y50-K54 PolarHBondContact O-N 2.77Å |
| 51 | N | 89.3 | Confident | 79 | Confident | 112 Ų | 112 | 120.8 Ų | 120.8 | 60% | 0.599 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -67.4 | -40.4 | -179.6 | -65.1 | -20 | 0 | 0 | 0 | 110.8 | G48 D49 S55 | G48-N51 PolarHBondContact O-N 3.28Å; D49-N51 VanDerWaalsContact C-N 3.28Å; D49-N51 PolarHBondContact O-N 2.9Å; N51-S55 WeakPolarHBondContact O-CB 3.44Å; N51-S55 PolarHBondContact O-N 2.92Å; N51-S55 PolarHBondContact O-OG 2.82Å |
| 52 | M | 87.4 | Confident | 77.6 | Confident | 106 Ų | 106 | 118.1 Ų | 118.1 | 52% | 0.522 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -69.8 | -39.9 | 176 | -68.6 | -179.6 | 59 | 0 | 0 | 112.7 | D49 S55 R56 | D49-M52 PolarHBondContact O-N 3.13Å; M52-S55 PolarHBondContact O-N 3.35Å; M52-S55 PolarHBondContact O-OG 3.46Å; M52-R56 VanDerWaalsContact O-CG 3.27Å; M52-R56 WeakPolarHBondContact O-CG 3.27Å; M52-R56 PolarHBondContact O-N 3.29Å |
| 53 | A | 85.8 | Confident | 76.1 | Confident | 60 Ų | 60 | 120.7 Ų | 120.7 | 50% | 0.496 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -68.4 | -37.5 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112 | F45 D49 Y50 | F45-A53 HydrophobicContact CZ-CB 4.2Å; D49-A53 WeakPolarHBondContact O-CB 3.34Å; D49-A53 PolarHBondContact O-N 3.48Å; Y50-A53 PolarHBondContact O-N 3Å |
| 54 | K | 83.3 | Confident | 74.5 | Confident | 171 Ų | 171 | 117.9 Ų | 117.9 | 74% | 0.743 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -68.8 | -35.7 | 174.9 | -77.4 | 179.9 | 175.9 | -176.8 | 0 | 112.8 | Y50 | Y50-K54 VanDerWaalsContact O-CB 3.32Å; Y50-K54 WeakPolarHBondContact O-CB 3.41Å; Y50-K54 VanDerWaalsContact O-CG 3.28Å; Y50-K54 WeakPolarHBondContact O-CG 3.49Å; Y50-K54 PolarHBondContact O-N 2.77Å |
| 55 | S | 80.4 | Confident | 72.7 | Confident | 86 Ų | 86 | 113.6 Ų | 113.6 | 60% | 0.601 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -82 | -16.9 | -176.5 | 69.9 | 0 | 0 | 0 | 0 | 113.9 | N51 M52 P57 | N51-S55 WeakPolarHBondContact O-CB 3.44Å; N51-S55 PolarHBondContact O-N 2.92Å; N51-S55 PolarHBondContact O-OG 2.82Å; M52-S55 PolarHBondContact O-N 3.35Å; M52-S55 PolarHBondContact O-OG 3.46Å; S55-P57 WeakPolarHBondContact O-CD 3.5Å; S55-P57 VanDerWaalsContact O-N 3.11Å |
| 56 | R | 71 | Confident | 70.9 | Confident | 177 Ų | 177 | 111.4 Ų | 111.4 | 67% | 0.668 | 61% | 0.611 | S | S | * | * | S | Bend | trans | -64.5 | 106.8 | 164.3 | -67.5 | -82.9 | -145 | -98.7 | -0.4 | 106.4 | M52 L58 | M52-R56 VanDerWaalsContact O-CG 3.27Å; M52-R56 WeakPolarHBondContact O-CG 3.27Å; M52-R56 PolarHBondContact O-N 3.29Å; R56-L58 PolarHBondContact O-N 3.45Å |
| 57 | P | 61.9 | Low | 69 | Low | 95 Ų | 95 | 113 Ų | 113 | 62% | 0.617 | 62% | 0.619 | S | S | * | * | trans | -55.5 | 141.1 | 162.5 | 27.6 | -33 | 0 | 0 | 0 | 105.7 | S55 M59 | S55-P57 WeakPolarHBondContact O-CD 3.5Å; S55-P57 VanDerWaalsContact O-N 3.11Å; P57-M59 HydrophobicContact CB-CG 4.31Å; P57-M59 HydrophobicContact CG-CG 4.01Å; P57-M59 PolarHBondContact O-N 3.12Å | ||
| 58 | L | 61.8 | Low | 66.9 | Low | 169 Ų | 169 | 114.7 Ų | 114.7 | 89% | 0.885 | 62% | 0.621 | S | S | * | * | trans | -67 | 61.8 | 172.2 | -167.6 | 67.3 | 0 | 0 | 0 | 108.6 | R56 K60 | R56-L58 PolarHBondContact O-N 3.45Å; L58-K60 PolarHBondContact O-N 2.79Å | ||
