| 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 | 55.6 | Low | 79.5 | Confident | 246 Ų | 246 | 114.5 Ų | 114.5 | 100% | 1.212 | 67% | 0.667 | S | S | * | * | 0 | 131.5 | 0 | -77.5 | 171.9 | 83.5 | 0 | 0 | 106.9 | |||||
| 2 | A | 64.3 | Low | 80.1 | Confident | 56 Ų | 56 | 110.8 Ų | 110.8 | 46% | 0.463 | 64% | 0.641 | S | S | . | * | trans | -65.4 | 135.7 | 178.4 | 0 | 0 | 0 | 0 | 0 | 110.4 | F14 | A2-F14 HydrophobicContact CB-CD1 3.78Å; A2-F14 HydrophobicContact CB-CE1 3.66Å | ||
| 3 | D | 79.4 | Confident | 80.3 | Confident | 81 Ų | 81 | 107.8 Ų | 107.8 | 43% | 0.433 | 64% | 0.637 | S | S | . | * | trans | -61.8 | 127.5 | 171.6 | 178.5 | -22.2 | 0 | 0 | 0 | 108.8 | K5 Y6 A7 | D3-K5 PolarHBondContact O-N 3.03Å; D3-K5 VanDerWaalsContact OD1-CB 3.27Å; D3-K5 WeakPolarHBondContact OD1-CB 3.47Å; D3-K5 PolarHBondContact OD1-N 3.01Å; D3-Y6 HydrophobicContact CB-CD2 3.81Å; D3-Y6 HydrophobicContact CB-CE2 4.22Å; D3-Y6 PolarHBondContact O-N 3.42Å; D3-A7 PolarHBondContact O-N 3.17Å | ||
| 4 | P | 85.1 | Confident | 80.3 | Confident | 112 Ų | 112 | 108.3 Ų | 108.3 | 73% | 0.727 | 63% | 0.628 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -56.4 | -23.1 | -178.2 | 23.7 | -35.8 | 0 | 0 | 0 | 113.5 | Y6 | P4-Y6 VanDerWaalsContact C-N 3.3Å; P4-Y6 PolarHBondContact O-N 3.05Å |
| 5 | K | 86.3 | Confident | 80.6 | Confident | 154 Ų | 154 | 111.7 Ų | 111.7 | 67% | 0.67 | 64% | 0.643 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.1 | -29.3 | 177.3 | -164.9 | 176.7 | -179.6 | -176.3 | 0 | 113.1 | D3 | D3-K5 PolarHBondContact O-N 3.03Å; D3-K5 VanDerWaalsContact OD1-CB 3.27Å; D3-K5 WeakPolarHBondContact OD1-CB 3.47Å; D3-K5 PolarHBondContact OD1-N 3.01Å |
| 6 | Y | 85.9 | Confident | 80.9 | Confident | 104 Ų | 104 | 112.4 Ų | 112.4 | 41% | 0.408 | 64% | 0.639 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -109.8 | -8.2 | -173.8 | -51.1 | -61.9 | 0 | 0 | 0 | 114.1 | D3 P4 N8 L9 | D3-Y6 HydrophobicContact CB-CD2 3.81Å; D3-Y6 HydrophobicContact CB-CE2 4.22Å; D3-Y6 PolarHBondContact O-N 3.42Å; P4-Y6 VanDerWaalsContact C-N 3.3Å; P4-Y6 PolarHBondContact O-N 3.05Å; Y6-N8 PolarHBondContact O-N 3.4Å; Y6-N8 VanDerWaalsContact O-N 3.16Å; Y6-L9 HydrophobicContact CD1-CD1 3.98Å; Y6-L9 PolarHBondContact O-N 3.17Å; Y6-L9 VanDerWaalsContact O-N 3.15Å |
| 7 | A | 82.9 | Confident | 81.2 | Confident | 51 Ų | 51 | 109.9 Ų | 109.9 | 42% | 0.421 | 63% | 0.628 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -59.6 | -28.3 | -175.4 | 0 | 0 | 0 | 0 | 0 | 114.9 | D3 | D3-A7 PolarHBondContact O-N 3.17Š|
| 8 | N | 83.7 | Confident | 81.5 | Confident | 155 Ų | 155 | 113.1 Ų | 113.1 | 83% | 0.829 | 64% | 0.642 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.1 | 0.8 | -177.6 | -64.7 | -32.1 | 0 | 0 | 0 | 113.7 | Y6 | Y6-N8 PolarHBondContact O-N 3.4Å; Y6-N8 VanDerWaalsContact O-N 3.16Å |
| 9 | L | 85.5 | Confident | 82.1 | Confident | 90 Ų | 90 | 111.9 Ų | 111.9 | 47% | 0.471 | 64% | 0.637 | S | S | . | * | S | Bend | trans | -90.2 | 125.8 | -179.6 | -69.8 | 166.8 | 0 | 0 | 0 | 109.9 | Y6 I12 | Y6-L9 HydrophobicContact CD1-CD1 3.98Å; Y6-L9 PolarHBondContact O-N 3.17Å; Y6-L9 VanDerWaalsContact O-N 3.15Å; L9-I12 HydrophobicContact CB-CD1 4.35Å; L9-I12 HydrophobicContact CB-CG1 3.84Å |
| 10 | P | 85.3 | Confident | 82.5 | Confident | 125 Ų | 125 | 114.8 Ų | 114.8 | 81% | 0.812 | 64% | 0.639 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.3 | 140.8 | 173.3 | 28.6 | -32.7 | 0 | 0 | 0 | 110.6 | ||
| 11 | G | 80.7 | Confident | 82.7 | Confident | 86 Ų | 86 | 117.1 Ų | 117.1 | 89% | 0.887 | 65% | 0.645 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 88.7 | 13.3 | 174.6 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||
| 12 | I | 86.5 | Confident | 84.1 | Confident | 70 Ų | 70 | 111.7 Ų | 111.7 | 36% | 0.359 | 63% | 0.626 | S | S | . | * | trans | -82.9 | 130.7 | 171.9 | -57.1 | -59.4 | 0 | 0 | 0 | 110 | L9 F14 | L9-I12 HydrophobicContact CB-CD1 4.35Å; L9-I12 HydrophobicContact CB-CG1 3.84Å; I12-F14 HydrophobicContact CB-CE1 4.39Å; I12-F14 HydrophobicContact CB-CE2 4.11Å; I12-F14 HydrophobicContact CB-CZ 3.9Å; I12-F14 HydrophobicContact CG2-CD1 4.38Å; I12-F14 HydrophobicContact CG2-CE1 3.97Å; I12-F14 HydrophobicContact CG2-CE2 4.42Å; I12-F14 HydrophobicContact CG2-CZ 4Å; I12-F14 VanDerWaalsContact O-CD2 3.23Å; I12-F14 WeakPolarHBondContact O-CD2 3.39Å; I12-F14 VanDerWaalsContact O-CE2 3.31Å; I12-F14 WeakPolarHBondContact O-CE2 3.31Å | ||
| 13 | A | 83.1 | Confident | 85 | Confident | 72 Ų | 72 | 112.1 Ų | 112.1 | 60% | 0.595 | 64% | 0.636 | S | S | * | * | trans | -79.8 | 120.1 | 173.7 | 0 | 0 | 0 | 0 | 0 | 109.8 | E16 | A13-E16 HydrophobicContact CB-CB 4.23Å; A13-E16 HydrophobicContact CB-CG 3.91Å | ||
| 14 | F | 80.1 | Confident | 85 | Confident | 114 Ų | 114 | 116 Ų | 116 | 50% | 0.5 | 66% | 0.657 | S | S | . | * | S | Bend | trans | -102.6 | -18.3 | -176.2 | -66 | -75.4 | 0 | 0 | 0 | 114.4 | A2 I12 | A2-F14 HydrophobicContact CB-CD1 3.78Å; A2-F14 HydrophobicContact CB-CE1 3.66Å; I12-F14 HydrophobicContact CB-CE1 4.39Å; I12-F14 HydrophobicContact CB-CE2 4.11Å; I12-F14 HydrophobicContact CB-CZ 3.9Å; I12-F14 HydrophobicContact CG2-CD1 4.38Å; I12-F14 HydrophobicContact CG2-CE1 3.97Å; I12-F14 HydrophobicContact CG2-CE2 4.42Å; I12-F14 HydrophobicContact CG2-CZ 4Å; I12-F14 VanDerWaalsContact O-CD2 3.23Å; I12-F14 WeakPolarHBondContact O-CD2 3.39Å; I12-F14 VanDerWaalsContact O-CE2 3.31Å; I12-F14 WeakPolarHBondContact O-CE2 3.31Å |
| 15 | N | 84.1 | Confident | 84.5 | Confident | 160 Ų | 160 | 116.2 Ų | 116.2 | 86% | 0.856 | 65% | 0.651 | S | S | * | * | S | Bend | trans | -123.2 | 19.2 | -173.4 | -66.4 | -25.9 | 0 | 0 | 0 | 112.5 | ||
| 16 | E | 86.2 | Confident | 83.9 | Confident | 123 Ų | 123 | 113 Ų | 113 | 58% | 0.575 | 65% | 0.646 | S | S | * | * | S | Bend | trans | -99.3 | 145.9 | 172.4 | -64 | -63.2 | 163.4 | 0 | 0 | 108.7 | A13 Y20 | A13-E16 HydrophobicContact CB-CB 4.23Å; A13-E16 HydrophobicContact CB-CG 3.91Å; E16-Y20 PolarHBondContact OE2-OH 3.31Å |
| 17 | P | 85.9 | Confident | 82.8 | Confident | 70 Ų | 70 | 114.6 Ų | 114.6 | 46% | 0.455 | 66% | 0.657 | S | S | . | * | trans | -61.1 | 141.2 | 170.2 | 28.9 | -35.4 | 0 | 0 | 0 | 110 | V19 Y20 | P17-V19 PolarHBondContact O-N 3.41Å; P17-Y20 WeakPolarHBondContact CD-OH 3.47Å; P17-Y20 HydrophobicContact CG-CD1 3.87Å; P17-Y20 HydrophobicContact CG-CD2 4.4Å; P17-Y20 HydrophobicContact CG-CE1 3.33Å; P17-Y20 HydrophobicContact CG-CE2 3.93Å; P17-Y20 HydrophobicContact CG-CG 4.38Å | ||
| 18 | D | 87.4 | Confident | 81.5 | Confident | 167 Ų | 167 | 119.7 Ų | 119.7 | 89% | 0.893 | 68% | 0.677 | S | S | * | * | S | Bend | trans | -66.8 | -29.4 | -178.9 | -166.2 | 39.2 | 0 | 0 | 0 | 112 | ||
| 19 | V | 91.9 | Very high | 80.5 | Confident | 90 Ų | 90 | 119 Ų | 119 | 55% | 0.545 | 67% | 0.674 | S | S | . | * | trans | -133.5 | 129.5 | -178.3 | -176.2 | 0 | 0 | 0 | 0 | 109.6 | P17 E21 | P17-V19 PolarHBondContact O-N 3.41Å; V19-E21 HydrophobicContact CG1-CB 4.15Å; V19-E21 HydrophobicContact CG1-CG 4.33Å | ||
| 20 | Y | 90 | Very high | 79.4 | Confident | 170 Ų | 170 | 121.2 Ų | 121.2 | 67% | 0.667 | 68% | 0.681 | S | S | * | * | trans | -107.4 | 100.4 | 167.6 | -60.4 | -97 | 0 | 0 | 0 | 108.3 | E16 P17 | E16-Y20 PolarHBondContact OE2-OH 3.31Å; P17-Y20 WeakPolarHBondContact CD-OH 3.47Å; P17-Y20 HydrophobicContact CG-CD1 3.87Å; P17-Y20 HydrophobicContact CG-CD2 4.4Å; P17-Y20 HydrophobicContact CG-CE1 3.33Å; P17-Y20 HydrophobicContact CG-CE2 3.93Å; P17-Y20 HydrophobicContact CG-CG 4.38Å | ||
| 21 | E | 86.3 | Confident | 78.3 | Confident | 164 Ų | 164 | 118.3 Ų | 118.3 | 77% | 0.766 | 67% | 0.668 | S | S | * | * | trans | -116.9 | 152.8 | 179.5 | 61.9 | -168.2 | 177.4 | 0 | 0 | 111.6 | V19 | V19-E21 HydrophobicContact CG1-CB 4.15Å; V19-E21 HydrophobicContact CG1-CG 4.33Å | ||
| 22 | T | 86.6 | Confident | 77.3 | Confident | 132 Ų | 132 | 122.9 Ų | 122.9 | 81% | 0.81 | 67% | 0.666 | S | S | * | * | trans | -69.1 | 143.4 | 168.1 | 46 | 0 | 0 | 0 | 0 | 108.9 | D24 | T22-D24 PolarHBondContact O-N 3Š| ||
| 23 | G | 81.8 | Confident | 76.1 | Confident | 65 Ų | 65 | 127.5 Ų | 127.5 | 67% | 0.67 | 68% | 0.684 | S | S | * | * | trans | -54.3 | 132.3 | 179.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | L25 | G23-L25 PolarHBondContact O-N 3.19Å; G23-L25 VanDerWaalsContact O-N 3.13Å | ||
| 24 | D | 79.6 | Confident | 75 | Confident | 163 Ų | 163 | 132.4 Ų | 132.4 | 87% | 0.872 | 69% | 0.694 | S | S | * | * | trans | -61.9 | 114.2 | -176.3 | -144.6 | 0.6 | 0 | 0 | 0 | 109.3 | T22 | T22-D24 PolarHBondContact O-N 3Š| ||
| 25 | L | 75.4 | Confident | 74.1 | Confident | 115 Ų | 115 | 132.4 Ų | 132.4 | 60% | 0.602 | 71% | 0.709 | S | S | * | * | trans | -89.6 | 135.8 | -179.4 | -70.7 | 176.9 | 0 | 0 | 0 | 108.7 | G23 E27 | G23-L25 PolarHBondContact O-N 3.19Å; G23-L25 VanDerWaalsContact O-N 3.13Å; L25-E27 HydrophobicContact CB-CG 4.38Å; L25-E27 PolarHBondContact O-N 2.96Å | ||
| 26 | P | 72.4 | Confident | 73.3 | Confident | 88 Ų | 88 | 131.5 Ų | 131.5 | 57% | 0.571 | 70% | 0.699 | S | S | * | * | G | 310 helix | trans | -73 | 20.1 | -178.9 | 31.9 | -36.5 | 0 | 0 | 0 | 113.5 | D28 D29 | P26-D28 VanDerWaalsContact C-N 3.27Å; P26-D28 PolarHBondContact O-N 3.21Å; P26-D29 PolarHBondContact O-N 3.23Å |
| 27 | E | 63.5 | Low | 72.1 | Confident | 136 Ų | 136 | 134 Ų | 134 | 64% | 0.636 | 71% | 0.711 | S | S | * | * | G | 310 helix | trans | -68.6 | -29.1 | 179.4 | -68.2 | -174.9 | 175.1 | 0 | 0 | 111.4 | L25 D29 Q30 | L25-E27 HydrophobicContact CB-CG 4.38Å; L25-E27 PolarHBondContact O-N 2.96Å; E27-D29 VanDerWaalsContact C-N 3.27Å; E27-D29 PolarHBondContact O-N 3.47Å; E27-Q30 PolarHBondContact O-N 3.32Å |
| 28 | D | 56.5 | Low | 71.1 | Confident | 158 Ų | 158 | 135.4 Ų | 135.4 | 85% | 0.845 | 71% | 0.714 | S | S | * | * | G | 310 helix | trans | -69.9 | -19.2 | 174.2 | -84.1 | -8.2 | 0 | 0 | 0 | 113.6 | P26 Q30 | P26-D28 VanDerWaalsContact C-N 3.27Å; P26-D28 PolarHBondContact O-N 3.21Å; D28-Q30 VanDerWaalsContact C-N 3.28Å; D28-Q30 PolarHBondContact O-N 2.9Å |
| 29 | D | 62 | Low | 70.1 | Confident | 142 Ų | 142 | 132.7 Ų | 132.7 | 76% | 0.759 | 71% | 0.707 | S | S | * | * | G | 310 helix | trans | -81.9 | -6.6 | 175.9 | -75.6 | -28.5 | 0 | 0 | 0 | 112.9 | P26 E27 A31 | P26-D29 PolarHBondContact O-N 3.23Å; E27-D29 VanDerWaalsContact C-N 3.27Å; E27-D29 PolarHBondContact O-N 3.47Å; D29-A31 PolarHBondContact O-N 3.24Å |
| 30 | Q | 62.5 | Low | 69.4 | Low | 136 Ų | 136 | 130.8 Ų | 130.8 | 64% | 0.636 | 70% | 0.697 | S | S | * | * | S | Bend | trans | -88.1 | 102 | 177.9 | -61 | -176.6 | 20.3 | 0 | 0 | 109.2 | E27 D28 Q32 | E27-Q30 PolarHBondContact O-N 3.32Å; D28-Q30 VanDerWaalsContact C-N 3.28Å; D28-Q30 PolarHBondContact O-N 2.9Å; Q30-Q32 VanDerWaalsContact C-N 3.32Å; Q30-Q32 PolarHBondContact O-N 3.12Å |
| 31 | A | 62.6 | Low | 68.9 | Low | 63 Ų | 63 | 131.4 Ų | 131.4 | 52% | 0.521 | 71% | 0.712 | S | S | . | * | trans | -60.8 | 94.6 | 170 | 0 | 0 | 0 | 0 | 0 | 110 | D29 F33 | D29-A31 PolarHBondContact O-N 3.24Å; A31-F33 VanDerWaalsContact C-N 3.31Å; A31-F33 HydrophobicContact CB-CD2 4.1Å; A31-F33 HydrophobicContact CB-CE2 3.65Å; A31-F33 HydrophobicContact CB-CZ 4.15Å; A31-F33 WeakPolarHBondContact O-CD2 3.41Å; A31-F33 PolarHBondContact O-N 3.17Å | ||
| 32 | Q | 58.8 | Low | 68.8 | Low | 182 Ų | 182 | 129.4 Ų | 129.4 | 85% | 0.85 | 72% | 0.717 | S | S | * | * | trans | -70.4 | 94.4 | 161.8 | -81.9 | 179.4 | -12.5 | 0 | 0 | 107.3 | Q30 E34 | Q30-Q32 VanDerWaalsContact C-N 3.32Å; Q30-Q32 PolarHBondContact O-N 3.12Å; Q32-E34 PolarHBondContact O-N 2.97Å; Q32-E34 VanDerWaalsContact O-N 3.09Å | ||
| 33 | F | 61 | Low | 68.7 | Low | 167 Ų | 167 | 128 Ų | 128 | 73% | 0.732 | 71% | 0.707 | S | S | * | * | trans | -68.1 | 106 | 166.9 | -69.7 | -86.2 | 0 | 0 | 0 | 107.4 | A31 S35 | A31-F33 VanDerWaalsContact C-N 3.31Å; A31-F33 HydrophobicContact CB-CD2 4.1Å; A31-F33 HydrophobicContact CB-CE2 3.65Å; A31-F33 HydrophobicContact CB-CZ 4.15Å; A31-F33 WeakPolarHBondContact O-CD2 3.41Å; A31-F33 PolarHBondContact O-N 3.17Å; F33-S35 PolarHBondContact O-N 2.67Å; F33-S35 PolarHBondContact O-OG 3.31Å | ||
| 34 | E | 61.2 | Low | 68.7 | Low | 176 Ų | 176 | 133.1 Ų | 133.1 | 82% | 0.822 | 71% | 0.714 | S | S | * | * | trans | -54.5 | 109.6 | 160.1 | -73.8 | -172.3 | 167.5 | 0 | 0 | 106.5 | Q32 E36 | Q32-E34 PolarHBondContact O-N 2.97Å; Q32-E34 VanDerWaalsContact O-N 3.09Å; E34-E36 PolarHBondContact O-N 3.12Å | ||
| 35 | S | 60.4 | Low | 68.7 | Low | 114 Ų | 114 | 132.4 Ų | 132.4 | 80% | 0.797 | 70% | 0.699 | S | S | * | * | trans | -74.6 | 84.3 | -179.7 | -58.8 | 0 | 0 | 0 | 0 | 107 | F33 E37 | F33-S35 PolarHBondContact O-N 2.67Å; F33-S35 PolarHBondContact O-OG 3.31Å; S35-E37 PolarHBondContact O-N 3.11Å | ||
| 36 | E | 66.6 | Low | 69.1 | Low | 140 Ų | 140 | 133.4 Ų | 133.4 | 65% | 0.654 | 70% | 0.704 | S | S | * | * | trans | -58.9 | 125.8 | 168 | -68.2 | -175.2 | 169.1 | 0 | 0 | 108.1 | E34 L38 | E34-E36 PolarHBondContact O-N 3.12Å; E36-L38 HydrophobicContact CB-CD1 4.34Å; E36-L38 HydrophobicContact CB-CD2 4.35Å; E36-L38 HydrophobicContact CB-CG 3.87Å; E36-L38 PolarHBondContact O-N 3.41Å | ||
| 37 | E | 62.6 | Low | 69.6 | Low | 175 Ų | 175 | 135.2 Ų | 135.2 | 82% | 0.818 | 71% | 0.712 | S | S | * | * | trans | -70.2 | 67.5 | 173.9 | -80.4 | -172.6 | 156.8 | 0 | 0 | 110.2 | S35 C39 | S35-E37 PolarHBondContact O-N 3.11Å; E37-C39 PolarHBondContact O-N 3.42Å | ||
| 38 | L | 64.3 | Low | 70.8 | Confident | 100 Ų | 100 | 134 Ų | 134 | 52% | 0.524 | 72% | 0.715 | S | S | . | * | trans | -78.7 | -12.7 | 174.8 | -60.1 | 173.1 | 0 | 0 | 0 | 111.2 | E36 R45 | E36-L38 HydrophobicContact CB-CD1 4.34Å; E36-L38 HydrophobicContact CB-CD2 4.35Å; E36-L38 HydrophobicContact CB-CG 3.87Å; E36-L38 PolarHBondContact O-N 3.41Å; L38-R45 VanDerWaalsContact O-CZ 3.26Å; L38-R45 PolarHBondContact O-NE 3.48Å; L38-R45 VanDerWaalsContact O-NE 3.12Å; L38-R45 PolarHBondContact O-NH2 2.96Å | ||