| 59 | M | 53.9 | Low | 65.2 | Low | 126 Ų | 126 | 119.9 Ų | 119.9 | 62% | 0.621 | 64% | 0.641 | S | S | * | * | trans | -71.8 | 78.7 | 162 | -75.9 | -81.3 | 147.9 | 0 | 0 | 104.9 | P57 D61 S62 | P57-M59 HydrophobicContact CB-CG 4.31Å; P57-M59 HydrophobicContact CG-CG 4.01Å; P57-M59 PolarHBondContact O-N 3.12Å; M59-D61 PolarHBondContact O-N 3.27Å; M59-S62 PolarHBondContact O-N 3.33Å | ||
| 60 | K | 53.7 | Low | 63.6 | Low | 165 Ų | 165 | 120.5 Ų | 120.5 | 72% | 0.717 | 65% | 0.65 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -52.9 | -16.6 | 164.8 | -175.1 | 72.6 | 178 | -162.9 | 0 | 111 | L58 | L58-K60 PolarHBondContact O-N 2.79Š|
| 61 | D | 53.8 | Low | 62 | Low | 139 Ų | 139 | 116.9 Ų | 116.9 | 74% | 0.743 | 64% | 0.643 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -121.8 | 30.9 | -173.4 | -49.1 | -42.7 | 0 | 0 | 0 | 113.5 | M59 | M59-D61 PolarHBondContact O-N 3.27Š|
| 62 | S | 47 | Very low | 61 | Low | 81 Ų | 81 | 118.1 Ų | 118.1 | 57% | 0.566 | 66% | 0.655 | S | S | * | * | trans | -119.7 | 31.6 | 166.7 | -54.1 | 0 | 0 | 0 | 0 | 113.4 | M59 | M59-S62 PolarHBondContact O-N 3.33Š| ||
| 63 | F | 50.8 | Low | 60.3 | Low | 170 Ų | 170 | 116.4 Ų | 116.4 | 75% | 0.746 | 66% | 0.664 | S | S | * | * | S | Bend | trans | -54.6 | 131.5 | 131.4 | -68.3 | -77.9 | 0 | 0 | 0 | 105.3 | S65 | F63-S65 PolarHBondContact O-N 3.21Š|
| 64 | P | 50.9 | Low | 59.8 | Low | 116 Ų | 116 | 119.4 Ų | 119.4 | 75% | 0.753 | 67% | 0.672 | S | S | * | * | trans | -64.9 | 82.4 | 161.1 | 30 | -32.4 | 0 | 0 | 0 | 106.4 | G66 | P64-G66 PolarHBondContact O-N 3.16Å; P64-G66 VanDerWaalsContact O-N 3.1Å | ||
| 65 | S | 47.5 | Very low | 59.6 | Low | 113 Ų | 113 | 115.7 Ų | 115.7 | 79% | 0.79 | 66% | 0.663 | S | S | * | * | -68.3 | 43.8 | 129.5 | -69.9 | 0 | 0 | 0 | 0 | 107.7 | F63 N67 | F63-S65 PolarHBondContact O-N 3.21Å; S65-N67 VanDerWaalsContact C-N 3.29Å; S65-N67 PolarHBondContact O-N 3.07Å | |||
| 66 | G | 49.1 | Very low | 59.6 | Low | 45 Ų | 45 | 118.4 Ų | 118.4 | 46% | 0.464 | 67% | 0.669 | S | S | . | * | trans | -61.6 | 110.6 | 154.4 | 0 | 0 | 0 | 0 | 0 | 102.1 | P64 L68 | P64-G66 PolarHBondContact O-N 3.16Å; P64-G66 VanDerWaalsContact O-N 3.1Å; G66-L68 VanDerWaalsContact C-N 3.32Å; G66-L68 PolarHBondContact O-N 3.09Å | ||
| 67 | N | 48.7 | Very low | 60.2 | Low | 133 Ų | 133 | 113.7 Ų | 113.7 | 71% | 0.711 | 66% | 0.662 | S | S | * | * | trans | -29.9 | 104 | 163.8 | -88.5 | -62.9 | 0 | 0 | 0 | 107.6 | S65 D69 | S65-N67 VanDerWaalsContact C-N 3.29Å; S65-N67 PolarHBondContact O-N 3.07Å; N67-D69 WeakPolarHBondContact CB-OD2 3.47Å; N67-D69 PolarHBondContact O-N 2.78Å | ||
| 68 | L | 49.2 | Very low | 61.4 | Low | 123 Ų | 123 | 112.5 Ų | 112.5 | 64% | 0.644 | 65% | 0.653 | S | S | * | * | trans | -75 | 52.5 | 172.4 | -124 | 87.5 | 0 | 0 | 0 | 106 | G66 S70 | G66-L68 VanDerWaalsContact C-N 3.32Å; G66-L68 PolarHBondContact O-N 3.09Å; L68-S70 CarbonylContact O-C 3.6Å; L68-S70 PolarHBondContact O-N 3.01Å; L68-S70 VanDerWaalsContact O-N 3.1Å | ||
| 69 | D | 57.5 | Low | 62.6 | Low | 141 Ų | 141 | 110.2 Ų | 110.2 | 75% | 0.754 | 65% | 0.646 | S | S | * | * | S | Bend | trans | -68.2 | -5.8 | 175.4 | -68.7 | -19.2 | 0 | 0 | 0 | 110.6 | N67 | N67-D69 WeakPolarHBondContact CB-OD2 3.47Å; N67-D69 PolarHBondContact O-N 2.78Å |
| 70 | S | 60.1 | Low | 64.1 | Low | 72 Ų | 72 | 109.8 Ų | 109.8 | 50% | 0.503 | 65% | 0.646 | S | S | . | * | S | Bend | trans | -125.8 | 102.5 | 155.6 | 67.5 | 0 | 0 | 0 | 0 | 109 | L68 T72 | L68-S70 CarbonylContact O-C 3.6Å; L68-S70 PolarHBondContact O-N 3.01Å; L68-S70 VanDerWaalsContact O-N 3.1Å; S70-T72 PolarHBondContact O-N 3.34Å; S70-T72 VanDerWaalsContact O-N 3.17Å |
| 71 | P | 58.4 | Low | 65.5 | Low | 55 Ų | 55 | 105.1 Ų | 105.1 | 36% | 0.357 | 63% | 0.629 | S | S | . | * | trans | -47.6 | 127 | 162.5 | 16.9 | -30.4 | 0 | 0 | 0 | 108.9 | G73 D74 | P71-G73 PolarHBondContact O-N 3.23Å; P71-D74 HydrophobicContact CB-CB 4.49Å; P71-D74 WeakPolarHBondContact CB-OD2 3.2Å; P71-D74 HydrophobicContact CG-CB 3.77Å; P71-D74 VanDerWaalsContact CG-CG 3.44Å; P71-D74 WeakPolarHBondContact CG-OD2 3.41Å; P71-D74 PolarHBondContact O-N 3.42Å; P71-D74 VanDerWaalsContact O-N 3.12Å | ||
| 72 | T | 68.8 | Low | 66.9 | Low | 138 Ų | 138 | 101.7 Ų | 101.7 | 85% | 0.847 | 61% | 0.61 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -54.7 | 102.6 | 175.9 | -62.2 | 0 | 0 | 0 | 0 | 108 | S70 | S70-T72 PolarHBondContact O-N 3.34Å; S70-T72 VanDerWaalsContact O-N 3.17Å |
| 73 | G | 72.2 | Confident | 68.6 | Low | 69 Ų | 69 | 101.4 Ų | 101.4 | 71% | 0.711 | 61% | 0.608 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 124.8 | -20.9 | 178.7 | 0 | 0 | 0 | 0 | 0 | 116.4 | P71 | P71-G73 PolarHBondContact O-N 3.23Š|
| 74 | D | 76.3 | Confident | 70.1 | Confident | 124 Ų | 124 | 97.5 Ų | 97.5 | 66% | 0.663 | 59% | 0.594 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.8 | -22.6 | -170.8 | -67.1 | -4.6 | 0 | 0 | 0 | 113.7 | P71 | P71-D74 HydrophobicContact CB-CB 4.49Å; P71-D74 WeakPolarHBondContact CB-OD2 3.2Å; P71-D74 HydrophobicContact CG-CB 3.77Å; P71-D74 VanDerWaalsContact CG-CG 3.44Å; P71-D74 WeakPolarHBondContact CG-OD2 3.41Å; P71-D74 PolarHBondContact O-N 3.42Å; P71-D74 VanDerWaalsContact O-N 3.12Å |
| 75 | T | 78.9 | Confident | 71.3 | Confident | 92 Ų | 92 | 96.6 Ų | 96.6 | 56% | 0.564 | 58% | 0.582 | S | S | * | * | S | Bend | trans | -100.4 | 107.1 | 177.9 | -51.5 | 0 | 0 | 0 | 0 | 110.4 | ||
| 76 | I | 80.8 | Confident | 72.7 | Confident | 143 Ų | 143 | 99.4 Ų | 99.4 | 73% | 0.733 | 58% | 0.575 | S | S | * | * | P | Polyproline II helix | trans | -63.2 | 129.6 | 168.6 | -60.3 | 177.9 | 0 | 0 | 0 | 108 | T78 | I76-T78 PolarHBondContact O-N 3.2Å; I76-T78 VanDerWaalsContact O-N 3.13Å |
| 77 | P | 82.5 | Confident | 73.9 | Confident | 79 Ų | 79 | 101.2 Ų | 101.2 | 51% | 0.513 | 58% | 0.581 | S | S | . | * | P | Polyproline II helix | trans | -62.1 | 118.4 | 178.3 | 22.8 | -31.1 | 0 | 0 | 0 | 110.6 | I82 L85 | P77-I82 HydrophobicContact CB-CG1 4.13Å; P77-L85 HydrophobicContact CB-CD1 4.37Å |
| 78 | T | 86.9 | Confident | 75 | Confident | 70 Ų | 70 | 101.7 Ų | 101.7 | 43% | 0.429 | 58% | 0.577 | S | S | . | * | P | Polyproline II helix | trans | -81.7 | 158.6 | 167.7 | 55.6 | 0 | 0 | 0 | 0 | 110.2 | I76 D80 N81 I82 | I76-T78 PolarHBondContact O-N 3.2Å; I76-T78 VanDerWaalsContact O-N 3.13Å; T78-D80 PolarHBondContact O-N 3.48Å; T78-D80 VanDerWaalsContact O-N 3.12Å; T78-N81 PolarHBondContact O-N 3.2Å; T78-N81 PolarHBondContact OG1-ND2 3.16Å; T78-I82 WeakPolarHBondContact O-CG1 3.46Å; T78-I82 PolarHBondContact O-N 3.04Å |