| 39 | C | 65.4 | Low | 72.5 | Confident | 111 Ų | 111 | 130.7 Ų | 130.7 | 75% | 0.75 | 70% | 0.696 | S | S | * | * | trans | -115.8 | 94.1 | -179.7 | -66.3 | 0 | 0 | 0 | 0 | 109.8 | E37 R45 | E37-C39 PolarHBondContact O-N 3.42Å; C39-R45 PolarHBondContact SG-NH2 3.48Å | ||
| 40 | S | 78.4 | Confident | 73.9 | Confident | 49 Ų | 49 | 128.2 Ų | 128.2 | 34% | 0.343 | 69% | 0.688 | S | S | . | * | trans | -116 | 137.1 | 172 | -48.2 | 0 | 0 | 0 | 0 | 109.9 | S42 V43 | S40-S42 PolarHBondContact O-N 3.38Å; S40-S42 VanDerWaalsContact O-N 3.14Å; S40-V43 PolarHBondContact O-N 3.47Å; S40-V43 VanDerWaalsContact O-N 3.17Å | ||
| 41 | D | 78.9 | Confident | 75.4 | Confident | 184 Ų | 184 | 127.5 Ų | 127.5 | 98% | 0.984 | 69% | 0.689 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.9 | -20 | 177.5 | -69 | -24.6 | 0 | 0 | 0 | 113.1 | ||
| 42 | S | 84.8 | Confident | 76.7 | Confident | 122 Ų | 122 | 126.4 Ų | 126.4 | 85% | 0.853 | 68% | 0.68 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.5 | -7.4 | -179.9 | -55.4 | 0 | 0 | 0 | 0 | 114.4 | S40 | S40-S42 PolarHBondContact O-N 3.38Å; S40-S42 VanDerWaalsContact O-N 3.14Å |
| 43 | V | 83.7 | Confident | 78.3 | Confident | 101 Ų | 101 | 119.4 Ų | 119.4 | 61% | 0.612 | 65% | 0.653 | S | S | * | * | S | Bend | trans | -127 | 117.9 | -171.7 | -177.4 | 0 | 0 | 0 | 0 | 110.6 | S40 R45 | S40-V43 PolarHBondContact O-N 3.47Å; S40-V43 VanDerWaalsContact O-N 3.17Å; V43-R45 PolarHBondContact O-N 2.97Å |
| 44 | E | 81.8 | Confident | 79.7 | Confident | 173 Ų | 173 | 118.3 Ų | 118.3 | 81% | 0.808 | 65% | 0.645 | S | S | * | * | trans | -74.5 | 119.2 | 171.8 | -67.6 | -173 | 176.1 | 0 | 0 | 110.7 | I46 | E44-I46 PolarHBondContact O-N 3.36Š| ||
| 45 | R | 79.6 | Confident | 81.3 | Confident | 149 Ų | 149 | 115.1 Ų | 115.1 | 56% | 0.562 | 63% | 0.633 | S | S | * | * | trans | -84.7 | 105.7 | 174.9 | -166 | -167.9 | -64.9 | -171.8 | 16 | 110.4 | L38 C39 V43 | L38-R45 VanDerWaalsContact O-CZ 3.26Å; L38-R45 PolarHBondContact O-NE 3.48Å; L38-R45 VanDerWaalsContact O-NE 3.12Å; L38-R45 PolarHBondContact O-NH2 2.96Å; C39-R45 PolarHBondContact SG-NH2 3.48Å; V43-R45 PolarHBondContact O-N 2.97Å | ||
| 46 | I | 83.9 | Confident | 82.7 | Confident | 136 Ų | 136 | 116.5 Ų | 116.5 | 70% | 0.697 | 63% | 0.625 | S | S | * | * | trans | -94 | 110.4 | 174.4 | -55.9 | 175 | 0 | 0 | 0 | 109.1 | E44 V48 | E44-I46 PolarHBondContact O-N 3.36Å; I46-V48 PolarHBondContact O-N 3.14Å | ||
| 47 | V | 84.5 | Confident | 83.8 | Confident | 125 Ų | 125 | 116.2 Ų | 116.2 | 76% | 0.758 | 62% | 0.622 | S | S | * | * | trans | -73.2 | 115.5 | 173.7 | -177.9 | 0 | 0 | 0 | 0 | 108.8 | N49 | V47-N49 PolarHBondContact O-N 3.11Š| ||
| 48 | V | 88.4 | Confident | 85.1 | Confident | 112 Ų | 112 | 113.3 Ų | 113.3 | 68% | 0.679 | 61% | 0.607 | S | S | * | * | trans | -82.6 | 115.5 | 175.2 | -177.9 | 0 | 0 | 0 | 0 | 108.3 | I46 P50 | I46-V48 PolarHBondContact O-N 3.14Å; V48-P50 WeakPolarHBondContact O-CD 3.17Å | ||
| 49 | N | 91.1 | Very high | 86.2 | Confident | 87 Ų | 87 | 114.6 Ų | 114.6 | 47% | 0.465 | 61% | 0.614 | S | S | . | * | trans | -100 | 106.1 | 168.3 | -177.7 | -25.6 | 0 | 0 | 0 | 108.7 | V47 N51 A52 A53 | V47-N49 PolarHBondContact O-N 3.11Å; N49-N51 VanDerWaalsContact C-N 3.26Å; N49-N51 PolarHBondContact O-N 3.45Å; N49-N51 WeakPolarHBondContact OD1-CB 3.27Å; N49-N51 PolarHBondContact OD1-N 3.47Å; N49-N51 VanDerWaalsContact OD1-N 3.08Å; N49-A52 HydrophobicContact CB-CB 4.04Å; N49-A52 PolarHBondContact O-N 2.71Å; N49-A52 PolarHBondContact OD1-N 3.16Å; N49-A53 WeakPolarHBondContact O-CB 3.38Å; N49-A53 PolarHBondContact O-N 3.33Å | ||
| 50 | P | 91.9 | Very high | 87.2 | Confident | 90 Ų | 90 | 115.7 Ų | 115.7 | 58% | 0.584 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -59.9 | -33.6 | -176.8 | -25.7 | 35.8 | 0 | 0 | 0 | 113.6 | V48 A53 Y54 | V48-P50 WeakPolarHBondContact O-CD 3.17Å; P50-A53 PolarHBondContact O-N 3.48Å; P50-Y54 WeakPolarHBondContact O-CB 3.35Å; P50-Y54 PolarHBondContact O-N 3.47Å |
| 51 | N | 92.9 | Very high | 87.3 | Confident | 121 Ų | 121 | 119.9 Ų | 119.9 | 65% | 0.647 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -69.4 | -48 | 179.9 | -63.5 | -28.8 | 0 | 0 | 0 | 110.7 | N49 A53 Y54 D55 | N49-N51 VanDerWaalsContact C-N 3.26Å; N49-N51 PolarHBondContact O-N 3.45Å; N49-N51 WeakPolarHBondContact OD1-CB 3.27Å; N49-N51 PolarHBondContact OD1-N 3.47Å; N49-N51 VanDerWaalsContact OD1-N 3.08Å; N51-A53 VanDerWaalsContact C-N 3.27Å; N51-A53 PolarHBondContact O-N 3.12Å; N51-Y54 WeakPolarHBondContact O-CB 3.3Å; N51-Y54 PolarHBondContact O-N 3.37Å; N51-D55 PolarHBondContact O-N 3.44Å |
| 52 | A | 91.1 | Very high | 87.2 | Confident | 40 Ų | 40 | 115.7 Ų | 115.7 | 33% | 0.331 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -66.2 | -30.9 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | N49 K56 | N49-A52 HydrophobicContact CB-CB 4.04Å; N49-A52 PolarHBondContact O-N 2.71Å; N49-A52 PolarHBondContact OD1-N 3.16Å; A52-K56 VanDerWaalsContact O-CG 3.26Å; A52-K56 WeakPolarHBondContact O-CG 3.45Å; A52-K56 PolarHBondContact O-N 2.97Å |
| 53 | A | 91.6 | Very high | 86.7 | Confident | 35 Ų | 35 | 111.4 Ų | 111.4 | 29% | 0.289 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -68.6 | -44.6 | 172.2 | 0 | 0 | 0 | 0 | 0 | 111.1 | N49 P50 N51 D55 K56 F57 | N49-A53 WeakPolarHBondContact O-CB 3.38Å; N49-A53 PolarHBondContact O-N 3.33Å; P50-A53 PolarHBondContact O-N 3.48Å; N51-A53 VanDerWaalsContact C-N 3.27Å; N51-A53 PolarHBondContact O-N 3.12Å; A53-D55 PolarHBondContact O-N 3.39Å; A53-K56 WeakPolarHBondContact O-CB 3.38Å; A53-K56 PolarHBondContact O-N 3.25Å; A53-K56 VanDerWaalsContact O-N 3.17Å; A53-F57 WeakPolarHBondContact O-CD2 3.47Å; A53-F57 PolarHBondContact O-N 3.39Å |
| 54 | Y | 91.7 | Very high | 86 | Confident | 145 Ų | 145 | 111.7 Ų | 111.7 | 57% | 0.569 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -57 | -49.2 | 176.9 | 178.6 | -98.1 | 0 | 0 | 0 | 111.4 | P50 N51 K56 F57 K58 | P50-Y54 WeakPolarHBondContact O-CB 3.35Å; P50-Y54 PolarHBondContact O-N 3.47Å; N51-Y54 WeakPolarHBondContact O-CB 3.3Å; N51-Y54 PolarHBondContact O-N 3.37Å; Y54-K56 PolarHBondContact O-N 3.31Å; Y54-F57 CarbonylContact O-C 3.56Å; Y54-F57 PolarHBondContact O-N 3.48Å; Y54-K58 HydrophobicContact CD1-CB 4.47Å; Y54-K58 HydrophobicContact CE1-CB 4.18Å; Y54-K58 HydrophobicContact CE1-CD 3.82Å; Y54-K58 HydrophobicContact CE1-CG 4Å; Y54-K58 WeakPolarHBondContact O-CB 3.38Å; Y54-K58 PolarHBondContact O-N 3Å |
| 55 | D | 93.3 | Very high | 85.3 | Confident | 108 Ų | 108 | 111.1 Ų | 111.1 | 58% | 0.578 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -59.6 | -34.2 | 178.9 | -67.5 | -27.1 | 0 | 0 | 0 | 112.7 | N51 A53 F57 | N51-D55 PolarHBondContact O-N 3.44Å; A53-D55 PolarHBondContact O-N 3.39Å; D55-F57 VanDerWaalsContact C-N 3.27Å; D55-F57 PolarHBondContact O-N 3.25Å |
| 56 | K | 91.1 | Very high | 84.5 | Confident | 143 Ų | 143 | 107.3 Ų | 107.3 | 62% | 0.622 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -69.6 | -21.8 | 177.4 | -74.4 | 173.7 | -176.4 | -176.3 | 0 | 114 | A52 A53 Y54 K60 | A52-K56 VanDerWaalsContact O-CG 3.26Å; A52-K56 WeakPolarHBondContact O-CG 3.45Å; A52-K56 PolarHBondContact O-N 2.97Å; A53-K56 WeakPolarHBondContact O-CB 3.38Å; A53-K56 PolarHBondContact O-N 3.25Å; A53-K56 VanDerWaalsContact O-N 3.17Å; Y54-K56 PolarHBondContact O-N 3.31Å; K56-K60 WeakPolarHBondContact O-CD 3.45Å; K56-K60 VanDerWaalsContact O-CE 3.31Å; K56-K60 WeakPolarHBondContact O-CE 3.46Å; K56-K60 PolarHBondContact O-NZ 2.89Å |
| 57 | F | 89.1 | Confident | 83.7 | Confident | 134 Ų | 134 | 103.3 Ų | 103.3 | 59% | 0.588 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -118.5 | -13.6 | -174.4 | -68.7 | -73.4 | 0 | 0 | 0 | 114.1 | A53 Y54 D55 D59 K60 | A53-F57 WeakPolarHBondContact O-CD2 3.47Å; A53-F57 PolarHBondContact O-N 3.39Å; Y54-F57 CarbonylContact O-C 3.56Å; Y54-F57 PolarHBondContact O-N 3.48Å; D55-F57 VanDerWaalsContact C-N 3.27Å; D55-F57 PolarHBondContact O-N 3.25Å; F57-D59 VanDerWaalsContact C-N 3.26Å; F57-D59 PolarHBondContact O-N 3.27Å; F57-K60 HydrophobicContact CD1-CD 3.98Å; F57-K60 HydrophobicContact CE1-CD 4.46Å; F57-K60 PolarHBondContact O-N 3.46Å |
| 58 | K | 88.8 | Confident | 82.7 | Confident | 115 Ų | 115 | 100.9 Ų | 100.9 | 50% | 0.5 | 54% | 0.543 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -51.2 | -42.6 | -177.8 | -178.2 | -171.7 | 178.3 | -172.9 | 0 | 113.4 | Y54 | Y54-K58 HydrophobicContact CD1-CB 4.47Å; Y54-K58 HydrophobicContact CE1-CB 4.18Å; Y54-K58 HydrophobicContact CE1-CD 3.82Å; Y54-K58 HydrophobicContact CE1-CG 4Å; Y54-K58 WeakPolarHBondContact O-CB 3.38Å; Y54-K58 PolarHBondContact O-N 3Å |
| 59 | D | 87.8 | Confident | 81.8 | Confident | 127 Ų | 127 | 103 Ų | 103 | 68% | 0.679 | 54% | 0.543 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.7 | -10.4 | -176.2 | -56.1 | -33.5 | 0 | 0 | 0 | 112.8 | F57 H61 | F57-D59 VanDerWaalsContact C-N 3.26Å; F57-D59 PolarHBondContact O-N 3.27Å; D59-H61 PolarHBondContact O-N 3.43Å; D59-H61 PolarHBondContact O-ND1 2.91Å |
| 60 | K | 87 | Confident | 80.5 | Confident | 134 Ų | 134 | 101 Ų | 101 | 58% | 0.583 | 54% | 0.536 | S | S | * | . | trans | -85.8 | 108.5 | -178.8 | -67.7 | 176.3 | -176.8 | 150.5 | 0 | 109.5 | K56 F57 | K56-K60 WeakPolarHBondContact O-CD 3.45Å; K56-K60 VanDerWaalsContact O-CE 3.31Å; K56-K60 WeakPolarHBondContact O-CE 3.46Å; K56-K60 PolarHBondContact O-NZ 2.89Å; F57-K60 HydrophobicContact CD1-CD 3.98Å; F57-K60 HydrophobicContact CE1-CD 4.46Å; F57-K60 PolarHBondContact O-N 3.46Å | ||
| 61 | H | 79.9 | Confident | 79.1 | Confident | 136 Ų | 136 | 104.1 Ų | 104.1 | 63% | 0.63 | 55% | 0.548 | S | S | * | . | trans | -99.7 | 149.3 | 176.6 | -62.7 | 75.1 | 0 | 0 | 0 | 110.4 | D59 | D59-H61 PolarHBondContact O-N 3.43Å; D59-H61 PolarHBondContact O-ND1 2.91Å | ||
| 62 | V | 77.8 | Confident | 77.7 | Confident | 96 Ų | 96 | 107.5 Ų | 107.5 | 58% | 0.582 | 55% | 0.551 | S | S | * | * | trans | -110.5 | 115.7 | -176 | 176.1 | 0 | 0 | 0 | 0 | 108.4 | Y81 | V62-Y81 HydrophobicContact CB-CD1 4.42Å; V62-Y81 HydrophobicContact CG1-CD1 2.93Å; V62-Y81 HydrophobicContact CG1-CD2 4.18Å; V62-Y81 HydrophobicContact CG1-CE1 3.32Å; V62-Y81 HydrophobicContact CG1-CG 3.39Å | ||
| 63 | G | 73.6 | Confident | 76.1 | Confident | 33 Ų | 33 | 113.9 Ų | 113.9 | 34% | 0.34 | 58% | 0.578 | S | S | . | * | trans | -76.7 | 134.3 | 178.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | Y81 | G63-Y81 WeakPolarHBondContact O-CD1 3.43Š| ||
| 64 | T | 68.3 | Low | 74.7 | Confident | 106 Ų | 106 | 115.1 Ų | 115.1 | 65% | 0.65 | 58% | 0.584 | S | S | * | * | trans | -96.6 | 6.5 | -178.4 | 55.7 | 0 | 0 | 0 | 0 | 114.6 | L67 | T64-L67 HydrophobicContact CG2-CD1 4.04Š| ||
| 65 | K | 67.1 | Low | 73.1 | Confident | 161 Ų | 161 | 120.8 Ų | 120.8 | 70% | 0.7 | 61% | 0.605 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77 | 127.2 | -178.3 | -68 | 175.6 | -176.5 | 163.5 | 0 | 110.3 | E85 | K65-E85 IonicContact NZ-OE1 2.98Å; K65-E85 PolarHBondContact NZ-OE1 3.26Å |
| 66 | G | 64.4 | Low | 71.5 | Confident | 69 Ų | 69 | 119.7 Ų | 119.7 | 71% | 0.711 | 61% | 0.606 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 85.7 | 9.3 | 175.7 | 0 | 0 | 0 | 0 | 0 | 115.9 | D68 | G66-D68 PolarHBondContact O-N 3.49Š|
| 67 | L | 66.2 | Low | 69.9 | Low | 52 Ų | 52 | 124 Ų | 124 | 27% | 0.272 | 62% | 0.618 | S | S | . | * | trans | -70.5 | 106.8 | 177.7 | -65.5 | 172.7 | 0 | 0 | 0 | 111.3 | T64 F69 Y81 | T64-L67 HydrophobicContact CG2-CD1 4.04Å; L67-F69 HydrophobicContact CB-CE2 4.31Å; L67-F69 HydrophobicContact CD2-CE2 4.29Å; L67-F69 HydrophobicContact CD2-CZ 4.34Å; L67-Y81 HydrophobicContact CD1-CD1 4.11Å; L67-Y81 HydrophobicContact CD1-CE1 3.57Å; L67-Y81 HydrophobicContact CD2-CD1 3.65Å; L67-Y81 HydrophobicContact CD2-CE1 3.69Å; L67-Y81 HydrophobicContact CD2-CG 4.21Å; L67-Y81 HydrophobicContact CG-CD1 4.41Å; L67-Y81 HydrophobicContact CG-CE1 4.25Å | ||
| 68 | D | 64.4 | Low | 68.4 | Low | 74 Ų | 74 | 122.6 Ų | 122.6 | 40% | 0.396 | 61% | 0.609 | S | S | . | * | trans | -126.6 | 97.1 | 171.8 | -174.2 | 10.4 | 0 | 0 | 0 | 110.5 | G66 S70 | G66-D68 PolarHBondContact O-N 3.49Å; D68-S70 VanDerWaalsContact C-N 3.33Å; D68-S70 VanDerWaalsContact OD1-CB 3.27Å; D68-S70 WeakPolarHBondContact OD1-CB 3.44Å; D68-S70 PolarHBondContact OD1-N 3.47Å; D68-S70 PolarHBondContact OD1-OG 3.16Å | ||
| 69 | F | 67.9 | Low | 67 | Low | 158 Ų | 158 | 120.4 Ų | 120.4 | 69% | 0.693 | 61% | 0.605 | S | S | * | * | trans | -87.8 | 0.7 | 172.6 | -62.7 | -78.2 | 0 | 0 | 0 | 112.8 | L67 D71 | L67-F69 HydrophobicContact CB-CE2 4.31Å; L67-F69 HydrophobicContact CD2-CE2 4.29Å; L67-F69 HydrophobicContact CD2-CZ 4.34Å; F69-D71 PolarHBondContact O-N 3Å | ||
| 70 | S | 65.5 | Low | 65.9 | Low | 45 Ų | 45 | 116.5 Ų | 116.5 | 32% | 0.315 | 59% | 0.594 | S | S | . | * | S | Bend | trans | -74.1 | 129.7 | 175.3 | 77.5 | 0 | 0 | 0 | 0 | 108.4 | D68 R72 R78 | D68-S70 VanDerWaalsContact C-N 3.33Å; D68-S70 VanDerWaalsContact OD1-CB 3.27Å; D68-S70 WeakPolarHBondContact OD1-CB 3.44Å; D68-S70 PolarHBondContact OD1-N 3.47Å; D68-S70 PolarHBondContact OD1-OG 3.16Å; S70-R72 PolarHBondContact O-N 2.83Å; S70-R78 PolarHBondContact O-NH1 2.9Å |
| 71 | D | 62 | Low | 64.6 | Low | 155 Ų | 155 | 116.7 Ų | 116.7 | 83% | 0.829 | 59% | 0.592 | S | S | * | * | trans | -66 | 22.3 | -179.9 | -82.4 | -28.2 | 0 | 0 | 0 | 114.6 | F69 I73 | F69-D71 PolarHBondContact O-N 3Å; D71-I73 PolarHBondContact O-N 3.13Å | ||
| 72 | R | 62.9 | Low | 63.2 | Low | 192 Ų | 192 | 116.8 Ų | 116.8 | 73% | 0.725 | 59% | 0.593 | S | S | * | * | trans | -72.4 | 122 | -179.6 | -69.4 | -178.5 | 171.3 | 179.7 | -0.9 | 111.1 | S70 S74 R78 | S70-R72 PolarHBondContact O-N 2.83Å; R72-S74 PolarHBondContact O-N 3.15Å; R72-S74 VanDerWaalsContact O-N 3.17Å; R72-R78 PolarHBondContact O-NH2 3.48Å | ||