| 79 | V | 87.7 | Confident | 75.9 | Confident | 120 Ų | 120 | 99.5 Ų | 99.5 | 73% | 0.727 | 57% | 0.572 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -53.1 | -36.2 | -175.8 | -66.4 | 0 | 0 | 0 | 0 | 113.5 | ||
| 80 | D | 86.2 | Confident | 76.1 | Confident | 118 Ų | 118 | 98.6 Ų | 98.6 | 63% | 0.631 | 57% | 0.566 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.2 | -26.5 | -179.6 | -53.9 | -54.2 | 0 | 0 | 0 | 113 | T78 | T78-D80 PolarHBondContact O-N 3.48Å; T78-D80 VanDerWaalsContact O-N 3.12Å |
| 81 | N | 82.4 | Confident | 76 | Confident | 66 Ų | 66 | 99.5 Ų | 99.5 | 35% | 0.353 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -88.1 | -15.9 | -172.7 | -70.4 | -8.3 | 0 | 0 | 0 | 113.4 | T78 S83 I84 L85 | T78-N81 PolarHBondContact O-N 3.2Å; T78-N81 PolarHBondContact OG1-ND2 3.16Å; N81-S83 PolarHBondContact O-N 3.5Å; N81-I84 PolarHBondContact O-N 3.19Å; N81-L85 WeakPolarHBondContact O-CG 3.43Å; N81-L85 PolarHBondContact O-N 3.22Å; N81-L85 VanDerWaalsContact O-N 3.14Å |
| 82 | I | 82.5 | Confident | 75.8 | Confident | 68 Ų | 68 | 104 Ų | 104 | 35% | 0.349 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -65.4 | -42.5 | -173.5 | -66.1 | 155.5 | 0 | 0 | 0 | 112.2 | P77 T78 L85 R86 | P77-I82 HydrophobicContact CB-CG1 4.13Å; T78-I82 WeakPolarHBondContact O-CG1 3.46Å; T78-I82 PolarHBondContact O-N 3.04Å; I82-L85 PolarHBondContact O-N 2.87Å; I82-R86 WeakPolarHBondContact O-CG 3.16Å; I82-R86 PolarHBondContact O-N 3.35Å; I82-R86 VanDerWaalsContact O-N 3.15Å |
| 83 | S | 84.4 | Confident | 74.9 | Confident | 75 Ų | 75 | 105.6 Ų | 105.6 | 52% | 0.524 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -62.4 | -44.2 | -179.4 | 57.1 | 0 | 0 | 0 | 0 | 111.2 | N81 L85 R86 S87 | N81-S83 PolarHBondContact O-N 3.5Å; S83-L85 PolarHBondContact O-N 3.37Å; S83-R86 PolarHBondContact O-N 3.42Å; S83-S87 PolarHBondContact O-N 2.93Å; S83-S87 PolarHBondContact O-OG 3.4Å |
| 84 | I | 80.6 | Confident | 73.6 | Confident | 88 Ų | 88 | 107.7 Ų | 107.7 | 45% | 0.451 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -64.2 | -42.3 | 179.8 | -58.8 | 165.8 | 0 | 0 | 0 | 110.9 | N81 S87 K88 | N81-I84 PolarHBondContact O-N 3.19Å; I84-S87 PolarHBondContact O-N 3.44Å; I84-K88 HydrophobicContact CG2-CD 4.37Å; I84-K88 WeakPolarHBondContact O-CG 3.44Å; I84-K88 PolarHBondContact O-N 3.38Å |
| 85 | L | 77.4 | Confident | 72.2 | Confident | 96 Ų | 96 | 109.8 Ų | 109.8 | 50% | 0.503 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -64.5 | -39.6 | 178.3 | -69.8 | 174.6 | 0 | 0 | 0 | 112.2 | P77 N81 I82 S83 K88 S89 | P77-L85 HydrophobicContact CB-CD1 4.37Å; N81-L85 WeakPolarHBondContact O-CG 3.43Å; N81-L85 PolarHBondContact O-N 3.22Å; N81-L85 VanDerWaalsContact O-N 3.14Å; I82-L85 PolarHBondContact O-N 2.87Å; S83-L85 PolarHBondContact O-N 3.37Å; L85-K88 PolarHBondContact O-N 3.03Å; L85-S89 PolarHBondContact O-N 3.45Å |