| 73 | I | 58.3 | Low | 61.8 | Low | 174 Ų | 174 | 117.3 Ų | 117.3 | 89% | 0.892 | 60% | 0.601 | S | S | * | * | trans | -65.4 | 113.4 | 179.2 | -56.8 | 171.2 | 0 | 0 | 0 | 109.2 | D71 | D71-I73 PolarHBondContact O-N 3.13Š| ||
| 74 | S | 61.9 | Low | 60.8 | Low | 60 Ų | 60 | 119.2 Ų | 119.2 | 42% | 0.42 | 62% | 0.621 | S | S | . | * | trans | -125.4 | 164.3 | 176.7 | 100.2 | 0 | 0 | 0 | 0 | 111.2 | R72 S76 | R72-S74 PolarHBondContact O-N 3.15Å; R72-S74 VanDerWaalsContact O-N 3.17Å; S74-S76 PolarHBondContact OG-N 3.46Å; S74-S76 PolarHBondContact OG-OG 3.15Å | ||
| 75 | R | 57.8 | Low | 60.1 | Low | 264 Ų | 264 | 120.7 Ų | 120.7 | 100% | 0.996 | 62% | 0.62 | S | S | * | * | S | Bend | trans | -81.1 | -14.5 | -177.6 | -88.3 | -176.7 | 175.2 | 177.8 | -1.2 | 114.6 | ||
| 76 | S | 59.4 | Low | 59.3 | Low | 85 Ų | 85 | 121 Ų | 121 | 59% | 0.594 | 62% | 0.622 | S | S | * | * | S | Bend | trans | -92.9 | 146 | 177.7 | 58.5 | 0 | 0 | 0 | 0 | 110.9 | S74 R78 | S74-S76 PolarHBondContact OG-N 3.46Å; S74-S76 PolarHBondContact OG-OG 3.15Å; S76-R78 PolarHBondContact O-N 3.31Å |
| 77 | R | 57.5 | Low | 58.9 | Low | 233 Ų | 233 | 125 Ų | 125 | 88% | 0.879 | 62% | 0.622 | S | S | * | * | trans | -64.6 | 118.4 | 172.4 | -167.8 | 176.1 | -167.7 | 175.5 | 2.6 | 107.5 | V79 | R77-V79 PolarHBondContact O-N 3.49Š| ||
| 78 | R | 59 | Low | 58.4 | Low | 106 Ų | 106 | 127.9 Ų | 127.9 | 40% | 0.4 | 64% | 0.636 | S | S | . | * | trans | -69.9 | 114.3 | 173.3 | -71.3 | -176.8 | -111.8 | 173 | 0.4 | 107.7 | S70 R72 S76 | S70-R78 PolarHBondContact O-NH1 2.9Å; R72-R78 PolarHBondContact O-NH2 3.48Å; S76-R78 PolarHBondContact O-N 3.31Å | ||
| 79 | V | 58.8 | Low | 57.9 | Low | 69 Ų | 69 | 126.9 Ų | 126.9 | 42% | 0.418 | 63% | 0.631 | S | S | . | * | trans | -105.2 | 139.3 | 171.5 | -170.1 | 0 | 0 | 0 | 0 | 106.2 | R77 E82 | R77-V79 PolarHBondContact O-N 3.49Å; V79-E82 HydrophobicContact CB-CG 4.46Å; V79-E82 HydrophobicContact CG1-CG 3.69Å | ||
| 80 | G | 63.5 | Low | 57.2 | Low | 44 Ų | 44 | 122 Ų | 122 | 45% | 0.454 | 63% | 0.625 | S | S | . | * | trans | -73.3 | -140 | 173.8 | 0 | 0 | 0 | 0 | 0 | 110.7 | E82 | G80-E82 PolarHBondContact O-N 3.41Š| ||
| 81 | Y | 60.2 | Low | 56.5 | Low | 139 Ų | 139 | 129.3 Ų | 129.3 | 55% | 0.545 | 66% | 0.655 | S | S | . | * | trans | -62.6 | 116.5 | 177.5 | -58.3 | -73 | 0 | 0 | 0 | 112 | V62 G63 L67 | V62-Y81 HydrophobicContact CB-CD1 4.42Å; V62-Y81 HydrophobicContact CG1-CD1 2.93Å; V62-Y81 HydrophobicContact CG1-CD2 4.18Å; V62-Y81 HydrophobicContact CG1-CE1 3.32Å; V62-Y81 HydrophobicContact CG1-CG 3.39Å; G63-Y81 WeakPolarHBondContact O-CD1 3.43Å; L67-Y81 HydrophobicContact CD1-CD1 4.11Å; L67-Y81 HydrophobicContact CD1-CE1 3.57Å; L67-Y81 HydrophobicContact CD2-CD1 3.65Å; L67-Y81 HydrophobicContact CD2-CE1 3.69Å; L67-Y81 HydrophobicContact CD2-CG 4.21Å; L67-Y81 HydrophobicContact CG-CD1 4.41Å; L67-Y81 HydrophobicContact CG-CE1 4.25Å | ||
| 82 | E | 51.3 | Low | 56.1 | Low | 137 Ų | 137 | 126 Ų | 126 | 64% | 0.64 | 66% | 0.656 | S | S | * | * | trans | -97.1 | 142 | 166.8 | -73.2 | -172.4 | 163.5 | 0 | 0 | 110.1 | V79 G80 | V79-E82 HydrophobicContact CB-CG 4.46Å; V79-E82 HydrophobicContact CG1-CG 3.69Å; G80-E82 PolarHBondContact O-N 3.41Å | ||
| 83 | S | 47.5 | Very low | 55.6 | Low | 108 Ų | 108 | 119.1 Ų | 119.1 | 76% | 0.755 | 64% | 0.638 | S | S | * | * | trans | -119.5 | 126.5 | -176.3 | -164.3 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 84 | G | 53.5 | Low | 55.4 | Low | 73 Ų | 73 | 115.1 Ų | 115.1 | 75% | 0.753 | 64% | 0.64 | S | S | * | * | trans | 148.3 | 103.7 | 168.6 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 85 | E | 53.7 | Low | 55.4 | Low | 136 Ų | 136 | 116.8 Ų | 116.8 | 64% | 0.636 | 65% | 0.647 | S | S | * | * | trans | -135.3 | 14.1 | 173.1 | -75.4 | -158.8 | 165.4 | 0 | 0 | 114.8 | K65 | K65-E85 IonicContact NZ-OE1 2.98Å; K65-E85 PolarHBondContact NZ-OE1 3.26Å | ||
| 86 | F | 49.1 | Very low | 55.5 | Low | 167 Ų | 167 | 114 Ų | 114 | 73% | 0.732 | 64% | 0.642 | S | S | * | * | trans | -133.6 | 106.7 | -175.2 | -56.9 | -73.3 | 0 | 0 | 0 | 113.9 | ||||
| 87 | E | 56.6 | Low | 55.9 | Low | 153 Ų | 153 | 113.5 Ų | 113.5 | 72% | 0.715 | 63% | 0.63 | S | S | * | * | trans | -136.3 | 129.4 | 167 | -169.8 | 174.4 | -168.1 | 0 | 0 | 108.6 | Q101 | E87-Q101 PolarHBondContact O-NE2 2.99Š| ||
| 88 | I | 55.1 | Low | 56.7 | Low | 113 Ų | 113 | 106.1 Ų | 106.1 | 58% | 0.579 | 61% | 0.611 | S | S | * | * | P | Polyproline II helix | trans | -101.6 | 120.5 | 170.8 | -60.8 | 174.4 | 0 | 0 | 0 | 106.6 | G90 | I88-G90 PolarHBondContact O-N 3.45Š|
| 89 | L | 55.4 | Low | 57.1 | Low | 53 Ų | 53 | 106.6 Ų | 106.6 | 28% | 0.277 | 63% | 0.629 | S | S | . | * | P | Polyproline II helix | trans | -68.9 | 129.6 | 175.1 | -75.9 | 166.8 | 0 | 0 | 0 | 109 | V95 | L89-V95 HydrophobicContact CD1-CB 4.35Š|
| 90 | G | 52.7 | Low | 57.4 | Low | 56 Ų | 56 | 109.4 Ų | 109.4 | 58% | 0.577 | 64% | 0.637 | S | S | * | * | P | Polyproline II helix | trans | -64.6 | 150.2 | 176 | 0 | 0 | 0 | 0 | 0 | 112.7 | I88 G92 S93 | I88-G90 PolarHBondContact O-N 3.45Å; G90-G92 PolarHBondContact O-N 3.03Å; G90-S93 WeakPolarHBondContact O-CB 3.44Å; G90-S93 PolarHBondContact O-N 3.48Å |
| 91 | E | 50 | Low | 57.6 | Low | 199 Ų | 199 | 108.4 Ų | 108.4 | 93% | 0.93 | 62% | 0.62 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -51.9 | 126.3 | 177.1 | -97.2 | -177.7 | 142 | 0 | 0 | 111.7 | ||
| 92 | G | 54.9 | Low | 58.2 | Low | 84 Ų | 84 | 106.8 Ų | 106.8 | 87% | 0.866 | 62% | 0.616 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 96.2 | -0.6 | -179.9 | 0 | 0 | 0 | 0 | 0 | 115.5 | G90 G94 | G90-G92 PolarHBondContact O-N 3.03Å; G92-G94 PolarHBondContact O-N 3.33Å |
| 93 | S | 50.7 | Low | 59.3 | Low | 48 Ų | 48 | 107.3 Ų | 107.3 | 34% | 0.336 | 61% | 0.614 | S | S | . | * | trans | -64.7 | 114.1 | 168.9 | 161.9 | 0 | 0 | 0 | 0 | 110.6 | G90 V95 | G90-S93 WeakPolarHBondContact O-CB 3.44Å; G90-S93 PolarHBondContact O-N 3.48Å; S93-V95 PolarHBondContact O-N 2.75Å; S93-V95 PolarHBondContact OG-N 3.08Å | ||
| 94 | G | 55.3 | Low | 60.4 | Low | 90 Ų | 90 | 104.6 Ų | 104.6 | 93% | 0.928 | 59% | 0.589 | S | S | * | * | trans | -68.6 | 11.5 | 177.3 | 0 | 0 | 0 | 0 | 0 | 115.5 | G92 | G92-G94 PolarHBondContact O-N 3.33Š| ||
| 95 | V | 61 | Low | 61.7 | Low | 96 Ų | 96 | 105 Ų | 105 | 58% | 0.582 | 57% | 0.567 | S | S | * | * | S | Bend | trans | -89.8 | 131 | 176.8 | -174.2 | 0 | 0 | 0 | 0 | 109.1 | L89 S93 E97 | L89-V95 HydrophobicContact CD1-CB 4.35Å; S93-V95 PolarHBondContact O-N 2.75Å; S93-V95 PolarHBondContact OG-N 3.08Å; V95-E97 PolarHBondContact O-N 3.24Å |
| 96 | K | 61.1 | Low | 62.9 | Low | 204 Ų | 204 | 101.8 Ų | 101.8 | 89% | 0.887 | 56% | 0.555 | S | S | * | * | P | Polyproline II helix | trans | -62.1 | 121.6 | 178.6 | -77.2 | -175.9 | 176 | -180 | 0 | 110.5 | ||
| 97 | E | 66.3 | Low | 64.3 | Low | 75 Ų | 75 | 96.5 Ų | 96.5 | 35% | 0.35 | 54% | 0.536 | S | S | . | . | P | Polyproline II helix | trans | -55.5 | 140.2 | 174.8 | -61.5 | 176.9 | 154.7 | 0 | 0 | 111.4 | V95 K102 R105 | V95-E97 PolarHBondContact O-N 3.24Å; E97-K102 HydrophobicContact CB-CB 4.32Å; E97-R105 IonicContact OE1-CZ 3.24Å; E97-R105 IonicContact OE1-NE 3.73Å; E97-R105 PolarHBondContact OE1-NE 3.22Å; E97-R105 IonicContact OE1-NH2 3.76Å; E97-R105 IonicContact OE2-CZ 2.67Å; E97-R105 IonicContact OE2-NE 2.7Å; E97-R105 IonicContact OE2-NH2 3.31Å; E97-R105 PolarHBondContact OE2-NH2 2.98Å |
| 98 | T | 74.6 | Confident | 65 | Low | 78 Ų | 78 | 94 Ų | 94 | 48% | 0.479 | 53% | 0.527 | S | S | . | . | P | Polyproline II helix | trans | -73.9 | 153.8 | 168 | 64.2 | 0 | 0 | 0 | 0 | 110.4 | Q100 Q101 K102 | T98-Q100 PolarHBondContact O-N 3.17Å; T98-Q101 PolarHBondContact O-N 3.23Å; T98-Q101 VanDerWaalsContact O-N 3.12Å; T98-Q101 WeakPolarHBondContact OG1-CB 3.3Å; T98-K102 PolarHBondContact O-N 3.04Å |
| 99 | P | 68.9 | Low | 66.1 | Low | 117 Ų | 117 | 92.5 Ų | 92.5 | 76% | 0.76 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -55.3 | -35.8 | -178.9 | -27.4 | 35.1 | 0 | 0 | 0 | 114.3 | Y103 | P99-Y103 PolarHBondContact O-N 3.1Å; P99-Y103 VanDerWaalsContact O-N 3.11Å |
| 100 | Q | 63.6 | Low | 67.3 | Low | 127 Ų | 127 | 95.1 Ų | 95.1 | 59% | 0.593 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -70.2 | -40 | 178.7 | -171.9 | 67.7 | 8.6 | 0 | 0 | 112.4 | T98 Y103 Q104 | T98-Q100 PolarHBondContact O-N 3.17Å; Q100-Y103 WeakPolarHBondContact O-CB 3.49Å; Q100-Y103 PolarHBondContact O-N 3.46Å; Q100-Q104 PolarHBondContact O-N 3.18Å |
| 101 | Q | 69.3 | Low | 68.3 | Low | 23 Ų | 23 | 98 Ų | 98 | 11% | 0.107 | 53% | 0.529 | C | S | . | . | H | α-helix | trans | -71.2 | -37.9 | 178.5 | -168.5 | 175.6 | 35.3 | 0 | 0 | 111.7 | E87 T98 Y103 Q104 R105 | E87-Q101 PolarHBondContact O-NE2 2.99Å; T98-Q101 PolarHBondContact O-N 3.23Å; T98-Q101 VanDerWaalsContact O-N 3.12Å; T98-Q101 WeakPolarHBondContact OG1-CB 3.3Å; Q101-Y103 VanDerWaalsContact C-N 3.33Å; Q101-Y103 PolarHBondContact O-N 3.3Å; Q101-Q104 PolarHBondContact O-N 3.35Å; Q101-R105 PolarHBondContact O-N 3.06Å; Q101-R105 VanDerWaalsContact O-N 3.08Å |
| 102 | K | 72.4 | Confident | 69.6 | Low | 105 Ų | 105 | 95 Ų | 95 | 46% | 0.457 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -62.7 | -39.3 | 172.8 | -174.7 | 173.6 | -177.6 | 179.2 | 0 | 112.2 | E97 T98 L106 | E97-K102 HydrophobicContact CB-CB 4.32Å; T98-K102 PolarHBondContact O-N 3.04Å; K102-L106 HydrophobicContact CG-CD1 4.13Å; K102-L106 WeakPolarHBondContact O-CB 3.27Å; K102-L106 VanDerWaalsContact O-CG 3.31Å; K102-L106 WeakPolarHBondContact O-CG 3.36Å; K102-L106 PolarHBondContact O-N 3.13Å; K102-L106 VanDerWaalsContact O-N 3.12Å |
| 103 | Y | 74.6 | Confident | 70.8 | Confident | 149 Ų | 149 | 96 Ų | 96 | 58% | 0.584 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -60.4 | -44.3 | 173.8 | 175.3 | -98 | 0 | 0 | 0 | 111.5 | P99 Q100 Q101 L106 V107 | P99-Y103 PolarHBondContact O-N 3.1Å; P99-Y103 VanDerWaalsContact O-N 3.11Å; Q100-Y103 WeakPolarHBondContact O-CB 3.49Å; Q100-Y103 PolarHBondContact O-N 3.46Å; Q101-Y103 VanDerWaalsContact C-N 3.33Å; Q101-Y103 PolarHBondContact O-N 3.3Å; Y103-L106 PolarHBondContact O-N 3.1Å; Y103-V107 HydrophobicContact CD1-CG2 4.22Å; Y103-V107 HydrophobicContact CD2-CG2 4.49Å; Y103-V107 HydrophobicContact CE1-CG2 3.83Å; Y103-V107 HydrophobicContact CE2-CG2 4.13Å; Y103-V107 VanDerWaalsContact O-CG2 3.27Å; Y103-V107 WeakPolarHBondContact O-CG2 3.38Å; Y103-V107 PolarHBondContact O-N 3.5Å |
| 104 | Q | 69.3 | Low | 72.1 | Confident | 51 Ų | 51 | 97.6 Ų | 97.6 | 24% | 0.238 | 51% | 0.508 | C | S | . | . | H | α-helix | trans | -67 | -39.5 | -179.7 | -75.6 | 165.9 | -7.7 | 0 | 0 | 113.5 | Q100 Q101 V107 N108 | Q100-Q104 PolarHBondContact O-N 3.18Å; Q101-Q104 PolarHBondContact O-N 3.35Å; Q104-V107 PolarHBondContact O-N 3.23Å; Q104-N108 PolarHBondContact O-N 3.47Å |
| 105 | R | 80.9 | Confident | 73.1 | Confident | 80 Ų | 80 | 99.3 Ų | 99.3 | 30% | 0.302 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -61.6 | -47.1 | 172.6 | -178.4 | 175.1 | 59.4 | 75.1 | 2.5 | 111.5 | E97 Q101 V107 N108 E109 | E97-R105 IonicContact OE1-CZ 3.24Å; E97-R105 IonicContact OE1-NE 3.73Å; E97-R105 PolarHBondContact OE1-NE 3.22Å; E97-R105 IonicContact OE1-NH2 3.76Å; E97-R105 IonicContact OE2-CZ 2.67Å; E97-R105 IonicContact OE2-NE 2.7Å; E97-R105 IonicContact OE2-NH2 3.31Å; E97-R105 PolarHBondContact OE2-NH2 2.98Å; Q101-R105 PolarHBondContact O-N 3.06Å; Q101-R105 VanDerWaalsContact O-N 3.08Å; R105-V107 VanDerWaalsContact C-N 3.3Å; R105-V107 PolarHBondContact O-N 2.95Å; R105-N108 PolarHBondContact O-N 3.24Å; R105-E109 WeakPolarHBondContact CG-OE1 3.47Å; R105-E109 IonicContact CZ-OE1 3.76Å; R105-E109 IonicContact NH1-OE1 2.7Å; R105-E109 PolarHBondContact NH1-OE1 3.29Å; R105-E109 IonicContact NH1-OE2 3.71Å; R105-E109 PolarHBondContact NH1-OE2 3.2Å; R105-E109 PolarHBondContact O-N 3.27Å |
| 106 | L | 79.1 | Confident | 73.8 | Confident | 70 Ų | 70 | 100.5 Ų | 100.5 | 37% | 0.366 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -62.1 | -37.2 | 179.2 | -74.4 | 169.3 | 0 | 0 | 0 | 112.4 | K102 Y103 N108 E109 I110 | K102-L106 HydrophobicContact CG-CD1 4.13Å; K102-L106 WeakPolarHBondContact O-CB 3.27Å; K102-L106 VanDerWaalsContact O-CG 3.31Å; K102-L106 WeakPolarHBondContact O-CG 3.36Å; K102-L106 PolarHBondContact O-N 3.13Å; K102-L106 VanDerWaalsContact O-N 3.12Å; Y103-L106 PolarHBondContact O-N 3.1Å; L106-N108 VanDerWaalsContact C-N 3.34Å; L106-E109 PolarHBondContact O-N 2.96Å; L106-I110 WeakPolarHBondContact O-CB 3.43Å; L106-I110 WeakPolarHBondContact O-CD1 3.48Å; L106-I110 WeakPolarHBondContact O-CG1 3.36Å; L106-I110 PolarHBondContact O-N 2.97Å |
| 107 | V | 77.8 | Confident | 74.5 | Confident | 56 Ų | 56 | 94.7 Ų | 94.7 | 34% | 0.339 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -62.1 | -42.4 | 175.5 | 168.4 | 0 | 0 | 0 | 0 | 111.2 | Y103 Q104 R105 Q111 | Y103-V107 HydrophobicContact CD1-CG2 4.22Å; Y103-V107 HydrophobicContact CD2-CG2 4.49Å; Y103-V107 HydrophobicContact CE1-CG2 3.83Å; Y103-V107 HydrophobicContact CE2-CG2 4.13Å; Y103-V107 VanDerWaalsContact O-CG2 3.27Å; Y103-V107 WeakPolarHBondContact O-CG2 3.38Å; Y103-V107 PolarHBondContact O-N 3.5Å; Q104-V107 PolarHBondContact O-N 3.23Å; R105-V107 VanDerWaalsContact C-N 3.3Å; R105-V107 PolarHBondContact O-N 2.95Å; V107-Q111 WeakPolarHBondContact O-CB 3.47Å; V107-Q111 PolarHBondContact O-N 2.91Å; V107-Q111 VanDerWaalsContact O-N 3.1Å |
| 108 | N | 72.4 | Confident | 74.9 | Confident | 99 Ų | 99 | 95.6 Ų | 95.6 | 53% | 0.529 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -68.6 | -42.9 | 177.7 | -74.4 | -7.4 | 0 | 0 | 0 | 112.5 | Q104 R105 L106 I110 Q111 E112 | Q104-N108 PolarHBondContact O-N 3.47Å; R105-N108 PolarHBondContact O-N 3.24Å; L106-N108 VanDerWaalsContact C-N 3.34Å; N108-I110 VanDerWaalsContact C-N 3.33Å; N108-I110 PolarHBondContact O-N 3.44Å; N108-Q111 PolarHBondContact O-N 3.31Å; N108-Q111 VanDerWaalsContact O-N 3.13Å; N108-E112 PolarHBondContact O-N 3.26Å |