| 86 | R | 77.1 | Confident | 70.5 | Confident | 172 Ų | 172 | 111.9 Ų | 111.9 | 65% | 0.649 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -63.9 | -42.6 | 177.2 | -74.5 | 178.8 | 128.8 | 144.5 | -0.3 | 112.7 | I82 S83 K88 S89 I90 | I82-R86 WeakPolarHBondContact O-CG 3.16Å; I82-R86 PolarHBondContact O-N 3.35Å; I82-R86 VanDerWaalsContact O-N 3.15Å; S83-R86 PolarHBondContact O-N 3.42Å; R86-K88 VanDerWaalsContact C-N 3.31Å; R86-K88 PolarHBondContact O-N 2.67Å; R86-S89 PolarHBondContact O-N 3.18Å; R86-S89 PolarHBondContact O-OG 3.21Å; R86-S89 VanDerWaalsContact O-OG 3.08Å; R86-I90 WeakPolarHBondContact O-CG1 3.41Å; R86-I90 PolarHBondContact O-N 2.96Å |
| 87 | S | 73.8 | Confident | 68.3 | Low | 84 Ų | 84 | 111 Ų | 111 | 59% | 0.587 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -65.3 | -35.4 | 179.1 | -60.2 | 0 | 0 | 0 | 0 | 112.4 | S83 I84 S89 I90 | S83-S87 PolarHBondContact O-N 2.93Å; S83-S87 PolarHBondContact O-OG 3.4Å; I84-S87 PolarHBondContact O-N 3.44Å; S87-S89 PolarHBondContact O-N 2.86Å; S87-I90 PolarHBondContact O-N 3.27Å |
| 88 | K | 71.6 | Confident | 66.2 | Low | 142 Ų | 142 | 114.3 Ų | 114.3 | 62% | 0.617 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -65.4 | -36 | 178.1 | -71.7 | 175 | 178.2 | -172.3 | 0 | 112.9 | I84 L85 R86 | I84-K88 HydrophobicContact CG2-CD 4.37Å; I84-K88 WeakPolarHBondContact O-CG 3.44Å; I84-K88 PolarHBondContact O-N 3.38Å; L85-K88 PolarHBondContact O-N 3.03Å; R86-K88 VanDerWaalsContact C-N 3.31Å; R86-K88 PolarHBondContact O-N 2.67Å |
| 89 | S | 67.7 | Low | 63.6 | Low | 78 Ų | 78 | 115.2 Ų | 115.2 | 55% | 0.545 | 64% | 0.638 | S | S | . | * | H | α-helix | trans | -76.4 | -30.1 | 179.7 | 67.9 | 0 | 0 | 0 | 0 | 113.5 | L85 R86 S87 | L85-S89 PolarHBondContact O-N 3.45Å; R86-S89 PolarHBondContact O-N 3.18Å; R86-S89 PolarHBondContact O-OG 3.21Å; R86-S89 VanDerWaalsContact O-OG 3.08Å; S87-S89 PolarHBondContact O-N 2.86Å |
| 90 | I | 63 | Low | 61.9 | Low | 121 Ų | 121 | 116.1 Ų | 116.1 | 62% | 0.621 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -78.4 | -29.5 | -174 | -66.5 | 167.8 | 0 | 0 | 0 | 112.2 | R86 S87 L92 Q93 | R86-I90 WeakPolarHBondContact O-CG1 3.41Å; R86-I90 PolarHBondContact O-N 2.96Å; S87-I90 PolarHBondContact O-N 3.27Å; I90-L92 PolarHBondContact O-N 3.4Å; I90-Q93 PolarHBondContact O-N 3.2Å |
| 91 | S | 58 | Low | 59.2 | Low | 91 Ų | 91 | 119.1 Ų | 119.1 | 64% | 0.636 | 66% | 0.657 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.4 | -3.3 | -179.3 | -170.8 | 0 | 0 | 0 | 0 | 114.8 | ||
| 92 | L | 53.3 | Low | 57 | Low | 150 Ų | 150 | 120.8 Ų | 120.8 | 79% | 0.785 | 67% | 0.674 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.5 | 0.5 | 179 | -75.8 | 164 | 0 | 0 | 0 | 113.8 | I90 | I90-L92 PolarHBondContact O-N 3.4Š|
| 93 | Q | 49 | Very low | 55 | Low | 171 Ų | 171 | 124.3 Ų | 124.3 | 80% | 0.799 | 70% | 0.699 | S | S | * | * | S | Bend | trans | -136 | 70.5 | -176.6 | -66.6 | -176 | 17.6 | 0 | 0 | 112.8 | I90 | I90-Q93 PolarHBondContact O-N 3.2Š|
| 94 | N | 46.5 | Very low | 52.5 | Low | 114 Ų | 114 | 127 Ų | 127 | 61% | 0.61 | 71% | 0.712 | S | S | * | * | trans | -162.8 | 64.3 | 166.9 | 43 | -15.2 | 0 | 0 | 0 | 109.3 | ||||
| 95 | N | 45.6 | Very low | 50.1 | Low | 168 Ų | 168 | 126.3 Ų | 126.3 | 90% | 0.898 | 72% | 0.72 | S | S | * | * | trans | -155.3 | 52.4 | 157.1 | -92.4 | -10 | 0 | 0 | 0 | 109.5 | ||||