| 109 | E | 78.9 | Confident | 74.9 | Confident | 83 Ų | 83 | 96 Ų | 96 | 39% | 0.388 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -62.6 | -39.2 | 176.7 | -76 | 175 | -164.1 | 0 | 0 | 112.2 | R105 L106 Q111 L113 | R105-E109 WeakPolarHBondContact CG-OE1 3.47Å; R105-E109 IonicContact CZ-OE1 3.76Å; R105-E109 IonicContact NH1-OE1 2.7Å; R105-E109 PolarHBondContact NH1-OE1 3.29Å; R105-E109 IonicContact NH1-OE2 3.71Å; R105-E109 PolarHBondContact NH1-OE2 3.2Å; R105-E109 PolarHBondContact O-N 3.27Å; L106-E109 PolarHBondContact O-N 2.96Å; E109-Q111 VanDerWaalsContact C-N 3.3Å; E109-Q111 PolarHBondContact O-N 3.39Å; E109-L113 PolarHBondContact O-N 3.33Å; E109-L113 VanDerWaalsContact O-N 3.14Å |
| 110 | I | 79.1 | Confident | 75.3 | Confident | 107 Ų | 107 | 95.5 Ų | 95.5 | 55% | 0.549 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -64.5 | -38.3 | 174.8 | -71.1 | 167.1 | 0 | 0 | 0 | 110.5 | L106 N108 L113 V114 | L106-I110 WeakPolarHBondContact O-CB 3.43Å; L106-I110 WeakPolarHBondContact O-CD1 3.48Å; L106-I110 WeakPolarHBondContact O-CG1 3.36Å; L106-I110 PolarHBondContact O-N 2.97Å; N108-I110 VanDerWaalsContact C-N 3.33Å; N108-I110 PolarHBondContact O-N 3.44Å; I110-L113 PolarHBondContact O-N 3.42Å; I110-V114 VanDerWaalsContact O-CG2 3.3Å; I110-V114 WeakPolarHBondContact O-CG2 3.36Å; I110-V114 PolarHBondContact O-N 2.7Å; I110-V114 VanDerWaalsContact O-N 3.11Å |
| 111 | Q | 74.8 | Confident | 75.7 | Confident | 117 Ų | 117 | 94.3 Ų | 94.3 | 55% | 0.547 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -71.4 | -36.2 | -179 | -170.8 | 144.9 | 11.7 | 0 | 0 | 112.9 | V107 N108 E109 V114 Q115 | V107-Q111 WeakPolarHBondContact O-CB 3.47Å; V107-Q111 PolarHBondContact O-N 2.91Å; V107-Q111 VanDerWaalsContact O-N 3.1Å; N108-Q111 PolarHBondContact O-N 3.31Å; N108-Q111 VanDerWaalsContact O-N 3.13Å; E109-Q111 VanDerWaalsContact C-N 3.3Å; E109-Q111 PolarHBondContact O-N 3.39Å; Q111-V114 PolarHBondContact O-N 3.28Å; Q111-Q115 PolarHBondContact O-N 2.93Å |
| 112 | E | 77.4 | Confident | 75.4 | Confident | 137 Ų | 137 | 95.8 Ų | 95.8 | 64% | 0.64 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -62.9 | -45.6 | 172.6 | -172.6 | 173.8 | -173.2 | 0 | 0 | 111.3 | N108 V114 Q115 E116 | N108-E112 PolarHBondContact O-N 3.26Å; E112-V114 VanDerWaalsContact C-N 3.32Å; E112-V114 PolarHBondContact O-N 3.48Å; E112-Q115 PolarHBondContact O-N 2.97Å; E112-E116 PolarHBondContact O-N 3.48Å |
| 113 | L | 80.3 | Confident | 74.9 | Confident | 105 Ų | 105 | 95.3 Ų | 95.3 | 55% | 0.55 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -60.6 | -39.2 | 177.3 | -176.6 | 65.9 | 0 | 0 | 0 | 112.7 | E109 I110 E116 V117 | E109-L113 PolarHBondContact O-N 3.33Å; E109-L113 VanDerWaalsContact O-N 3.14Å; I110-L113 PolarHBondContact O-N 3.42Å; L113-E116 PolarHBondContact O-N 3.5Å; L113-V117 WeakPolarHBondContact O-CG2 3.47Å; L113-V117 PolarHBondContact O-N 3.41Å; L113-V117 VanDerWaalsContact O-N 3.12Å |
| 114 | V | 77.6 | Confident | 74.3 | Confident | 80 Ų | 80 | 90.9 Ų | 90.9 | 49% | 0.485 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -63.6 | -43.3 | 176.4 | 169.3 | 0 | 0 | 0 | 0 | 111.3 | I110 Q111 E112 E116 V117 D118 | I110-V114 VanDerWaalsContact O-CG2 3.3Å; I110-V114 WeakPolarHBondContact O-CG2 3.36Å; I110-V114 PolarHBondContact O-N 2.7Å; I110-V114 VanDerWaalsContact O-N 3.11Å; Q111-V114 PolarHBondContact O-N 3.28Å; E112-V114 VanDerWaalsContact C-N 3.32Å; E112-V114 PolarHBondContact O-N 3.48Å; V114-E116 VanDerWaalsContact C-N 3.33Å; V114-E116 PolarHBondContact O-N 3.23Å; V114-V117 PolarHBondContact O-N 2.98Å; V114-D118 PolarHBondContact O-N 2.88Å; V114-D118 VanDerWaalsContact O-N 3.1Å |
| 115 | Q | 75.5 | Confident | 73.9 | Confident | 126 Ų | 126 | 94.8 Ų | 94.8 | 59% | 0.589 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -63 | -40.5 | 176.7 | -77 | -177.1 | -6.1 | 0 | 0 | 111.9 | Q111 E112 V117 D118 T119 | Q111-Q115 PolarHBondContact O-N 2.93Å; E112-Q115 PolarHBondContact O-N 2.97Å; Q115-V117 PolarHBondContact O-N 3.32Å; Q115-D118 PolarHBondContact O-N 3.33Å; Q115-T119 WeakPolarHBondContact O-CG2 3.48Å; Q115-T119 PolarHBondContact O-N 2.92Å |
| 116 | E | 75.3 | Confident | 72.6 | Confident | 121 Ų | 121 | 98.4 Ų | 98.4 | 57% | 0.565 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -63 | -42.4 | 179 | -145.4 | 177.2 | -163.9 | 0 | 0 | 111.4 | E112 L113 V114 D118 T119 I120 | E112-E116 PolarHBondContact O-N 3.48Å; L113-E116 PolarHBondContact O-N 3.5Å; V114-E116 VanDerWaalsContact C-N 3.33Å; V114-E116 PolarHBondContact O-N 3.23Å; E116-D118 PolarHBondContact O-N 2.91Å; E116-T119 PolarHBondContact O-N 3.37Å; E116-T119 PolarHBondContact O-OG1 2.95Å; E116-I120 WeakPolarHBondContact O-CG1 3.25Å; E116-I120 PolarHBondContact O-N 3.07Å; E116-I120 VanDerWaalsContact O-N 3.16Å |
| 117 | V | 76 | Confident | 71.4 | Confident | 83 Ų | 83 | 99.7 Ų | 99.7 | 50% | 0.503 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -64.2 | -40.1 | 175.8 | 172.5 | 0 | 0 | 0 | 0 | 112.4 | L113 V114 Q115 I120 Q121 | L113-V117 WeakPolarHBondContact O-CG2 3.47Å; L113-V117 PolarHBondContact O-N 3.41Å; L113-V117 VanDerWaalsContact O-N 3.12Å; V114-V117 PolarHBondContact O-N 2.98Å; Q115-V117 PolarHBondContact O-N 3.32Å; V117-I120 PolarHBondContact O-N 3.3Å; V117-Q121 PolarHBondContact O-N 3.26Å |
| 118 | D | 74.5 | Confident | 70.4 | Confident | 93 Ų | 93 | 102.7 Ų | 102.7 | 50% | 0.497 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -66.1 | -37.1 | 177.7 | -80.8 | -21.7 | 0 | 0 | 0 | 112.1 | V114 Q115 E116 I120 Q121 A122 | V114-D118 PolarHBondContact O-N 2.88Å; V114-D118 VanDerWaalsContact O-N 3.1Å; Q115-D118 PolarHBondContact O-N 3.33Å; E116-D118 PolarHBondContact O-N 2.91Å; D118-I120 PolarHBondContact O-N 2.87Å; D118-Q121 PolarHBondContact O-N 2.93Å; D118-A122 PolarHBondContact O-N 2.88Å |
| 119 | T | 76.1 | Confident | 69.5 | Low | 86 Ų | 86 | 101.3 Ų | 101.3 | 53% | 0.528 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -66 | -36.3 | 174.8 | 63.5 | 0 | 0 | 0 | 0 | 112.7 | Q115 E116 T123 | Q115-T119 WeakPolarHBondContact O-CG2 3.48Å; Q115-T119 PolarHBondContact O-N 2.92Å; E116-T119 PolarHBondContact O-N 3.37Å; E116-T119 PolarHBondContact O-OG1 2.95Å; T119-T123 WeakPolarHBondContact O-CG2 3.34Å; T119-T123 PolarHBondContact O-N 3.42Å; T119-T123 PolarHBondContact O-OG1 3.49Å |
| 120 | I | 75.8 | Confident | 68.2 | Low | 108 Ų | 108 | 106.8 Ų | 106.8 | 55% | 0.554 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -68.3 | -36.7 | 173.9 | -65.1 | 165.8 | 0 | 0 | 0 | 110.8 | E116 V117 D118 T123 A124 | E116-I120 WeakPolarHBondContact O-CG1 3.25Å; E116-I120 PolarHBondContact O-N 3.07Å; E116-I120 VanDerWaalsContact O-N 3.16Å; V117-I120 PolarHBondContact O-N 3.3Å; D118-I120 PolarHBondContact O-N 2.87Å; I120-T123 WeakPolarHBondContact CA-OG1 3.41Å; I120-T123 PolarHBondContact O-OG1 3.49Å; I120-A124 PolarHBondContact O-N 2.88Å |
| 121 | Q | 71.9 | Confident | 67 | Low | 101 Ų | 101 | 110 Ų | 110 | 47% | 0.472 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -71.4 | -36.9 | 178.3 | -159.2 | -168.5 | 76 | 0 | 0 | 112.5 | V117 D118 A124 K125 | V117-Q121 PolarHBondContact O-N 3.26Å; D118-Q121 PolarHBondContact O-N 2.93Å; Q121-A124 PolarHBondContact O-N 3.31Å; Q121-K125 WeakPolarHBondContact O-CG 3.21Å; Q121-K125 PolarHBondContact O-N 3.29Å |
| 122 | A | 64.9 | Low | 66.2 | Low | 54 Ų | 54 | 114.3 Ų | 114.3 | 45% | 0.446 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -63.7 | -45.5 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | D118 A124 K125 E126 | D118-A122 PolarHBondContact O-N 2.88Å; A122-A124 VanDerWaalsContact C-N 3.32Å; A122-A124 PolarHBondContact O-N 2.94Å; A122-K125 PolarHBondContact O-N 3.3Å; A122-E126 PolarHBondContact O-N 2.86Å |
| 123 | T | 61.2 | Low | 65.2 | Low | 95 Ų | 95 | 114.5 Ų | 114.5 | 58% | 0.583 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -65.9 | -30.5 | 178.9 | 47.2 | 0 | 0 | 0 | 0 | 113.3 | T119 I120 | T119-T123 WeakPolarHBondContact O-CG2 3.34Å; T119-T123 PolarHBondContact O-N 3.42Å; T119-T123 PolarHBondContact O-OG1 3.49Å; I120-T123 WeakPolarHBondContact CA-OG1 3.41Å; I120-T123 PolarHBondContact O-OG1 3.49Å |
| 124 | A | 60.9 | Low | 64.6 | Low | 57 Ų | 57 | 112.8 Ų | 112.8 | 47% | 0.471 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -77.6 | -23.7 | 175.6 | 0 | 0 | 0 | 0 | 0 | 114.5 | I120 Q121 A122 S127 | I120-A124 PolarHBondContact O-N 2.88Å; Q121-A124 PolarHBondContact O-N 3.31Å; A122-A124 VanDerWaalsContact C-N 3.32Å; A122-A124 PolarHBondContact O-N 2.94Å; A124-S127 PolarHBondContact O-OG 3.45Å |
| 125 | K | 60.8 | Low | 63.9 | Low | 132 Ų | 132 | 114.3 Ų | 114.3 | 57% | 0.574 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -80.3 | -30 | -179.7 | -81 | 173 | 176 | 166.6 | 0 | 112.9 | Q121 A122 S127 N128 | Q121-K125 WeakPolarHBondContact O-CG 3.21Å; Q121-K125 PolarHBondContact O-N 3.29Å; A122-K125 PolarHBondContact O-N 3.3Å; K125-S127 VanDerWaalsContact C-N 3.3Å; K125-S127 PolarHBondContact O-N 3.02Å; K125-N128 PolarHBondContact O-N 3.13Å |
| 126 | E | 54.1 | Low | 63.8 | Low | 157 Ų | 157 | 113.3 Ų | 113.3 | 73% | 0.734 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -65.5 | -29.7 | 179.7 | -74.5 | -179.9 | 165.2 | 0 | 0 | 113.2 | A122 N128 | A122-E126 PolarHBondContact O-N 2.86Å; E126-N128 VanDerWaalsContact C-N 3.3Å; E126-N128 PolarHBondContact O-N 3.27Å |
| 127 | S | 54.7 | Low | 63.7 | Low | 97 Ų | 97 | 110 Ų | 110 | 68% | 0.678 | 60% | 0.601 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.7 | -7.4 | 180 | 35.4 | 0 | 0 | 0 | 0 | 116.2 | A124 K125 | A124-S127 PolarHBondContact O-OG 3.45Å; K125-S127 VanDerWaalsContact C-N 3.3Å; K125-S127 PolarHBondContact O-N 3.02Å |
| 128 | N | 56.7 | Low | 63.6 | Low | 118 Ų | 118 | 110.5 Ų | 110.5 | 63% | 0.631 | 60% | 0.6 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -108.5 | 2.9 | -176.1 | -92.7 | -57.3 | 0 | 0 | 0 | 114.3 | K125 E126 | K125-N128 PolarHBondContact O-N 3.13Å; E126-N128 VanDerWaalsContact C-N 3.3Å; E126-N128 PolarHBondContact O-N 3.27Å |
| 129 | A | 52.6 | Low | 63.5 | Low | 71 Ų | 71 | 109 Ų | 109 | 59% | 0.587 | 60% | 0.6 | S | S | * | * | S | Bend | trans | -86 | -23.3 | -169.1 | 0 | 0 | 0 | 0 | 0 | 114.8 | E131 | A129-E131 PolarHBondContact O-N 3.4Š|
| 130 | E | 52.6 | Low | 63.7 | Low | 197 Ų | 197 | 110.5 Ų | 110.5 | 92% | 0.921 | 60% | 0.602 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.8 | -11.6 | -171.7 | -67.5 | -166.2 | 151.6 | 0 | 0 | 114.9 | ||
| 131 | E | 54.3 | Low | 63.7 | Low | 176 Ų | 176 | 110.2 Ų | 110.2 | 82% | 0.822 | 60% | 0.598 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.1 | 2.8 | -171.6 | -136.4 | 177.6 | -169.5 | 0 | 0 | 115 | A129 | A129-E131 PolarHBondContact O-N 3.4Š|
| 132 | R | 56.8 | Low | 63.9 | Low | 206 Ų | 206 | 108.3 Ų | 108.3 | 78% | 0.777 | 60% | 0.599 | S | S | * | * | trans | -97.6 | -7.8 | -167.3 | -79.1 | -171.3 | 172.4 | -170.9 | -1.1 | 117.6 | T134 | R132-T134 PolarHBondContact O-N 2.87Š| ||
| 133 | L | 57.2 | Low | 64.6 | Low | 141 Ų | 141 | 108.5 Ų | 108.5 | 74% | 0.738 | 60% | 0.601 | S | S | * | * | trans | -94.4 | 74.8 | -175.5 | -74.3 | 163.4 | 0 | 0 | 0 | 111.9 | L138 | L133-L138 HydrophobicContact CD2-CD1 3.97Š| ||
| 134 | T | 67.5 | Low | 65.7 | Low | 70 Ų | 70 | 109.2 Ų | 109.2 | 43% | 0.429 | 60% | 0.598 | S | S | . | * | trans | -88.8 | 148.1 | 170.8 | 57.9 | 0 | 0 | 0 | 0 | 111.3 | R132 V136 V137 L138 | R132-T134 PolarHBondContact O-N 2.87Å; T134-V136 PolarHBondContact O-N 3Å; T134-V136 VanDerWaalsContact O-N 3.07Å; T134-V137 WeakPolarHBondContact O-CB 3.4Å; T134-V137 PolarHBondContact O-N 2.7Å; T134-V137 WeakPolarHBondContact OG1-CG2 3.4Å; T134-L138 PolarHBondContact O-N 3.4Å | ||
| 135 | P | 62.3 | Low | 66.6 | Low | 111 Ų | 111 | 112.1 Ų | 112.1 | 72% | 0.721 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -56.7 | -26.9 | -178.8 | -25.6 | 33.3 | 0 | 0 | 0 | 114.6 | L138 A139 | P135-L138 PolarHBondContact O-N 2.9Å; P135-A139 PolarHBondContact O-N 3.44Å |
| 136 | V | 73.1 | Confident | 67.5 | Low | 105 Ų | 105 | 113.2 Ų | 113.2 | 64% | 0.636 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -66.9 | -37.1 | 174.8 | 173.5 | 0 | 0 | 0 | 0 | 111.4 | T134 A139 Q140 | T134-V136 PolarHBondContact O-N 3Å; T134-V136 VanDerWaalsContact O-N 3.07Å; V136-A139 PolarHBondContact O-N 2.9Å; V136-Q140 WeakPolarHBondContact O-CB 3.45Å; V136-Q140 PolarHBondContact O-N 2.91Å |
| 137 | V | 74.4 | Confident | 69 | Low | 53 Ų | 53 | 112.5 Ų | 112.5 | 32% | 0.321 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -68.4 | -39.6 | 175.7 | 176.9 | 0 | 0 | 0 | 0 | 110.5 | T134 Q140 Q141 | T134-V137 WeakPolarHBondContact O-CB 3.4Å; T134-V137 PolarHBondContact O-N 2.7Å; T134-V137 WeakPolarHBondContact OG1-CG2 3.4Å; V137-Q140 PolarHBondContact O-N 3.42Å; V137-Q141 WeakPolarHBondContact O-CB 3.25Å; V137-Q141 VanDerWaalsContact O-CG 3.29Å; V137-Q141 WeakPolarHBondContact O-CG 3.4Å; V137-Q141 PolarHBondContact O-N 2.88Å |
| 138 | L | 72.3 | Confident | 70.3 | Confident | 92 Ų | 92 | 113.8 Ų | 113.8 | 48% | 0.482 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -63.8 | -41.2 | 173.4 | -88.4 | 76 | 0 | 0 | 0 | 111.9 | L133 T134 P135 Q140 Q141 A142 | L133-L138 HydrophobicContact CD2-CD1 3.97Å; T134-L138 PolarHBondContact O-N 3.4Å; P135-L138 PolarHBondContact O-N 2.9Å; L138-Q140 VanDerWaalsContact C-N 3.33Å; L138-Q140 PolarHBondContact O-N 3.01Å; L138-Q141 PolarHBondContact O-N 3.17Å; L138-A142 WeakPolarHBondContact O-CB 3.44Å; L138-A142 PolarHBondContact O-N 3.24Å |
| 139 | A | 74.1 | Confident | 71.6 | Confident | 61 Ų | 61 | 114.3 Ų | 114.3 | 50% | 0.504 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -64.5 | -38 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | P135 V136 A142 A143 | P135-A139 PolarHBondContact O-N 3.44Å; V136-A139 PolarHBondContact O-N 2.9Å; A139-A142 PolarHBondContact O-N 3.47Å; A139-A143 WeakPolarHBondContact O-CB 3.33Å; A139-A143 PolarHBondContact O-N 3.37Å |
| 140 | Q | 78.8 | Confident | 73 | Confident | 118 Ų | 118 | 115 Ų | 115 | 55% | 0.551 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -69.9 | -38.2 | 176 | -171.3 | 153.5 | 1.9 | 0 | 0 | 112.4 | V136 V137 L138 A143 Q144 | V136-Q140 WeakPolarHBondContact O-CB 3.45Å; V136-Q140 PolarHBondContact O-N 2.91Å; V137-Q140 PolarHBondContact O-N 3.42Å; L138-Q140 VanDerWaalsContact C-N 3.33Å; L138-Q140 PolarHBondContact O-N 3.01Å; Q140-A143 PolarHBondContact O-N 2.91Å; Q140-Q144 WeakPolarHBondContact O-CG 3.33Å; Q140-Q144 PolarHBondContact O-N 3.49Å |
| 141 | Q | 75.7 | Confident | 74.4 | Confident | 103 Ų | 103 | 108.3 Ų | 108.3 | 48% | 0.481 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -63.7 | -42.1 | 171.7 | -74.1 | 174.3 | -5.1 | 0 | 0 | 111.6 | V137 L138 A143 Q144 L145 | V137-Q141 WeakPolarHBondContact O-CB 3.25Å; V137-Q141 VanDerWaalsContact O-CG 3.29Å; V137-Q141 WeakPolarHBondContact O-CG 3.4Å; V137-Q141 PolarHBondContact O-N 2.88Å; L138-Q141 PolarHBondContact O-N 3.17Å; Q141-A143 PolarHBondContact O-N 3.24Å; Q141-Q144 PolarHBondContact O-N 3.5Å; Q141-L145 WeakPolarHBondContact O-CB 3.42Å; Q141-L145 PolarHBondContact O-N 3.33Å |
| 142 | A | 78 | Confident | 75.6 | Confident | 60 Ų | 60 | 102.6 Ų | 102.6 | 50% | 0.496 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -64.7 | -37.9 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | L138 A139 L145 K146 | L138-A142 WeakPolarHBondContact O-CB 3.44Å; L138-A142 PolarHBondContact O-N 3.24Å; A139-A142 PolarHBondContact O-N 3.47Å; A142-L145 PolarHBondContact O-N 2.9Å; A142-K146 WeakPolarHBondContact O-CB 3.49Å; A142-K146 PolarHBondContact O-N 2.88Å |
| 143 | A | 79.1 | Confident | 76.7 | Confident | 58 Ų | 58 | 98.8 Ų | 98.8 | 48% | 0.479 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -67.2 | -40.4 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | A139 Q140 Q141 K146 Q147 | A139-A143 WeakPolarHBondContact O-CB 3.33Å; A139-A143 PolarHBondContact O-N 3.37Å; Q140-A143 PolarHBondContact O-N 2.91Å; Q141-A143 PolarHBondContact O-N 3.24Å; A143-K146 PolarHBondContact O-N 3.4Å; A143-Q147 PolarHBondContact O-N 2.97Å |
| 144 | Q | 83.3 | Confident | 77.5 | Confident | 110 Ų | 110 | 95.8 Ų | 95.8 | 51% | 0.514 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -64.3 | -41.4 | 173.3 | -75.5 | 175.7 | -8.7 | 0 | 0 | 111.8 | Q140 Q141 K146 Q147 Q148 | Q140-Q144 WeakPolarHBondContact O-CG 3.33Å; Q140-Q144 PolarHBondContact O-N 3.49Å; Q141-Q144 PolarHBondContact O-N 3.5Å; Q144-K146 VanDerWaalsContact C-N 3.33Å; Q144-K146 PolarHBondContact O-N 3.49Å; Q144-Q147 WeakPolarHBondContact O-CB 3.36Å; Q144-Q147 PolarHBondContact O-N 3.48Å; Q144-Q148 WeakPolarHBondContact O-CG 3.5Å; Q144-Q148 PolarHBondContact O-N 2.95Å |
| 145 | L | 81.2 | Confident | 78 | Confident | 119 Ų | 119 | 97.5 Ų | 97.5 | 62% | 0.623 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -62.4 | -41.8 | 176.2 | -157.9 | 86.9 | 0 | 0 | 0 | 111.3 | Q141 A142 Q147 Q148 L149 | Q141-L145 WeakPolarHBondContact O-CB 3.42Å; Q141-L145 PolarHBondContact O-N 3.33Å; A142-L145 PolarHBondContact O-N 2.9Å; L145-Q147 VanDerWaalsContact C-N 3.35Å; L145-Q147 PolarHBondContact O-N 2.86Å; L145-Q148 PolarHBondContact O-N 2.94Å; L145-L149 WeakPolarHBondContact O-CB 3.44Å; L145-L149 PolarHBondContact O-N 2.89Å |
| 146 | K | 79.3 | Confident | 78.8 | Confident | 155 Ų | 155 | 97.1 Ų | 97.1 | 67% | 0.674 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -60.8 | -43.4 | 173.8 | -178.6 | -178 | 174.1 | -179 | 0 | 111.5 | A142 A143 Q144 L149 V150 | A142-K146 WeakPolarHBondContact O-CB 3.49Å; A142-K146 PolarHBondContact O-N 2.88Å; A143-K146 PolarHBondContact O-N 3.4Å; Q144-K146 VanDerWaalsContact C-N 3.33Å; Q144-K146 PolarHBondContact O-N 3.49Å; K146-L149 PolarHBondContact O-N 3.38Å; K146-V150 WeakPolarHBondContact O-CG2 3.26Å; K146-V150 PolarHBondContact O-N 3.37Å; K146-V150 VanDerWaalsContact O-N 3.12Å |
| 147 | Q | 85.2 | Confident | 78.9 | Confident | 142 Ų | 142 | 98 Ų | 98 | 66% | 0.664 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -62.4 | -43.7 | 177.2 | -168.5 | 76.2 | 23.2 | 0 | 0 | 111.3 | A143 Q144 L145 V150 S151 | A143-Q147 PolarHBondContact O-N 2.97Å; Q144-Q147 WeakPolarHBondContact O-CB 3.36Å; Q144-Q147 PolarHBondContact O-N 3.48Å; L145-Q147 VanDerWaalsContact C-N 3.35Å; L145-Q147 PolarHBondContact O-N 2.86Å; Q147-V150 PolarHBondContact O-N 3.31Å; Q147-S151 PolarHBondContact O-N 2.88Å; Q147-S151 PolarHBondContact O-OG 3.39Å |
| 148 | Q | 82.5 | Confident | 78.8 | Confident | 123 Ų | 123 | 99 Ų | 99 | 58% | 0.575 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -64.4 | -38.5 | 177.6 | -74.7 | 177.6 | -22 | 0 | 0 | 112.7 | Q144 L145 S151 A152 | Q144-Q148 WeakPolarHBondContact O-CG 3.5Å; Q144-Q148 PolarHBondContact O-N 2.95Å; L145-Q148 PolarHBondContact O-N 2.94Å; Q148-S151 WeakPolarHBondContact CA-OG 3.49Å; Q148-S151 PolarHBondContact O-N 3.31Å; Q148-S151 PolarHBondContact O-OG 3.19Å; Q148-A152 WeakPolarHBondContact O-CB 3.44Å; Q148-A152 PolarHBondContact O-N 3.24Å |
| 149 | L | 82.4 | Confident | 78.6 | Confident | 129 Ų | 129 | 95.9 Ų | 95.9 | 68% | 0.675 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -65.5 | -41.2 | 176.9 | -174.3 | 65.3 | 0 | 0 | 0 | 111.5 | L145 K146 A152 H153 | L145-L149 WeakPolarHBondContact O-CB 3.44Å; L145-L149 PolarHBondContact O-N 2.89Å; K146-L149 PolarHBondContact O-N 3.38Å; L149-A152 PolarHBondContact O-N 3.24Å; L149-H153 WeakPolarHBondContact O-CB 3.44Å; L149-H153 PolarHBondContact O-N 3.24Å |
| 150 | V | 83.6 | Confident | 78.2 | Confident | 87 Ų | 87 | 99.3 Ų | 99.3 | 53% | 0.527 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -66.4 | -40.3 | 176.9 | 173.2 | 0 | 0 | 0 | 0 | 111.1 | K146 Q147 H153 L154 | K146-V150 WeakPolarHBondContact O-CG2 3.26Å; K146-V150 PolarHBondContact O-N 3.37Å; K146-V150 VanDerWaalsContact O-N 3.12Å; Q147-V150 PolarHBondContact O-N 3.31Å; V150-H153 PolarHBondContact O-N 3.26Å; V150-L154 WeakPolarHBondContact O-CB 3.17Å; V150-L154 PolarHBondContact O-N 2.97Å |
| 151 | S | 81.2 | Confident | 77.1 | Confident | 55 Ų | 55 | 101.3 Ų | 101.3 | 39% | 0.385 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -66.8 | -42.1 | 175.7 | 59.5 | 0 | 0 | 0 | 0 | 112.5 | Q147 Q148 H153 L154 D155 | Q147-S151 PolarHBondContact O-N 2.88Å; Q147-S151 PolarHBondContact O-OG 3.39Å; Q148-S151 WeakPolarHBondContact CA-OG 3.49Å; Q148-S151 PolarHBondContact O-N 3.31Å; Q148-S151 PolarHBondContact O-OG 3.19Å; S151-H153 VanDerWaalsContact C-N 3.32Å; S151-H153 PolarHBondContact O-N 3.43Å; S151-L154 WeakPolarHBondContact O-CB 3.37Å; S151-L154 PolarHBondContact O-N 2.95Å; S151-L154 VanDerWaalsContact O-N 3.11Å; S151-D155 PolarHBondContact O-N 3.02Å |
| 152 | A | 78.8 | Confident | 76.4 | Confident | 56 Ų | 56 | 98.6 Ų | 98.6 | 46% | 0.463 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -63.4 | -38.2 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | Q148 L149 L154 D155 S156 | Q148-A152 WeakPolarHBondContact O-CB 3.44Å; Q148-A152 PolarHBondContact O-N 3.24Å; L149-A152 PolarHBondContact O-N 3.24Å; A152-L154 VanDerWaalsContact C-N 3.33Å; A152-D155 PolarHBondContact O-N 3.28Å; A152-S156 PolarHBondContact O-N 2.77Å; A152-S156 VanDerWaalsContact O-N 3.16Å |
| 153 | H | 79.8 | Confident | 75.7 | Confident | 126 Ų | 126 | 104.1 Ų | 104.1 | 58% | 0.583 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -67.7 | -34.5 | 174 | -171 | -86.5 | 0 | 0 | 0 | 112.1 | L149 V150 S151 L157 | L149-H153 WeakPolarHBondContact O-CB 3.44Å; L149-H153 PolarHBondContact O-N 3.24Å; V150-H153 PolarHBondContact O-N 3.26Å; S151-H153 VanDerWaalsContact C-N 3.32Å; S151-H153 PolarHBondContact O-N 3.43Å; H153-L157 VanDerWaalsContact CE1-CD1 3.49Å; H153-L157 WeakPolarHBondContact CE1-CD1 3.45Å; H153-L157 WeakPolarHBondContact ND1-CD1 3.27Å; H153-L157 WeakPolarHBondContact O-CG 3.42Å; H153-L157 PolarHBondContact O-N 3.26Å |
| 154 | L | 76.1 | Confident | 75.1 | Confident | 78 Ų | 78 | 105.9 Ų | 105.9 | 41% | 0.408 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -66.7 | -44 | 175.4 | -167.1 | 63.9 | 0 | 0 | 0 | 111.1 | V150 S151 A152 S156 L157 L158 I164 | V150-L154 WeakPolarHBondContact O-CB 3.17Å; V150-L154 PolarHBondContact O-N 2.97Å; S151-L154 WeakPolarHBondContact O-CB 3.37Å; S151-L154 PolarHBondContact O-N 2.95Å; S151-L154 VanDerWaalsContact O-N 3.11Å; A152-L154 VanDerWaalsContact C-N 3.33Å; L154-S156 VanDerWaalsContact C-N 3.32Å; L154-S156 PolarHBondContact O-N 2.99Å; L154-L157 PolarHBondContact O-N 3.02Å; L154-L157 VanDerWaalsContact O-N 3.08Å; L154-L158 HydrophobicContact CD1-CD1 3.46Å; L154-L158 VanDerWaalsContact CD1-CD1 3.46Å; L154-L158 HydrophobicContact CG-CD1 3.65Å; L154-L158 WeakPolarHBondContact O-CD1 3.41Å; L154-L158 PolarHBondContact O-N 3.25Å; L154-I164 HydrophobicContact CD2-CD1 4.13Å |
| 155 | D | 77.2 | Confident | 74.3 | Confident | 106 Ų | 106 | 105.5 Ų | 105.5 | 57% | 0.567 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -61.4 | -39.1 | 176.3 | -69.7 | -18.8 | 0 | 0 | 0 | 112.3 | S151 A152 L157 G159 | S151-D155 PolarHBondContact O-N 3.02Å; A152-D155 PolarHBondContact O-N 3.28Å; D155-L157 VanDerWaalsContact C-N 3.28Å; D155-L157 PolarHBondContact O-N 3.18Å; D155-G159 PolarHBondContact O-N 3.47Å |
| 156 | S | 79.1 | Confident | 73.6 | Confident | 103 Ų | 103 | 107.4 Ų | 107.4 | 72% | 0.72 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -65.2 | -29.9 | 174.6 | -175.1 | 0 | 0 | 0 | 0 | 113.4 | A152 L154 | A152-S156 PolarHBondContact O-N 2.77Å; A152-S156 VanDerWaalsContact O-N 3.16Å; L154-S156 VanDerWaalsContact C-N 3.32Å; L154-S156 PolarHBondContact O-N 2.99Å |
| 157 | L | 74.8 | Confident | 73.2 | Confident | 123 Ų | 123 | 103.7 Ų | 103.7 | 64% | 0.644 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -83.3 | -36.8 | -179.7 | -78.4 | 169.3 | 0 | 0 | 0 | 112.7 | H153 L154 D155 | H153-L157 VanDerWaalsContact CE1-CD1 3.49Å; H153-L157 WeakPolarHBondContact CE1-CD1 3.45Å; H153-L157 WeakPolarHBondContact ND1-CD1 3.27Å; H153-L157 WeakPolarHBondContact O-CG 3.42Å; H153-L157 PolarHBondContact O-N 3.26Å; L154-L157 PolarHBondContact O-N 3.02Å; L154-L157 VanDerWaalsContact O-N 3.08Å; D155-L157 VanDerWaalsContact C-N 3.28Å; D155-L157 PolarHBondContact O-N 3.18Å |
| 158 | L | 73.4 | Confident | 72.2 | Confident | 76 Ų | 76 | 98 Ų | 98 | 40% | 0.398 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -83.4 | -17.6 | 179.6 | -80 | 86.1 | 0 | 0 | 0 | 113.2 | L154 A162 I164 | L154-L158 HydrophobicContact CD1-CD1 3.46Å; L154-L158 VanDerWaalsContact CD1-CD1 3.46Å; L154-L158 HydrophobicContact CG-CD1 3.65Å; L154-L158 WeakPolarHBondContact O-CD1 3.41Å; L154-L158 PolarHBondContact O-N 3.25Å; L158-A162 HydrophobicContact CB-CB 3.7Å; L158-A162 HydrophobicContact CD2-CB 4.18Å; L158-A162 WeakPolarHBondContact O-CB 3.29Å; L158-I164 HydrophobicContact CD1-CD1 4.4Å; L158-I164 HydrophobicContact CD2-CD1 3.37Å; L158-I164 HydrophobicContact CD2-CG1 3.45Å; L158-I164 VanDerWaalsContact CD2-CG1 3.45Å |
| 159 | G | 67 | Low | 71.4 | Confident | 26 Ų | 26 | 97.3 Ų | 97.3 | 27% | 0.268 | 56% | 0.56 | S | S | . | * | trans | 87.3 | 158 | 179.9 | 0 | 0 | 0 | 0 | 0 | 113 | D155 Q161 A162 | D155-G159 PolarHBondContact O-N 3.47Å; G159-Q161 PolarHBondContact O-N 3.46Å; G159-A162 PolarHBondContact O-N 3.17Å | ||
| 160 | P | 66.9 | Low | 70.9 | Confident | 132 Ų | 132 | 97.4 Ų | 97.4 | 86% | 0.857 | 56% | 0.562 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67 | -1.1 | -165.5 | 23.4 | -32.8 | 0 | 0 | 0 | 116.1 | ||
| 161 | Q | 55.6 | Low | 70.4 | Confident | 160 Ų | 160 | 94.4 Ų | 94.4 | 75% | 0.748 | 55% | 0.549 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -123.8 | 5.2 | -174.8 | -61.9 | -65 | -17.7 | 0 | 0 | 113.2 | G159 H163 | G159-Q161 PolarHBondContact O-N 3.46Å; Q161-H163 PolarHBondContact O-N 3.17Å |
| 162 | A | 59.8 | Low | 70.2 | Confident | 47 Ų | 47 | 94.3 Ų | 94.3 | 39% | 0.388 | 55% | 0.551 | S | S | . | * | trans | -89.7 | 102.7 | -176.9 | 0 | 0 | 0 | 0 | 0 | 111.1 | L158 G159 I164 | L158-A162 HydrophobicContact CB-CB 3.7Å; L158-A162 HydrophobicContact CD2-CB 4.18Å; L158-A162 WeakPolarHBondContact O-CB 3.29Å; G159-A162 PolarHBondContact O-N 3.17Å; A162-I164 PolarHBondContact O-N 3.22Å | ||
| 163 | H | 63.5 | Low | 70.1 | Confident | 175 Ų | 175 | 96.9 Ų | 96.9 | 81% | 0.81 | 56% | 0.557 | S | S | * | * | trans | -85.4 | 107.8 | 173.2 | -64.6 | -51.3 | 0 | 0 | 0 | 110.8 | Q161 N165 | Q161-H163 PolarHBondContact O-N 3.17Å; H163-N165 PolarHBondContact O-N 2.61Å | ||
| 164 | I | 65.9 | Low | 69.9 | Low | 95 Ų | 95 | 93.5 Ų | 93.5 | 49% | 0.487 | 55% | 0.55 | S | S | . | * | trans | -82.6 | 105.8 | 173.5 | -46.5 | 175.9 | 0 | 0 | 0 | 108.9 | L154 L158 A162 L166 | L154-I164 HydrophobicContact CD2-CD1 4.13Å; L158-I164 HydrophobicContact CD1-CD1 4.4Å; L158-I164 HydrophobicContact CD2-CD1 3.37Å; L158-I164 HydrophobicContact CD2-CG1 3.45Å; L158-I164 VanDerWaalsContact CD2-CG1 3.45Å; A162-I164 PolarHBondContact O-N 3.22Å; I164-L166 HydrophobicContact CG2-CG 4.34Å | ||
| 165 | N | 66.3 | Low | 70.1 | Confident | 102 Ų | 102 | 98.2 Ų | 98.2 | 55% | 0.545 | 56% | 0.563 | S | S | . | * | trans | -95 | 96.7 | 170.8 | -167.1 | -8.9 | 0 | 0 | 0 | 110.4 | H163 A167 D168 | H163-N165 PolarHBondContact O-N 2.61Å; N165-A167 PolarHBondContact O-N 3.37Å; N165-A167 WeakPolarHBondContact OD1-CB 3.39Å; N165-A167 PolarHBondContact OD1-N 3.04Å; N165-D168 CarbonylContact O-C 3.35Å; N165-D168 PolarHBondContact O-N 2.98Å | ||
| 166 | L | 67.8 | Low | 70.2 | Confident | 159 Ų | 159 | 101 Ų | 101 | 83% | 0.832 | 57% | 0.565 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65 | -19.7 | 179.1 | -73.5 | 159 | 0 | 0 | 0 | 113.6 | I164 | I164-L166 HydrophobicContact CG2-CG 4.34Š|
| 167 | A | 69.5 | Low | 70.3 | Confident | 78 Ų | 78 | 101 Ų | 101 | 65% | 0.645 | 56% | 0.557 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.5 | -20.7 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113 | N165 | N165-A167 PolarHBondContact O-N 3.37Å; N165-A167 WeakPolarHBondContact OD1-CB 3.39Å; N165-A167 PolarHBondContact OD1-N 3.04Å |