| 96 | T | 43.1 | Very low | 47.8 | Very low | 135 Ų | 135 | 127.5 Ų | 127.5 | 83% | 0.828 | 73% | 0.734 | S | S | * | * | trans | -134.6 | 44.3 | 173.3 | -20.3 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 97 | T | 35 | Very low | 45.7 | Very low | 125 Ų | 125 | 124.9 Ų | 124.9 | 77% | 0.767 | 74% | 0.738 | S | S | * | * | trans | -156.5 | 76.1 | 163.1 | -39.8 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 98 | V | 38.8 | Very low | 44 | Very low | 149 Ų | 149 | 126.1 Ų | 126.1 | 90% | 0.903 | 74% | 0.742 | S | S | * | * | trans | -103.1 | 100.7 | 151.5 | -75.5 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 99 | S | 33 | Very low | 42.8 | Very low | 89 Ų | 89 | 124.7 Ų | 124.7 | 62% | 0.622 | 75% | 0.747 | S | S | * | * | trans | -52.9 | 146.3 | 171.1 | -59.8 | 0 | 0 | 0 | 0 | 110.9 | Q101 | S99-Q101 PolarHBondContact O-N 3.42Å; S99-Q101 VanDerWaalsContact O-N 3.08Å | ||
| 100 | P | 50.4 | Low | 41.3 | Very low | 139 Ų | 139 | 126.9 Ų | 126.9 | 90% | 0.903 | 76% | 0.757 | S | S | * | * | trans | -75.4 | 101.8 | -179.9 | 30.6 | -30.8 | 0 | 0 | 0 | 108.7 | ||||
| 101 | Q | 30.5 | Very low | 40.4 | Very low | 180 Ų | 180 | 125.4 Ų | 125.4 | 84% | 0.841 | 76% | 0.758 | S | S | * | * | trans | -144.6 | 89.2 | 174.1 | -157.8 | 174.5 | 19.6 | 0 | 0 | 110.6 | S99 | S99-Q101 PolarHBondContact O-N 3.42Å; S99-Q101 VanDerWaalsContact O-N 3.08Å | ||
| 102 | S | 34.8 | Very low | 39.6 | Very low | 102 Ų | 102 | 126.8 Ų | 126.8 | 71% | 0.713 | 76% | 0.763 | S | S | * | * | -175.4 | 111.1 | 124.7 | 54.5 | 0 | 0 | 0 | 0 | 108.3 | T104 | S102-T104 PolarHBondContact O-N 3.47Š| |||
| 103 | T | 41.5 | Very low | 39.2 | Very low | 141 Ų | 141 | 124.2 Ų | 124.2 | 87% | 0.865 | 76% | 0.757 | S | S | * | * | trans | -32.5 | 115.1 | 156.5 | 47.1 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 104 | T | 32 | Very low | 38.7 | Very low | 132 Ų | 132 | 121.4 Ų | 121.4 | 81% | 0.81 | 75% | 0.752 | S | S | * | * | trans | -140.9 | 127.5 | 146.4 | -53.4 | 0 | 0 | 0 | 0 | 107.4 | S102 | S102-T104 PolarHBondContact O-N 3.47Š| ||
| 105 | A | 30.7 | Very low | 38.8 | Very low | 74 Ų | 74 | 119.8 Ų | 119.8 | 61% | 0.612 | 75% | 0.754 | S | S | * | * | trans | -27 | 138.7 | -174.3 | 0 | 0 | 0 | 0 | 0 | 116.2 | T107 | A105-T107 VanDerWaalsContact C-N 3.34Å; A105-T107 PolarHBondContact O-N 2.95Å; A105-T107 PolarHBondContact O-OG1 3.1Å | ||
| 106 | C | 29.2 | Very low | 38.8 | Very low | 120 Ų | 120 | 116.7 Ų | 116.7 | 81% | 0.811 | 74% | 0.741 | S | S | * | * | trans | -34.5 | 101.4 | 143.5 | 174.5 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 107 | T | 32.6 | Very low | 39.3 | Very low | 118 Ų | 118 | 116 Ų | 116 | 72% | 0.724 | 74% | 0.737 | S | S | * | * | trans | -119.9 | 99.6 | 155.7 | 19.2 | 0 | 0 | 0 | 0 | 104 | A105 P109 | A105-T107 VanDerWaalsContact C-N 3.34Å; A105-T107 PolarHBondContact O-N 2.95Å; A105-T107 PolarHBondContact O-OG1 3.1Å; T107-P109 WeakPolarHBondContact O-CD 3.29Å; T107-P109 VanDerWaalsContact O-N 3.15Å | ||
| 108 | T | 37.5 | Very low | 40.3 | Very low | 110 Ų | 110 | 115.1 Ų | 115.1 | 68% | 0.675 | 73% | 0.732 | S | S | * | * | trans | -48.3 | 112.8 | 156 | 26.3 | 0 | 0 | 0 | 0 | 107.9 | T110 | T108-T110 PolarHBondContact O-N 3.24Š| ||