| 168 | D | 65.9 | Low | 70.6 | Confident | 23 Ų | 23 | 100 Ų | 100 | 12% | 0.123 | 55% | 0.551 | C | S | . | * | trans | -144.2 | 74.2 | 177.3 | -166.4 | 13.4 | 0 | 0 | 0 | 110.8 | N165 D170 G171 A172 L173 A174 | N165-D168 CarbonylContact O-C 3.35Å; N165-D168 PolarHBondContact O-N 2.98Å; D168-D170 PolarHBondContact O-N 3.37Å; D168-G171 VanDerWaalsContact CG-CA 3.42Å; D168-G171 PolarHBondContact O-N 3.5Å; D168-G171 WeakPolarHBondContact OD1-CA 3.46Å; D168-G171 PolarHBondContact OD1-N 3.45Å; D168-G171 WeakPolarHBondContact OD2-CA 3.36Å; D168-A172 PolarHBondContact OD1-N 2.9Å; D168-A172 PolarHBondContact OD2-N 2.9Å; D168-L173 HydrophobicContact CB-CB 4.37Å; D168-L173 HydrophobicContact CB-CD1 4.27Å; D168-L173 PolarHBondContact OD1-N 3.1Å; D168-L173 VanDerWaalsContact OD1-N 3.13Å; D168-L173 WeakPolarHBondContact OD2-CA 3.43Å; D168-L173 WeakPolarHBondContact OD2-CB 3.49Å; D168-L173 PolarHBondContact OD2-N 3.31Å; D168-A174 PolarHBondContact OD2-N 3.49Å | ||
| 169 | P | 66 | Low | 71.1 | Confident | 107 Ų | 107 | 100.5 Ų | 100.5 | 70% | 0.695 | 56% | 0.557 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64 | -27.3 | -172.6 | 23.9 | -33.4 | 0 | 0 | 0 | 113.7 | ||
| 170 | D | 70.4 | Confident | 71.6 | Confident | 131 Ų | 131 | 104.3 Ų | 104.3 | 70% | 0.701 | 57% | 0.569 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -104.4 | 1.4 | -179.5 | -69.4 | -27.9 | 0 | 0 | 0 | 113.2 | D168 A172 | D168-D170 PolarHBondContact O-N 3.37Å; D170-A172 HydrophobicContact CB-CB 4.35Å; D170-A172 PolarHBondContact O-N 3.04Å |
| 171 | G | 74 | Confident | 72 | Confident | 25 Ų | 25 | 101.8 Ų | 101.8 | 26% | 0.258 | 55% | 0.547 | S | S | . | . | S | Bend | trans | 63.2 | 20.8 | -171.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | D168 R175 | D168-G171 VanDerWaalsContact CG-CA 3.42Å; D168-G171 PolarHBondContact O-N 3.5Å; D168-G171 WeakPolarHBondContact OD1-CA 3.46Å; D168-G171 PolarHBondContact OD1-N 3.45Å; D168-G171 WeakPolarHBondContact OD2-CA 3.36Å; G171-R175 WeakPolarHBondContact O-CG 3.46Å; G171-R175 PolarHBondContact O-N 3.06Å |
| 172 | A | 76 | Confident | 73.1 | Confident | 53 Ų | 53 | 100.5 Ų | 100.5 | 44% | 0.438 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -72.8 | -35 | -173.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | D168 D170 R176 | D168-A172 PolarHBondContact OD1-N 2.9Å; D168-A172 PolarHBondContact OD2-N 2.9Å; D170-A172 HydrophobicContact CB-CB 4.35Å; D170-A172 PolarHBondContact O-N 3.04Å; A172-R176 VanDerWaalsContact O-CB 3.26Å; A172-R176 WeakPolarHBondContact O-CB 3.45Å; A172-R176 PolarHBondContact O-N 2.84Å |
| 173 | L | 76.7 | Confident | 73.9 | Confident | 110 Ų | 110 | 101.4 Ų | 101.4 | 58% | 0.576 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -69 | -42.3 | 174 | -64.9 | 172.9 | 0 | 0 | 0 | 110.7 | D168 R175 R176 L177 | D168-L173 HydrophobicContact CB-CB 4.37Å; D168-L173 HydrophobicContact CB-CD1 4.27Å; D168-L173 PolarHBondContact OD1-N 3.1Å; D168-L173 VanDerWaalsContact OD1-N 3.13Å; D168-L173 WeakPolarHBondContact OD2-CA 3.43Å; D168-L173 WeakPolarHBondContact OD2-CB 3.49Å; D168-L173 PolarHBondContact OD2-N 3.31Å; L173-R175 PolarHBondContact O-N 3.39Å; L173-R176 PolarHBondContact O-N 3.4Å; L173-L177 WeakPolarHBondContact O-CB 3.46Å; L173-L177 PolarHBondContact O-N 2.86Å |
| 174 | A | 76.1 | Confident | 74.1 | Confident | 54 Ų | 54 | 94.8 Ų | 94.8 | 45% | 0.446 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -59.7 | -45.7 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | D168 L177 L178 | D168-A174 PolarHBondContact OD2-N 3.49Å; A174-L177 PolarHBondContact O-N 3.13Å; A174-L178 WeakPolarHBondContact O-CG 3.41Å; A174-L178 PolarHBondContact O-N 3.25Å |
| 175 | R | 79.5 | Confident | 74.2 | Confident | 177 Ų | 177 | 98.2 Ų | 98.2 | 67% | 0.668 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -62.8 | -44.4 | 175.2 | -73.5 | 176.3 | -173.4 | 170.7 | 5.9 | 112.2 | G171 L173 L177 L178 T179 | G171-R175 WeakPolarHBondContact O-CG 3.46Å; G171-R175 PolarHBondContact O-N 3.06Å; L173-R175 PolarHBondContact O-N 3.39Å; R175-L177 VanDerWaalsContact C-N 3.33Å; R175-L177 PolarHBondContact O-N 3.44Å; R175-L178 WeakPolarHBondContact O-CB 3.5Å; R175-L178 PolarHBondContact O-N 2.87Å; R175-T179 PolarHBondContact O-N 3.46Å; R175-T179 PolarHBondContact O-OG1 2.93Å |
| 176 | R | 80.5 | Confident | 73.7 | Confident | 166 Ų | 166 | 95.8 Ų | 95.8 | 63% | 0.626 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -62.7 | -40.3 | 178.1 | -176.2 | 176.1 | -179.7 | 147.8 | 0.1 | 111.8 | A172 L173 T179 Q180 | A172-R176 VanDerWaalsContact O-CB 3.26Å; A172-R176 WeakPolarHBondContact O-CB 3.45Å; A172-R176 PolarHBondContact O-N 2.84Å; L173-R176 PolarHBondContact O-N 3.4Å; R176-T179 PolarHBondContact O-N 3.01Å; R176-Q180 HydrophobicContact CG-CG 4.47Å; R176-Q180 WeakPolarHBondContact O-CB 3.32Å; R176-Q180 VanDerWaalsContact O-CG 3.27Å; R176-Q180 WeakPolarHBondContact O-CG 3.47Å; R176-Q180 PolarHBondContact O-N 3.44Å |
| 177 | L | 80.3 | Confident | 73 | Confident | 102 Ų | 102 | 92.3 Ų | 92.3 | 53% | 0.534 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -64.2 | -44 | 176.2 | -157.8 | 101.3 | 0 | 0 | 0 | 110.8 | L173 A174 R175 Q180 L181 | L173-L177 WeakPolarHBondContact O-CB 3.46Å; L173-L177 PolarHBondContact O-N 2.86Å; A174-L177 PolarHBondContact O-N 3.13Å; R175-L177 VanDerWaalsContact C-N 3.33Å; R175-L177 PolarHBondContact O-N 3.44Å; L177-Q180 PolarHBondContact O-N 3.46Å; L177-L181 HydrophobicContact CD2-CD1 4.12Å; L177-L181 HydrophobicContact CG-CD1 4.44Å; L177-L181 WeakPolarHBondContact O-CB 3.32Å; L177-L181 VanDerWaalsContact O-CG 3.25Å; L177-L181 WeakPolarHBondContact O-CG 3.17Å; L177-L181 PolarHBondContact O-N 2.76Å |
| 178 | L | 81.4 | Confident | 71.9 | Confident | 102 Ų | 102 | 97.4 Ų | 97.4 | 53% | 0.534 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -59.1 | -47.1 | 173.9 | -76.5 | 168.5 | 0 | 0 | 0 | 111.7 | A174 R175 Q180 L181 E182 | A174-L178 WeakPolarHBondContact O-CG 3.41Å; A174-L178 PolarHBondContact O-N 3.25Å; R175-L178 WeakPolarHBondContact O-CB 3.5Å; R175-L178 PolarHBondContact O-N 2.87Å; L178-Q180 PolarHBondContact O-N 2.97Å; L178-L181 PolarHBondContact O-N 3.18Å; L178-E182 WeakPolarHBondContact O-CB 3.27Å; L178-E182 WeakPolarHBondContact O-CG 3.44Å; L178-E182 PolarHBondContact O-N 3.47Å |
| 179 | T | 83.1 | Confident | 70.6 | Confident | 86 Ų | 86 | 101.4 Ų | 101.4 | 53% | 0.528 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -64.1 | -37.8 | 177 | -52.2 | 0 | 0 | 0 | 0 | 112.4 | R175 R176 E182 A183 | R175-T179 PolarHBondContact O-N 3.46Å; R175-T179 PolarHBondContact O-OG1 2.93Å; R176-T179 PolarHBondContact O-N 3.01Å; T179-E182 PolarHBondContact O-N 2.94Å; T179-A183 WeakPolarHBondContact O-CB 3.48Å; T179-A183 PolarHBondContact O-N 2.88Å |
| 180 | Q | 78.8 | Confident | 69.3 | Low | 107 Ų | 107 | 101.1 Ų | 101.1 | 50% | 0.5 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -69.4 | -35.8 | 176.3 | -76.1 | 178.8 | -18.1 | 0 | 0 | 112.2 | R176 L177 L178 A183 A184 | R176-Q180 HydrophobicContact CG-CG 4.47Å; R176-Q180 WeakPolarHBondContact O-CB 3.32Å; R176-Q180 VanDerWaalsContact O-CG 3.27Å; R176-Q180 WeakPolarHBondContact O-CG 3.47Å; R176-Q180 PolarHBondContact O-N 3.44Å; L177-Q180 PolarHBondContact O-N 3.46Å; L178-Q180 PolarHBondContact O-N 2.97Å; Q180-A183 PolarHBondContact O-N 3.45Å; Q180-A184 VanDerWaalsContact O-CB 3.3Å; Q180-A184 WeakPolarHBondContact O-CB 3.42Å; Q180-A184 PolarHBondContact O-N 3.49Å |
| 181 | L | 75.5 | Confident | 67.5 | Low | 79 Ų | 79 | 99.7 Ų | 99.7 | 41% | 0.414 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -68.4 | -39.2 | 172.6 | -72.4 | 169.8 | 0 | 0 | 0 | 111.7 | L177 L178 A184 K185 V207 | L177-L181 HydrophobicContact CD2-CD1 4.12Å; L177-L181 HydrophobicContact CG-CD1 4.44Å; L177-L181 WeakPolarHBondContact O-CB 3.32Å; L177-L181 VanDerWaalsContact O-CG 3.25Å; L177-L181 WeakPolarHBondContact O-CG 3.17Å; L177-L181 PolarHBondContact O-N 2.76Å; L178-L181 PolarHBondContact O-N 3.18Å; L181-A184 PolarHBondContact O-N 3.33Å; L181-K185 WeakPolarHBondContact O-CB 3.39Å; L181-K185 PolarHBondContact O-N 3.39Å; L181-V207 HydrophobicContact CD2-CG1 3.75Å |
| 182 | E | 78.2 | Confident | 65.7 | Low | 132 Ų | 132 | 103.8 Ų | 103.8 | 62% | 0.617 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -64 | -42.2 | 173.1 | -75.4 | 173.9 | 173 | 0 | 0 | 111.8 | L178 T179 K185 G186 | L178-E182 WeakPolarHBondContact O-CB 3.27Å; L178-E182 WeakPolarHBondContact O-CG 3.44Å; L178-E182 PolarHBondContact O-N 3.47Å; T179-E182 PolarHBondContact O-N 2.94Å; E182-K185 WeakPolarHBondContact O-CB 3.31Å; E182-K185 PolarHBondContact O-N 2.87Å; E182-G186 PolarHBondContact O-N 3Å |
| 183 | A | 76.3 | Confident | 63.4 | Low | 67 Ų | 67 | 105 Ų | 105 | 55% | 0.554 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -65.2 | -41 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | T179 Q180 K185 G186 S187 | T179-A183 WeakPolarHBondContact O-CB 3.48Å; T179-A183 PolarHBondContact O-N 2.88Å; Q180-A183 PolarHBondContact O-N 3.45Å; A183-K185 VanDerWaalsContact C-N 3.32Å; A183-K185 PolarHBondContact O-N 3.34Å; A183-G186 PolarHBondContact O-N 3.12Å; A183-S187 PolarHBondContact O-N 3.39Å |
| 184 | A | 67.7 | Low | 61.2 | Low | 36 Ų | 36 | 108.2 Ų | 108.2 | 30% | 0.298 | 62% | 0.624 | S | S | . | * | H | α-helix | trans | -67.2 | -32.1 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | Q180 L181 R188 V207 | Q180-A184 VanDerWaalsContact O-CB 3.3Å; Q180-A184 WeakPolarHBondContact O-CB 3.42Å; Q180-A184 PolarHBondContact O-N 3.49Å; L181-A184 PolarHBondContact O-N 3.33Å; A184-R188 PolarHBondContact O-N 2.92Å; A184-V207 HydrophobicContact CB-CG2 3.85Å |
| 185 | K | 69 | Low | 59 | Low | 166 Ų | 166 | 108.8 Ų | 108.8 | 72% | 0.722 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -68.5 | -41.2 | 171.9 | -172.8 | 179.5 | 177.6 | -177.9 | 0 | 111.5 | L181 E182 A183 S187 R188 | L181-K185 WeakPolarHBondContact O-CB 3.39Å; L181-K185 PolarHBondContact O-N 3.39Å; E182-K185 WeakPolarHBondContact O-CB 3.31Å; E182-K185 PolarHBondContact O-N 2.87Å; A183-K185 VanDerWaalsContact C-N 3.32Å; A183-K185 PolarHBondContact O-N 3.34Å; K185-S187 VanDerWaalsContact C-N 3.31Å; K185-S187 PolarHBondContact O-N 2.88Å; K185-R188 PolarHBondContact O-N 2.69Å |
| 186 | G | 54.4 | Low | 56.7 | Low | 51 Ų | 51 | 110.1 Ų | 110.1 | 53% | 0.526 | 65% | 0.646 | S | S | . | * | H | α-helix | trans | -65.5 | -29.3 | 174.8 | 0 | 0 | 0 | 0 | 0 | 113.9 | E182 A183 R188 S189 | E182-G186 PolarHBondContact O-N 3Å; A183-G186 PolarHBondContact O-N 3.12Å; G186-R188 VanDerWaalsContact C-N 3.34Å; G186-S189 PolarHBondContact O-OG 3.36Å |
| 187 | S | 53.3 | Low | 54.7 | Low | 87 Ų | 87 | 108.3 Ų | 108.3 | 61% | 0.608 | 66% | 0.655 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.9 | -16.3 | 175.4 | -175.8 | 0 | 0 | 0 | 0 | 114 | A183 K185 | A183-S187 PolarHBondContact O-N 3.39Å; K185-S187 VanDerWaalsContact C-N 3.31Å; K185-S187 PolarHBondContact O-N 2.88Å |
| 188 | R | 47.4 | Very low | 52.4 | Low | 184 Ų | 184 | 108.7 Ų | 108.7 | 69% | 0.694 | 67% | 0.667 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.2 | -8.9 | -175.9 | -106.7 | 178.8 | 170.5 | 160.6 | -2.4 | 114.5 | A184 K185 G186 S190 | A184-R188 PolarHBondContact O-N 2.92Å; K185-R188 PolarHBondContact O-N 2.69Å; G186-R188 VanDerWaalsContact C-N 3.34Å; R188-S190 PolarHBondContact O-N 3.49Å |
| 189 | S | 37.6 | Very low | 50.5 | Low | 108 Ų | 108 | 108.8 Ų | 108.8 | 76% | 0.755 | 68% | 0.676 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.8 | 9.9 | 178.7 | 59.2 | 0 | 0 | 0 | 0 | 114.6 | G186 | G186-S189 PolarHBondContact O-OG 3.36Š|
| 190 | S | 38.4 | Very low | 48.4 | Very low | 101 Ų | 101 | 111 Ų | 111 | 71% | 0.706 | 69% | 0.689 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -124.9 | 14 | -176.3 | 57.8 | 0 | 0 | 0 | 0 | 116.2 | R188 | R188-S190 PolarHBondContact O-N 3.49Š|
| 191 | S | 34.1 | Very low | 46.8 | Very low | 100 Ų | 100 | 115.6 Ų | 115.6 | 70% | 0.699 | 71% | 0.708 | S | S | * | * | trans | -148.8 | 95.4 | 170.5 | 46.8 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 192 | A | 34.4 | Very low | 44.9 | Very low | 112 Ų | 112 | 115.2 Ų | 115.2 | 93% | 0.926 | 72% | 0.723 | S | S | * | * | trans | -83.8 | 118.8 | 155.2 | 0 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 193 | G | 29 | Very low | 43.3 | Very low | 77 Ų | 77 | 113.3 Ų | 113.3 | 79% | 0.794 | 72% | 0.722 | S | S | * | * | trans | -179 | 122.3 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 194 | D | 30.8 | Very low | 42.2 | Very low | 179 Ų | 179 | 118.9 Ų | 118.9 | 96% | 0.957 | 74% | 0.743 | S | S | * | * | trans | -65.8 | 160.2 | -167 | -167.1 | 18.1 | 0 | 0 | 0 | 116.8 | ||||
| 195 | G | 29.9 | Very low | 41.8 | Very low | 66 Ų | 66 | 120.7 Ų | 120.7 | 68% | 0.68 | 77% | 0.765 | S | S | * | * | trans | 134.2 | 91 | 157.3 | 0 | 0 | 0 | 0 | 0 | 121 | ||||
| 196 | K | 31.2 | Very low | 41.5 | Very low | 204 Ų | 204 | 116.5 Ų | 116.5 | 89% | 0.887 | 75% | 0.753 | S | S | * | * | trans | 44.2 | 136.3 | 141.5 | -137.9 | 168 | -171.5 | 178.1 | 0 | 122.8 | ||||
| 197 | P | 38.6 | Very low | 42.3 | Very low | 128 Ų | 128 | 117.6 Ų | 117.6 | 83% | 0.831 | 75% | 0.749 | S | S | * | * | trans | -88.8 | 133.1 | -173.4 | 35.4 | -32.3 | 0 | 0 | 0 | 113.3 | ||||
| 198 | S | 30.3 | Very low | 43.4 | Very low | 110 Ų | 110 | 119.7 Ų | 119.7 | 77% | 0.769 | 75% | 0.753 | S | S | * | * | trans | -122.1 | 121.5 | 163.4 | 163 | 0 | 0 | 0 | 0 | 107.9 | T200 | S198-T200 PolarHBondContact O-N 2.74Š| ||
| 199 | S | 43.5 | Very low | 44.7 | Very low | 105 Ų | 105 | 119.7 Ų | 119.7 | 73% | 0.734 | 75% | 0.754 | S | S | * | * | trans | -62.1 | 122.9 | 171.6 | 52.8 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 200 | T | 38.4 | Very low | 46.7 | Very low | 131 Ų | 131 | 121.3 Ų | 121.3 | 80% | 0.804 | 75% | 0.75 | S | S | * | * | S | Bend | trans | 161.1 | 129 | 135.2 | 34.3 | 0 | 0 | 0 | 0 | 110 | S198 | S198-T200 PolarHBondContact O-N 2.74Š|
| 201 | K | 44.8 | Very low | 48.3 | Very low | 204 Ų | 204 | 122 Ų | 122 | 89% | 0.887 | 75% | 0.745 | S | S | * | * | trans | 55.3 | 103.9 | 171.1 | -63.9 | -174.4 | 178.2 | -178.5 | 0 | 115.5 | ||||
| 202 | G | 35 | Very low | 50.2 | Low | 72 Ų | 72 | 125.5 Ų | 125.5 | 74% | 0.742 | 75% | 0.75 | S | S | * | * | trans | -57.6 | 132.4 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 203 | P | 44.5 | Very low | 52.3 | Low | 91 Ų | 91 | 122.8 Ų | 122.8 | 59% | 0.591 | 72% | 0.724 | S | S | * | * | trans | -73.6 | 150.6 | 179.2 | 27.2 | -26.2 | 0 | 0 | 0 | 111 | G205 V206 | P203-G205 PolarHBondContact O-N 3.17Å; P203-V206 HydrophobicContact CG-CG2 3.71Å; P203-V206 PolarHBondContact O-N 2.93Å; P203-V206 VanDerWaalsContact O-N 3.17Å | ||
| 204 | D | 53.5 | Low | 54.6 | Low | 185 Ų | 185 | 128.8 Ų | 128.8 | 99% | 0.989 | 72% | 0.723 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.2 | 108.5 | 174.7 | -141 | -0.1 | 0 | 0 | 0 | 108.8 | ||
| 205 | G | 59.9 | Low | 57.1 | Low | 74 Ų | 74 | 123.6 Ų | 123.6 | 76% | 0.763 | 70% | 0.699 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 120.4 | -2.6 | -176.6 | 0 | 0 | 0 | 0 | 0 | 117 | P203 | P203-G205 PolarHBondContact O-N 3.17Š|
| 206 | V | 63.5 | Low | 59.6 | Low | 77 Ų | 77 | 128.5 Ų | 128.5 | 47% | 0.467 | 71% | 0.705 | S | S | . | * | trans | -93.8 | 114 | 173.3 | -179.6 | 0 | 0 | 0 | 0 | 110.6 | P203 L208 | P203-V206 HydrophobicContact CG-CG2 3.71Å; P203-V206 PolarHBondContact O-N 2.93Å; P203-V206 VanDerWaalsContact O-N 3.17Å; V206-L208 PolarHBondContact O-N 3.36Å | ||
| 207 | V | 70.8 | Confident | 62.2 | Low | 75 Ų | 75 | 123.2 Ų | 123.2 | 46% | 0.455 | 68% | 0.683 | S | S | . | * | trans | -69.3 | 96.9 | 169.3 | -177.7 | 0 | 0 | 0 | 0 | 108.3 | L181 A184 | L181-V207 HydrophobicContact CD2-CG1 3.75Å; A184-V207 HydrophobicContact CB-CG2 3.85Å | ||
| 208 | L | 75.7 | Confident | 64.3 | Low | 131 Ų | 131 | 122.8 Ų | 122.8 | 69% | 0.686 | 67% | 0.67 | S | S | * | * | trans | -94.5 | 108.3 | 170.4 | -170.2 | 73.8 | 0 | 0 | 0 | 108.2 | V206 E210 | V206-L208 PolarHBondContact O-N 3.36Å; L208-E210 HydrophobicContact CD2-CG 4.23Å; L208-E210 HydrophobicContact CG-CG 4.23Å | ||
| 209 | Y | 75.1 | Confident | 67.1 | Low | 184 Ų | 184 | 124.5 Ų | 124.5 | 72% | 0.722 | 66% | 0.663 | S | S | * | * | trans | -100.7 | 101.3 | 173.4 | -168.3 | -104.9 | 0 | 0 | 0 | 108.7 | L211 | Y209-L211 HydrophobicContact CD1-CB 4Å; Y209-L211 HydrophobicContact CE1-CB 3.69Å; Y209-L211 HydrophobicContact CE1-CD1 3.96Å; Y209-L211 HydrophobicContact CE1-CD2 4.38Å; Y209-L211 HydrophobicContact CE1-CG 4.2Å; Y209-L211 PolarHBondContact O-N 3.02Å | ||
| 210 | E | 80.5 | Confident | 69.3 | Low | 142 Ų | 142 | 125.9 Ų | 125.9 | 66% | 0.664 | 66% | 0.656 | S | S | * | * | trans | -90.4 | 96.1 | 172.3 | -76 | -177.1 | 166.2 | 0 | 0 | 109.2 | L208 H212 | L208-E210 HydrophobicContact CD2-CG 4.23Å; L208-E210 HydrophobicContact CG-CG 4.23Å; E210-H212 PolarHBondContact O-N 2.83Å | ||
| 211 | L | 71.9 | Confident | 71.7 | Confident | 116 Ų | 116 | 123.2 Ų | 123.2 | 61% | 0.607 | 64% | 0.637 | S | S | * | * | trans | -85.4 | 103.4 | 174.8 | -175.3 | 61.9 | 0 | 0 | 0 | 109.9 | Y209 S213 | Y209-L211 HydrophobicContact CD1-CB 4Å; Y209-L211 HydrophobicContact CE1-CB 3.69Å; Y209-L211 HydrophobicContact CE1-CD1 3.96Å; Y209-L211 HydrophobicContact CE1-CD2 4.38Å; Y209-L211 HydrophobicContact CE1-CG 4.2Å; Y209-L211 PolarHBondContact O-N 3.02Å; L211-S213 PolarHBondContact O-N 3.4Å | ||
| 212 | H | 73.5 | Confident | 73.9 | Confident | 172 Ų | 172 | 120 Ų | 120 | 80% | 0.796 | 63% | 0.625 | S | S | * | * | trans | -92.2 | 79.3 | 169.5 | -68.1 | -163 | 0 | 0 | 0 | 108.7 | E210 | E210-H212 PolarHBondContact O-N 2.83Š| ||
| 213 | S | 77.6 | Confident | 76.5 | Confident | 55 Ų | 55 | 120.2 Ų | 120.2 | 39% | 0.385 | 62% | 0.615 | S | S | . | * | trans | -118.9 | 141.2 | 171.1 | 177.2 | 0 | 0 | 0 | 0 | 110 | L211 P215 | L211-S213 PolarHBondContact O-N 3.4Å; S213-P215 WeakPolarHBondContact O-CD 3.4Å | ||
| 214 | R | 78.3 | Confident | 78.7 | Confident | 203 Ų | 203 | 118 Ų | 118 | 77% | 0.766 | 61% | 0.605 | S | S | * | * | trans | -109.2 | 76.7 | 170.1 | -67.9 | -171.2 | -176.4 | 176.6 | 2 | 108.8 | E216 Q217 E218 | R214-E216 PolarHBondContact O-N 3.48Å; R214-Q217 HydrophobicContact CB-CB 4.1Å; R214-Q217 PolarHBondContact O-N 3.2Å; R214-E218 PolarHBondContact O-N 3.13Å | ||
| 215 | P | 82.7 | Confident | 80.6 | Confident | 71 Ų | 71 | 115.9 Ų | 115.9 | 46% | 0.461 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -62.2 | -26.8 | -175.3 | 25.7 | -35.7 | 0 | 0 | 0 | 112.7 | S213 Q217 E218 K219 | S213-P215 WeakPolarHBondContact O-CD 3.4Å; P215-Q217 VanDerWaalsContact C-N 3.35Å; P215-E218 PolarHBondContact O-N 3.19Å; P215-K219 WeakPolarHBondContact O-CB 3.36Å; P215-K219 WeakPolarHBondContact O-CG 3.25Å; P215-K219 PolarHBondContact O-N 3.43Å |
| 216 | E | 81.8 | Confident | 82.2 | Confident | 169 Ų | 169 | 118.9 Ų | 118.9 | 79% | 0.79 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -66.3 | -35.5 | 175 | -67.3 | -172.1 | 163.7 | 0 | 0 | 112.6 | R214 F220 | R214-E216 PolarHBondContact O-N 3.48Å; E216-F220 WeakPolarHBondContact O-CB 3.48Å; E216-F220 PolarHBondContact O-N 2.93Å |
| 217 | Q | 86.4 | Confident | 83.5 | Confident | 93 Ų | 93 | 117.4 Ų | 117.4 | 44% | 0.435 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -71.1 | -38.3 | 178.4 | -173.3 | 64.1 | 49.9 | 0 | 0 | 111.4 | R214 P215 F220 N221 | R214-Q217 HydrophobicContact CB-CB 4.1Å; R214-Q217 PolarHBondContact O-N 3.2Å; P215-Q217 VanDerWaalsContact C-N 3.35Å; Q217-F220 PolarHBondContact O-N 3.39Å; Q217-N221 PolarHBondContact NE2-OD1 3.07Å; Q217-N221 WeakPolarHBondContact O-CB 3.49Å; Q217-N221 PolarHBondContact O-N 2.91Å; Q217-N221 PolarHBondContact O-ND2 3.4Å; Q217-N221 PolarHBondContact O-OD1 2.83Å |
| 218 | E | 83.5 | Confident | 84.6 | Confident | 119 Ų | 119 | 120.5 Ų | 120.5 | 56% | 0.556 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -67 | -47.1 | 176.9 | -71.5 | 178.1 | 171.4 | 0 | 0 | 111.1 | R214 P215 F220 N221 E222 | R214-E218 PolarHBondContact O-N 3.13Å; P215-E218 PolarHBondContact O-N 3.19Å; E218-F220 VanDerWaalsContact C-N 3.3Å; E218-F220 PolarHBondContact O-N 3.45Å; E218-N221 PolarHBondContact O-N 3.45Å; E218-N221 VanDerWaalsContact O-N 3.13Å; E218-E222 PolarHBondContact O-N 3.23Å |
| 219 | K | 89.3 | Confident | 85.4 | Confident | 146 Ų | 146 | 120 Ų | 120 | 64% | 0.635 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -59.3 | -41.1 | 173.4 | -72.6 | 179.1 | 179.8 | -174.5 | 0 | 112.3 | P215 E222 S223 | P215-K219 WeakPolarHBondContact O-CB 3.36Å; P215-K219 WeakPolarHBondContact O-CG 3.25Å; P215-K219 PolarHBondContact O-N 3.43Å; K219-E222 PolarHBondContact O-N 2.93Å; K219-S223 VanDerWaalsContact O-CB 3.31Å; K219-S223 WeakPolarHBondContact O-CB 3.36Å; K219-S223 PolarHBondContact O-N 3.02Å |
| 220 | F | 89.3 | Confident | 86.3 | Confident | 133 Ų | 133 | 117.6 Ų | 117.6 | 58% | 0.583 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -62.3 | -44.3 | 174.9 | 178.3 | -95.4 | 0 | 0 | 0 | 111.5 | E216 Q217 E218 E222 S223 A224 | E216-F220 WeakPolarHBondContact O-CB 3.48Å; E216-F220 PolarHBondContact O-N 2.93Å; Q217-F220 PolarHBondContact O-N 3.39Å; E218-F220 VanDerWaalsContact C-N 3.3Å; E218-F220 PolarHBondContact O-N 3.45Å; F220-E222 PolarHBondContact O-N 2.9Å; F220-S223 PolarHBondContact O-N 3.42Å; F220-A224 VanDerWaalsContact O-CB 3.25Å; F220-A224 WeakPolarHBondContact O-CB 3.25Å; F220-A224 PolarHBondContact O-N 3.5Å |
| 221 | N | 89.1 | Confident | 86.9 | Confident | 75 Ų | 75 | 117.4 Ų | 117.4 | 40% | 0.401 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -64.8 | -37.8 | 178.1 | -70 | -14.3 | 0 | 0 | 0 | 112.3 | Q217 E218 K225 | Q217-N221 PolarHBondContact NE2-OD1 3.07Å; Q217-N221 WeakPolarHBondContact O-CB 3.49Å; Q217-N221 PolarHBondContact O-N 2.91Å; Q217-N221 PolarHBondContact O-ND2 3.4Å; Q217-N221 PolarHBondContact O-OD1 2.83Å; E218-N221 PolarHBondContact O-N 3.45Å; E218-N221 VanDerWaalsContact O-N 3.13Å; N221-K225 WeakPolarHBondContact O-CG 3.39Å; N221-K225 PolarHBondContact O-N 2.98Å |
| 222 | E | 89.9 | Confident | 88 | Confident | 137 Ų | 137 | 119.8 Ų | 119.8 | 64% | 0.64 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -67.3 | -47.3 | 174.2 | -72.8 | -178.9 | 168.3 | 0 | 0 | 111.9 | E218 K219 F220 A224 K225 M226 | E218-E222 PolarHBondContact O-N 3.23Å; K219-E222 PolarHBondContact O-N 2.93Å; F220-E222 PolarHBondContact O-N 2.9Å; E222-A224 VanDerWaalsContact C-N 3.31Å; E222-A224 PolarHBondContact O-N 2.77Å; E222-K225 PolarHBondContact O-N 3.49Å; E222-M226 PolarHBondContact O-N 2.83Å |
| 223 | S | 90.3 | Very high | 88.8 | Confident | 76 Ų | 76 | 117 Ų | 117 | 53% | 0.531 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -61.5 | -39.2 | 176.7 | 178.4 | 0 | 0 | 0 | 0 | 112 | K219 F220 M226 A227 | K219-S223 VanDerWaalsContact O-CB 3.31Å; K219-S223 WeakPolarHBondContact O-CB 3.36Å; K219-S223 PolarHBondContact O-N 3.02Å; F220-S223 PolarHBondContact O-N 3.42Å; S223-M226 PolarHBondContact O-N 2.92Å; S223-A227 WeakPolarHBondContact O-CB 3.37Å; S223-A227 PolarHBondContact O-N 2.96Å |
| 224 | A | 91.3 | Very high | 89.4 | Confident | 45 Ų | 45 | 116.3 Ų | 116.3 | 37% | 0.372 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -62.3 | -43 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | F220 E222 A227 E228 | F220-A224 VanDerWaalsContact O-CB 3.25Å; F220-A224 WeakPolarHBondContact O-CB 3.25Å; F220-A224 PolarHBondContact O-N 3.5Å; E222-A224 VanDerWaalsContact C-N 3.31Å; E222-A224 PolarHBondContact O-N 2.77Å; A224-A227 PolarHBondContact O-N 3.3Å; A224-E228 PolarHBondContact O-N 3.37Å |
| 225 | K | 93.5 | Very high | 89.9 | Confident | 140 Ų | 140 | 112 Ų | 112 | 61% | 0.609 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -64 | -41 | 174.5 | -71.7 | 173.2 | -176.7 | 177.2 | 0 | 111.9 | N221 E222 E228 L229 | N221-K225 WeakPolarHBondContact O-CG 3.39Å; N221-K225 PolarHBondContact O-N 2.98Å; E222-K225 PolarHBondContact O-N 3.49Å; K225-E228 PolarHBondContact O-N 3.34Å; K225-L229 WeakPolarHBondContact O-CG 3.2Å; K225-L229 PolarHBondContact O-N 2.94Å; K225-L229 VanDerWaalsContact O-N 3.07Å |
| 226 | M | 92.5 | Very high | 90.2 | Very high | 138 Ų | 138 | 113.2 Ų | 113.2 | 68% | 0.68 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -63.1 | -43.8 | 176.4 | -174.2 | 176.3 | -77.7 | 0 | 0 | 111.4 | E222 S223 E228 L229 E230 | E222-M226 PolarHBondContact O-N 2.83Å; S223-M226 PolarHBondContact O-N 2.92Å; M226-E228 VanDerWaalsContact C-N 3.34Å; M226-E228 PolarHBondContact O-N 2.88Å; M226-L229 PolarHBondContact O-N 3.48Å; M226-E230 WeakPolarHBondContact O-CB 3.39Å; M226-E230 PolarHBondContact O-N 3.4Å |
| 227 | A | 90.9 | Very high | 90.4 | Very high | 46 Ų | 46 | 111.5 Ų | 111.5 | 38% | 0.38 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -65.4 | -34.1 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | S223 A224 K231 | S223-A227 WeakPolarHBondContact O-CB 3.37Å; S223-A227 PolarHBondContact O-N 2.96Å; A224-A227 PolarHBondContact O-N 3.3Å; A227-K231 WeakPolarHBondContact O-CB 3.47Å; A227-K231 PolarHBondContact O-N 3.4Å |
| 228 | E | 93.1 | Very high | 90.4 | Very high | 139 Ų | 139 | 113.7 Ų | 113.7 | 65% | 0.65 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -64.9 | -45 | 173 | -173.1 | -174.9 | 173.2 | 0 | 0 | 111.5 | A224 K225 M226 K231 R232 | A224-E228 PolarHBondContact O-N 3.37Å; K225-E228 PolarHBondContact O-N 3.34Å; M226-E228 VanDerWaalsContact C-N 3.34Å; M226-E228 PolarHBondContact O-N 2.88Å; E228-K231 PolarHBondContact O-N 2.79Å; E228-R232 WeakPolarHBondContact O-CB 3.4Å; E228-R232 PolarHBondContact O-N 2.94Å |
| 229 | L | 93.8 | Very high | 90.4 | Very high | 120 Ų | 120 | 112 Ų | 112 | 63% | 0.628 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -63.7 | -42.2 | 175.9 | -72.4 | 174.6 | 0 | 0 | 0 | 111.7 | K225 M226 R232 L233 | K225-L229 WeakPolarHBondContact O-CG 3.2Å; K225-L229 PolarHBondContact O-N 2.94Å; K225-L229 VanDerWaalsContact O-N 3.07Å; M226-L229 PolarHBondContact O-N 3.48Å; L229-R232 PolarHBondContact O-N 2.93Å; L229-L233 VanDerWaalsContact O-CB 3.31Å; L229-L233 WeakPolarHBondContact O-CB 3.48Å; L229-L233 PolarHBondContact O-N 3.4Å |
| 230 | E | 93.3 | Very high | 90 | Very high | 135 Ų | 135 | 109.3 Ų | 109.3 | 63% | 0.631 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -61.2 | -46.8 | 175.1 | -175.5 | -177.3 | -174.4 | 0 | 0 | 111.3 | M226 R232 L233 A234 | M226-E230 WeakPolarHBondContact O-CB 3.39Å; M226-E230 PolarHBondContact O-N 3.4Å; E230-R232 VanDerWaalsContact C-N 3.33Å; E230-R232 PolarHBondContact O-N 3.11Å; E230-L233 PolarHBondContact O-N 3.46Å; E230-A234 WeakPolarHBondContact O-CB 3.41Å; E230-A234 PolarHBondContact O-N 3.25Å |
| 231 | K | 93 | Very high | 89.2 | Confident | 137 Ų | 137 | 104.8 Ų | 104.8 | 60% | 0.596 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -59.1 | -43.7 | 175.8 | -179 | -178.4 | 177.7 | -177.7 | 0 | 111.8 | A227 E228 A234 Q235 | A227-K231 WeakPolarHBondContact O-CB 3.47Å; A227-K231 PolarHBondContact O-N 3.4Å; E228-K231 PolarHBondContact O-N 2.79Å; K231-A234 PolarHBondContact O-N 3.48Å; K231-Q235 WeakPolarHBondContact O-CG 3.48Å; K231-Q235 PolarHBondContact O-N 2.99Å |
| 232 | R | 94.6 | Very high | 87.9 | Confident | 167 Ų | 167 | 105.5 Ų | 105.5 | 63% | 0.63 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -67.1 | -39.3 | 177.7 | -175.7 | 177.6 | 173.9 | -179.9 | -2.2 | 111.5 | E228 L229 E230 Q235 L236 | E228-R232 WeakPolarHBondContact O-CB 3.4Å; E228-R232 PolarHBondContact O-N 2.94Å; L229-R232 PolarHBondContact O-N 2.93Å; E230-R232 VanDerWaalsContact C-N 3.33Å; E230-R232 PolarHBondContact O-N 3.11Å; R232-Q235 PolarHBondContact O-N 3.08Å; R232-L236 WeakPolarHBondContact O-CG 3.41Å; R232-L236 PolarHBondContact O-N 3.41Å |