| 109 | P | 45.9 | Very low | 40.7 | Very low | 111 Ų | 111 | 112.5 Ų | 112.5 | 72% | 0.721 | 72% | 0.719 | S | S | * | * | trans | -72.9 | 95 | 155.3 | 30.9 | -26.2 | 0 | 0 | 0 | 105.6 | T107 S111 | T107-P109 WeakPolarHBondContact O-CD 3.29Å; T107-P109 VanDerWaalsContact O-N 3.15Å; P109-S111 PolarHBondContact O-N 3.25Å | ||
| 110 | T | 37.1 | Very low | 42 | Very low | 124 Ų | 124 | 113.1 Ų | 113.1 | 76% | 0.761 | 72% | 0.724 | S | S | * | * | trans | -62 | 75.9 | 148.1 | -52.5 | 0 | 0 | 0 | 0 | 106.6 | T108 | T108-T110 PolarHBondContact O-N 3.24Š| ||
| 111 | S | 44.2 | Very low | 43.1 | Very low | 90 Ų | 90 | 116.9 Ų | 116.9 | 63% | 0.629 | 72% | 0.721 | S | S | * | * | trans | -109.3 | 93 | 158.6 | 70.1 | 0 | 0 | 0 | 0 | 105.8 | P109 S113 | P109-S111 PolarHBondContact O-N 3.25Å; S111-S113 PolarHBondContact O-N 3.44Å | ||
| 112 | T | 39.9 | Very low | 44.9 | Very low | 121 Ų | 121 | 115.3 Ų | 115.3 | 74% | 0.742 | 72% | 0.717 | S | S | * | * | trans | -60.7 | 74.1 | 162.5 | -44.6 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 113 | S | 44.9 | Very low | 46.8 | Very low | 95 Ų | 95 | 116.6 Ų | 116.6 | 66% | 0.664 | 72% | 0.721 | S | S | * | * | trans | -97.3 | 87 | 163.1 | -178.1 | 0 | 0 | 0 | 0 | 105.6 | S111 A115 | S111-S113 PolarHBondContact O-N 3.44Å; S113-A115 PolarHBondContact O-N 3.16Å | ||
| 114 | T | 40.3 | Very low | 48.4 | Very low | 112 Ų | 112 | 116.9 Ų | 116.9 | 69% | 0.687 | 72% | 0.716 | S | S | * | * | trans | -61.6 | 76.4 | 167.1 | -39.9 | 0 | 0 | 0 | 0 | 107.7 | T116 | T114-T116 PolarHBondContact O-N 2.92Š| ||
| 115 | A | 47 | Very low | 50 | Low | 80 Ų | 80 | 115.9 Ų | 115.9 | 66% | 0.661 | 71% | 0.711 | S | S | * | * | trans | -74.8 | 83.6 | 165.8 | 0 | 0 | 0 | 0 | 0 | 105.6 | S113 T117 | S113-A115 PolarHBondContact O-N 3.16Å; A115-T117 PolarHBondContact O-N 3.47Å | ||
| 116 | T | 45.9 | Very low | 52.1 | Low | 103 Ų | 103 | 116.9 Ų | 116.9 | 63% | 0.632 | 72% | 0.72 | S | S | * | * | trans | -56.9 | 91.8 | 171 | -54 | 0 | 0 | 0 | 0 | 107.7 | T114 T118 | T114-T116 PolarHBondContact O-N 2.92Å; T116-T118 WeakPolarHBondContact CG2-OG1 3.14Å; T116-T118 PolarHBondContact O-N 3.46Å | ||
| 117 | T | 53.4 | Low | 54.3 | Low | 120 Ų | 120 | 121.6 Ų | 121.6 | 74% | 0.736 | 72% | 0.721 | S | S | * | * | trans | -75.7 | 84.7 | 161.9 | -64.3 | 0 | 0 | 0 | 0 | 105.3 | A115 C119 | A115-T117 PolarHBondContact O-N 3.47Å; T117-C119 PolarHBondContact O-N 3.36Å | ||
| 118 | T | 56.4 | Low | 56.1 | Low | 107 Ų | 107 | 122.2 Ų | 122.2 | 66% | 0.656 | 72% | 0.724 | S | S | * | * | trans | -67.3 | 102.9 | 167.3 | -76.7 | 0 | 0 | 0 | 0 | 106.8 | T116 S120 | T116-T118 WeakPolarHBondContact CG2-OG1 3.14Å; T116-T118 PolarHBondContact O-N 3.46Å; T118-S120 PolarHBondContact O-N 3.18Å | ||
| 119 | C | 47.2 | Very low | 57.8 | Low | 95 Ų | 95 | 124.6 Ų | 124.6 | 64% | 0.642 | 73% | 0.728 | S | S | * | * | trans | -72.8 | 98.2 | 163.4 | -60.6 | 0 | 0 | 0 | 0 | 107.6 | T117 Y121 | T117-C119 PolarHBondContact O-N 3.36Å; C119-Y121 PolarHBondContact O-N 3.46Å | ||
| 120 | S | 61.4 | Low | 58.7 | Low | 102 Ų | 102 | 125.7 Ų | 125.7 | 71% | 0.713 | 73% | 0.732 | S | S | * | * | trans | -75 | 105.5 | 166.6 | 38.6 | 0 | 0 | 0 | 0 | 108.8 | T118 I122 | T118-S120 PolarHBondContact O-N 3.18Å; S120-I122 PolarHBondContact O-N 3.11Å | ||
| 121 | Y | 72.1 | Confident | 59.5 | Low | 217 Ų | 217 | 124.3 Ų | 124.3 | 85% | 0.851 | 73% | 0.734 | S | S | * | * | trans | -68 | 124.2 | 163.8 | -91 | -90.6 | 0 | 0 | 0 | 108.6 | C119 | C119-Y121 PolarHBondContact O-N 3.46Š| ||
| 122 | I | 69.1 | Low | 60.5 | Low | 148 Ų | 148 | 133.3 Ų | 133.3 | 76% | 0.759 | 76% | 0.761 | S | S | * | * | trans | -86.6 | 112.8 | 166.1 | -64.5 | 172.8 | 0 | 0 | 0 | 106.9 | S120 I124 | S120-I122 PolarHBondContact O-N 3.11Å; I122-I124 PolarHBondContact O-N 3.18Å | ||
| 123 | T | 75.2 | Confident | 61.5 | Low | 129 Ų | 129 | 133.9 Ų | 133.9 | 79% | 0.791 | 76% | 0.762 | S | S | * | * | P | Polyproline II helix | trans | -77 | 118.2 | 170.1 | -59 | 0 | 0 | 0 | 0 | 109 | ||
| 124 | I | 73.8 | Confident | 62.4 | Low | 146 Ų | 146 | 135.9 Ų | 135.9 | 75% | 0.749 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -86.9 | 124.5 | 173.5 | -54 | 175.1 | 0 | 0 | 0 | 107.8 | I122 | I122-I124 PolarHBondContact O-N 3.18Š|
| 125 | P | 66.7 | Low | 63.6 | Low | 111 Ų | 111 | 137.3 Ų | 137.3 | 72% | 0.721 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -67.4 | 140.8 | 179.3 | 26.3 | -32.8 | 0 | 0 | 0 | 111.7 | R127 | P125-R127 PolarHBondContact O-N 3.41Š|
| 126 | A | 74.8 | Confident | 64.6 | Low | 96 Ų | 96 | 140.6 Ų | 140.6 | 79% | 0.793 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -62.6 | 126 | 177.9 | 0 | 0 | 0 | 0 | 0 | 110.7 | T128 | A126-T128 PolarHBondContact O-N 3.25Š|
| 127 | R | 75.2 | Confident | 65.8 | Low | 219 Ų | 219 | 143 Ų | 143 | 83% | 0.826 | 79% | 0.787 | S | S | * | * | trans | -77.7 | 99.3 | 174.7 | -176.7 | 175.9 | 179 | 165.9 | 0 | 109.2 | P125 Q129 | P125-R127 PolarHBondContact O-N 3.41Å; R127-Q129 PolarHBondContact O-N 3.37Å | ||
| 128 | T | 70.3 | Confident | 66.6 | Low | 130 Ų | 130 | 144.5 Ų | 144.5 | 80% | 0.798 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -67.7 | 122.2 | 170.2 | -9.7 | 0 | 0 | 0 | 0 | 109.4 | A126 | A126-T128 PolarHBondContact O-N 3.25Š|
| 129 | Q | 73.8 | Confident | 67.3 | Low | 160 Ų | 160 | 147.2 Ų | 147.2 | 75% | 0.748 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -80.3 | 126 | 168.2 | -67.9 | -82.8 | 21.4 | 0 | 0 | 108 | R127 A131 | R127-Q129 PolarHBondContact O-N 3.37Å; Q129-A131 PolarHBondContact O-N 3.42Å |
| 130 | V | 63.4 | Low | 68.9 | Low | 134 Ų | 134 | 151.2 Ų | 151.2 | 81% | 0.812 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -72.4 | 123.3 | 176.5 | 175.7 | 0 | 0 | 0 | 0 | 108.2 | K132 | V130-K132 PolarHBondContact O-N 3.11Š|
| 131 | A | 55.5 | Low | 69.5 | Low | 96 Ų | 96 | 155.3 Ų | 155.3 | 79% | 0.793 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -58.8 | 131.5 | 170.7 | 0 | 0 | 0 | 0 | 0 | 110 | Q129 | Q129-A131 PolarHBondContact O-N 3.42Š|
| 132 | K | 64.1 | Low | 69.3 | Low | 278 Ų | 278 | 149.7 Ų | 149.7 | 100% | 1.209 | 82% | 0.818 | S | S | * | * | trans | -119.8 | 0 | 156.6 | -89.6 | -176.1 | 175.8 | 176 | 0 | 107.8 | V130 | V130-K132 PolarHBondContact O-N 3.11Š|
Retrieved 132 of 132 residues in 32.8 ms
(Link to these results)