| 233 | L | 91.6 | Very high | 86.3 | Confident | 113 Ų | 113 | 101.4 Ų | 101.4 | 59% | 0.592 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -64.5 | -44.1 | 175.7 | -173.9 | 66.2 | 0 | 0 | 0 | 110.9 | L229 E230 Q235 L236 E237 | L229-L233 VanDerWaalsContact O-CB 3.31Å; L229-L233 WeakPolarHBondContact O-CB 3.48Å; L229-L233 PolarHBondContact O-N 3.4Å; E230-L233 PolarHBondContact O-N 3.46Å; L233-Q235 VanDerWaalsContact C-N 3.32Å; L233-Q235 PolarHBondContact O-N 3.4Å; L233-L236 CarbonylContact O-C 3.59Å; L233-L236 WeakPolarHBondContact O-CB 3.46Å; L233-L236 PolarHBondContact O-N 2.98Å; L233-L236 VanDerWaalsContact O-N 3.12Å; L233-E237 WeakPolarHBondContact O-CB 3.37Å; L233-E237 PolarHBondContact O-N 3.01Å |
| 234 | A | 88.5 | Confident | 84.6 | Confident | 40 Ų | 40 | 103.5 Ų | 103.5 | 33% | 0.331 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -62 | -38 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112 | E230 K231 E237 I238 | E230-A234 WeakPolarHBondContact O-CB 3.41Å; E230-A234 PolarHBondContact O-N 3.25Å; K231-A234 PolarHBondContact O-N 3.48Å; A234-E237 PolarHBondContact O-N 3.02Å; A234-I238 WeakPolarHBondContact O-CD1 3.08Å; A234-I238 VanDerWaalsContact O-CG1 3.23Å; A234-I238 WeakPolarHBondContact O-CG1 3.37Å; A234-I238 PolarHBondContact O-N 3.35Å |
| 235 | Q | 90.3 | Very high | 82.6 | Confident | 114 Ų | 114 | 108.1 Ų | 108.1 | 53% | 0.533 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -64.7 | -40 | 172.9 | -74.4 | 175.5 | -6 | 0 | 0 | 112.3 | K231 R232 L233 E237 I238 A239 | K231-Q235 WeakPolarHBondContact O-CG 3.48Å; K231-Q235 PolarHBondContact O-N 2.99Å; R232-Q235 PolarHBondContact O-N 3.08Å; L233-Q235 VanDerWaalsContact C-N 3.32Å; L233-Q235 PolarHBondContact O-N 3.4Å; Q235-E237 VanDerWaalsContact C-N 3.35Å; Q235-I238 PolarHBondContact O-N 3.19Å; Q235-A239 WeakPolarHBondContact O-CB 3.37Å; Q235-A239 PolarHBondContact O-N 2.78Å |
| 236 | L | 88.4 | Confident | 80.9 | Confident | 95 Ų | 95 | 110 Ų | 110 | 50% | 0.497 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -67 | -38.1 | 174.1 | -72.6 | 171 | 0 | 0 | 0 | 111.6 | R232 L233 A239 V240 | R232-L236 WeakPolarHBondContact O-CG 3.41Å; R232-L236 PolarHBondContact O-N 3.41Å; L233-L236 CarbonylContact O-C 3.59Å; L233-L236 WeakPolarHBondContact O-CB 3.46Å; L233-L236 PolarHBondContact O-N 2.98Å; L233-L236 VanDerWaalsContact O-N 3.12Å; L236-A239 PolarHBondContact O-N 2.98Å; L236-V240 WeakPolarHBondContact O-CB 3.43Å; L236-V240 WeakPolarHBondContact O-CG2 3.39Å; L236-V240 PolarHBondContact O-N 2.85Å |
| 237 | E | 86.3 | Confident | 79.2 | Confident | 133 Ų | 133 | 108.3 Ų | 108.3 | 62% | 0.621 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -66.8 | -37 | 174.7 | -173.2 | 174.2 | -169.3 | 0 | 0 | 111.6 | L233 A234 Q235 A239 G241 | L233-E237 WeakPolarHBondContact O-CB 3.37Å; L233-E237 PolarHBondContact O-N 3.01Å; A234-E237 PolarHBondContact O-N 3.02Å; Q235-E237 VanDerWaalsContact C-N 3.35Å; E237-A239 VanDerWaalsContact C-N 3.34Å; E237-G241 WeakPolarHBondContact O-CA 3.42Å; E237-G241 PolarHBondContact O-N 3.37Å |
| 238 | I | 86.5 | Confident | 77.5 | Confident | 140 Ų | 140 | 107.8 Ų | 107.8 | 72% | 0.718 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -67.9 | -36.9 | 172.8 | -68.7 | 161.9 | 0 | 0 | 0 | 111.1 | A234 Q235 | A234-I238 WeakPolarHBondContact O-CD1 3.08Å; A234-I238 VanDerWaalsContact O-CG1 3.23Å; A234-I238 WeakPolarHBondContact O-CG1 3.37Å; A234-I238 PolarHBondContact O-N 3.35Å; Q235-I238 PolarHBondContact O-N 3.19Å |
| 239 | A | 84.2 | Confident | 75.8 | Confident | 83 Ų | 83 | 107.3 Ų | 107.3 | 69% | 0.686 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -76 | -36.9 | -177.7 | 0 | 0 | 0 | 0 | 0 | 113.5 | Q235 L236 E237 | Q235-A239 WeakPolarHBondContact O-CB 3.37Å; Q235-A239 PolarHBondContact O-N 2.78Å; L236-A239 PolarHBondContact O-N 2.98Å; E237-A239 VanDerWaalsContact C-N 3.34Å |
| 240 | V | 80.6 | Confident | 73.9 | Confident | 89 Ų | 89 | 109.3 Ų | 109.3 | 54% | 0.539 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -104.2 | -31.2 | -175.8 | -179 | 0 | 0 | 0 | 0 | 111.9 | L236 S242 | L236-V240 WeakPolarHBondContact O-CB 3.43Å; L236-V240 WeakPolarHBondContact O-CG2 3.39Å; L236-V240 PolarHBondContact O-N 2.85Å; V240-S242 PolarHBondContact O-N 3.42Å; V240-S242 VanDerWaalsContact O-N 3.14Å |
| 241 | G | 71.1 | Confident | 72.2 | Confident | 38 Ų | 38 | 106.2 Ų | 106.2 | 39% | 0.392 | 60% | 0.599 | S | S | . | * | trans | -62.2 | 117.9 | 178.6 | 0 | 0 | 0 | 0 | 0 | 109.4 | E237 G243 | E237-G241 WeakPolarHBondContact O-CA 3.42Å; E237-G241 PolarHBondContact O-N 3.37Å; G241-G243 PolarHBondContact O-N 3.39Å | ||
| 242 | S | 62.4 | Low | 70.6 | Confident | 90 Ų | 90 | 102.6 Ų | 102.6 | 63% | 0.629 | 60% | 0.595 | S | S | * | * | trans | -64.9 | 106.6 | 160.2 | -54.3 | 0 | 0 | 0 | 0 | 105.1 | V240 | V240-S242 PolarHBondContact O-N 3.42Å; V240-S242 VanDerWaalsContact O-N 3.14Å | ||
| 243 | G | 56 | Low | 68.8 | Low | 52 Ų | 52 | 97.4 Ų | 97.4 | 54% | 0.536 | 59% | 0.593 | S | S | . | * | trans | -46.4 | 153.2 | 166.5 | 0 | 0 | 0 | 0 | 0 | 109 | G241 D245 | G241-G243 PolarHBondContact O-N 3.39Å; G243-D245 PolarHBondContact O-N 2.87Å | ||
| 244 | S | 54.2 | Low | 67.3 | Low | 119 Ų | 119 | 94 Ų | 94 | 83% | 0.832 | 58% | 0.577 | S | S | * | * | S | Bend | trans | -60.7 | 6 | -175 | 78.3 | 0 | 0 | 0 | 0 | 114.9 | K246 | S244-K246 PolarHBondContact O-N 2.98Š|
| 245 | D | 50.3 | Low | 65.9 | Low | 143 Ų | 143 | 98.5 Ų | 98.5 | 77% | 0.765 | 59% | 0.591 | S | S | * | * | S | Bend | trans | -64.1 | 88.3 | 162.9 | -72.7 | -25.6 | 0 | 0 | 0 | 109.1 | G243 Q247 | G243-D245 PolarHBondContact O-N 2.87Å; D245-Q247 PolarHBondContact O-N 3.26Å; D245-Q247 VanDerWaalsContact O-N 3.1Å |
| 246 | K | 57.9 | Low | 64.4 | Low | 178 Ų | 178 | 94.5 Ų | 94.5 | 77% | 0.774 | 58% | 0.581 | S | S | * | * | trans | -44.3 | 119.1 | 170.9 | -62.6 | -179.2 | -178.7 | -178.3 | 0 | 108.6 | S244 G248 | S244-K246 PolarHBondContact O-N 2.98Å; K246-G248 PolarHBondContact O-N 3.07Å | ||
| 247 | Q | 55.4 | Low | 63.3 | Low | 103 Ų | 103 | 95.3 Ų | 95.3 | 48% | 0.481 | 60% | 0.601 | S | S | . | * | trans | -47.6 | 129.7 | 178.4 | -64.5 | -71.8 | -32.5 | 0 | 0 | 109.9 | D245 N251 | D245-Q247 PolarHBondContact O-N 3.26Å; D245-Q247 VanDerWaalsContact O-N 3.1Å; Q247-N251 HydrophobicContact CB-CB 3.95Å; Q247-N251 PolarHBondContact OE1-ND2 3.35Å | ||
| 248 | G | 55.9 | Low | 62.6 | Low | 36 Ų | 36 | 91.2 Ų | 91.2 | 37% | 0.371 | 59% | 0.587 | S | S | . | * | trans | -58.5 | 162.3 | -175.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | K246 L250 N251 | K246-G248 PolarHBondContact O-N 3.07Å; G248-L250 PolarHBondContact O-N 3.24Å; G248-N251 PolarHBondContact O-N 2.93Å | ||
| 249 | P | 57.5 | Low | 62.2 | Low | 128 Ų | 128 | 89.4 Ų | 89.4 | 83% | 0.831 | 58% | 0.578 | S | S | * | * | G | 310 helix | trans | -54.9 | -22.5 | -175 | -24.7 | 32.1 | 0 | 0 | 0 | 114.9 | N251 A252 | P249-N251 VanDerWaalsContact C-N 3.33Å; P249-A252 WeakPolarHBondContact O-CB 3.31Å |
| 250 | L | 53.5 | Low | 62 | Low | 162 Ų | 162 | 91.1 Ų | 91.1 | 85% | 0.848 | 57% | 0.574 | S | S | * | * | G | 310 helix | trans | -75.8 | -18.7 | 178.1 | -59.7 | 177.7 | 0 | 0 | 0 | 113.6 | G248 | G248-L250 PolarHBondContact O-N 3.24Š|
| 251 | N | 58.3 | Low | 62 | Low | 70 Ų | 70 | 90 Ų | 90 | 37% | 0.374 | 57% | 0.565 | S | S | . | * | G | 310 helix | trans | -90.8 | -4.8 | 179.5 | -70.4 | -5.7 | 0 | 0 | 0 | 112.6 | Q247 G248 P249 G253 V254 Q255 | Q247-N251 HydrophobicContact CB-CB 3.95Å; Q247-N251 PolarHBondContact OE1-ND2 3.35Å; G248-N251 PolarHBondContact O-N 2.93Å; P249-N251 VanDerWaalsContact C-N 3.33Å; N251-G253 PolarHBondContact O-N 3.34Å; N251-V254 PolarHBondContact O-N 3.49Å; N251-Q255 WeakPolarHBondContact O-CG 3.48Å |
| 252 | A | 59.8 | Low | 62.4 | Low | 62 Ų | 62 | 89.7 Ų | 89.7 | 51% | 0.512 | 56% | 0.555 | S | S | . | * | G | 310 helix | trans | -58.1 | -32.1 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | P249 V254 | P249-A252 WeakPolarHBondContact O-CB 3.31Å; A252-V254 VanDerWaalsContact C-N 3.28Å; A252-V254 PolarHBondContact O-N 2.85Å |
| 253 | G | 56.8 | Low | 63.4 | Low | 58 Ų | 58 | 89.1 Ų | 89.1 | 60% | 0.598 | 54% | 0.544 | S | S | * | . | G | 310 helix | trans | -79.1 | -3.1 | 177.9 | 0 | 0 | 0 | 0 | 0 | 115.4 | N251 | N251-G253 PolarHBondContact O-N 3.34Š|
| 254 | V | 59.4 | Low | 64.8 | Low | 41 Ų | 41 | 92.2 Ų | 92.2 | 25% | 0.248 | 55% | 0.545 | C | S | . | . | G | 310 helix | trans | -113.2 | 0.6 | -177.8 | -176.4 | 0 | 0 | 0 | 0 | 111.5 | N251 A252 G256 T262 L266 | N251-V254 PolarHBondContact O-N 3.49Å; A252-V254 VanDerWaalsContact C-N 3.28Å; A252-V254 PolarHBondContact O-N 2.85Å; V254-G256 PolarHBondContact O-N 3.35Å; V254-T262 VanDerWaalsContact O-CB 3.32Å; V254-T262 WeakPolarHBondContact O-CB 3.38Å; V254-T262 WeakPolarHBondContact O-CG2 3.42Å; V254-L266 HydrophobicContact CG1-CD1 3.88Å; V254-L266 HydrophobicContact CG1-CD2 3.92Å; V254-L266 HydrophobicContact CG1-CG 3.62Å; V254-L266 HydrophobicContact CG2-CD2 4.3Å |
| 255 | Q | 58.8 | Low | 66.1 | Low | 134 Ų | 134 | 89.4 Ų | 89.4 | 63% | 0.626 | 52% | 0.52 | S | S | * | . | trans | -75.6 | 98 | -177.1 | -64.7 | -176.7 | 6.2 | 0 | 0 | 111.4 | N251 | N251-Q255 WeakPolarHBondContact O-CG 3.48Š| ||
| 256 | G | 59.2 | Low | 67.6 | Low | 31 Ų | 31 | 86.5 Ų | 86.5 | 32% | 0.32 | 50% | 0.504 | S | S | . | . | trans | -87.6 | 162 | 159.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | V254 S258 T262 | V254-G256 PolarHBondContact O-N 3.35Å; G256-S258 PolarHBondContact O-N 3.02Å; G256-T262 VanDerWaalsContact N-CG2 3.25Å | ||
| 257 | A | 64.5 | Low | 68.9 | Low | 111 Ų | 111 | 83.6 Ų | 83.6 | 92% | 0.917 | 49% | 0.493 | S | S | * | . | S | Bend | trans | -65.3 | -24.2 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||
| 258 | S | 72.3 | Confident | 70.1 | Confident | 48 Ų | 48 | 81.3 Ų | 81.3 | 34% | 0.336 | 49% | 0.492 | S | S | . | . | S | Bend | trans | -124.4 | 158.2 | 172.1 | 73.3 | 0 | 0 | 0 | 0 | 112.1 | G256 M260 D261 T262 | G256-S258 PolarHBondContact O-N 3.02Å; S258-M260 PolarHBondContact O-N 3.47Å; S258-M260 PolarHBondContact OG-N 2.96Å; S258-D261 WeakPolarHBondContact CB-OD2 3.5Å; S258-D261 PolarHBondContact N-OD2 3.28Å; S258-D261 PolarHBondContact O-N 3.48Å; S258-D261 VanDerWaalsContact O-N 3.12Å; S258-D261 PolarHBondContact OG-N 3.45Å; S258-D261 VanDerWaalsContact OG-N 3.12Å; S258-D261 PolarHBondContact OG-OD1 3.39Å; S258-D261 PolarHBondContact OG-OD2 3.47Å; S258-T262 WeakPolarHBondContact O-CG2 3.44Å; S258-T262 PolarHBondContact O-N 3.21Å; S258-T262 VanDerWaalsContact O-N 3.14Å |
| 259 | L | 78.3 | Confident | 71.2 | Confident | 101 Ų | 101 | 87.6 Ų | 87.6 | 53% | 0.529 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -59.3 | -26.6 | 171.4 | -170.6 | 113.3 | 0 | 0 | 0 | 111.8 | T262 I263 | L259-T262 PolarHBondContact O-OG1 2.73Å; L259-I263 HydrophobicContact CD2-CD1 3.78Å; L259-I263 HydrophobicContact CG-CD1 4.23Å; L259-I263 WeakPolarHBondContact O-CD1 3.44Å; L259-I263 VanDerWaalsContact O-CG1 3.23Å; L259-I263 WeakPolarHBondContact O-CG1 3.42Å; L259-I263 PolarHBondContact O-N 3.32Å; L259-I263 VanDerWaalsContact O-N 3.15Å |
| 260 | M | 80.8 | Confident | 72.4 | Confident | 119 Ų | 119 | 86 Ų | 86 | 59% | 0.586 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -70.3 | -43.9 | 175.4 | -170.9 | 64.6 | -163.2 | 0 | 0 | 111 | S258 T262 I263 E264 | S258-M260 PolarHBondContact O-N 3.47Å; S258-M260 PolarHBondContact OG-N 2.96Å; M260-T262 VanDerWaalsContact C-N 3.28Å; M260-T262 PolarHBondContact O-N 3.09Å; M260-I263 PolarHBondContact O-N 2.91Å; M260-E264 WeakPolarHBondContact O-CB 3.31Å; M260-E264 PolarHBondContact O-N 2.93Å |
| 261 | D | 79.9 | Confident | 73.6 | Confident | 67 Ų | 67 | 81.7 Ų | 81.7 | 36% | 0.358 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -62.9 | -36.8 | 177.9 | -55.8 | -35.5 | 0 | 0 | 0 | 111.4 | S258 E264 L265 | S258-D261 WeakPolarHBondContact CB-OD2 3.5Å; S258-D261 PolarHBondContact N-OD2 3.28Å; S258-D261 PolarHBondContact O-N 3.48Å; S258-D261 VanDerWaalsContact O-N 3.12Å; S258-D261 PolarHBondContact OG-N 3.45Å; S258-D261 VanDerWaalsContact OG-N 3.12Å; S258-D261 PolarHBondContact OG-OD1 3.39Å; S258-D261 PolarHBondContact OG-OD2 3.47Å; D261-E264 PolarHBondContact O-N 3.33Å; D261-L265 VanDerWaalsContact O-CB 3.24Å; D261-L265 WeakPolarHBondContact O-CB 3.45Å; D261-L265 PolarHBondContact O-N 2.97Å |
| 262 | T | 79.9 | Confident | 74.3 | Confident | 30 Ų | 30 | 80.7 Ų | 80.7 | 18% | 0.184 | 48% | 0.477 | C | S | . | . | H | α-helix | trans | -67.6 | -40.6 | 177.2 | 70.8 | 0 | 0 | 0 | 0 | 111.1 | V254 G256 S258 L259 M260 L266 | V254-T262 VanDerWaalsContact O-CB 3.32Å; V254-T262 WeakPolarHBondContact O-CB 3.38Å; V254-T262 WeakPolarHBondContact O-CG2 3.42Å; G256-T262 VanDerWaalsContact N-CG2 3.25Å; S258-T262 WeakPolarHBondContact O-CG2 3.44Å; S258-T262 PolarHBondContact O-N 3.21Å; S258-T262 VanDerWaalsContact O-N 3.14Å; L259-T262 PolarHBondContact O-OG1 2.73Å; M260-T262 VanDerWaalsContact C-N 3.28Å; M260-T262 PolarHBondContact O-N 3.09Å; T262-L266 WeakPolarHBondContact O-CB 3.47Å; T262-L266 VanDerWaalsContact O-CG 3.3Å; T262-L266 WeakPolarHBondContact O-CG 3.4Å; T262-L266 PolarHBondContact O-N 2.83Å |
| 263 | I | 82.4 | Confident | 75.1 | Confident | 78 Ų | 78 | 84.4 Ų | 84.4 | 40% | 0.4 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -66.8 | -42.5 | 175 | -69.9 | 168.2 | 0 | 0 | 0 | 110.9 | L259 M260 L265 L266 Q267 | L259-I263 HydrophobicContact CD2-CD1 3.78Å; L259-I263 HydrophobicContact CG-CD1 4.23Å; L259-I263 WeakPolarHBondContact O-CD1 3.44Å; L259-I263 VanDerWaalsContact O-CG1 3.23Å; L259-I263 WeakPolarHBondContact O-CG1 3.42Å; L259-I263 PolarHBondContact O-N 3.32Å; L259-I263 VanDerWaalsContact O-N 3.15Å; M260-I263 PolarHBondContact O-N 2.91Å; I263-L265 VanDerWaalsContact C-N 3.35Å; I263-L266 PolarHBondContact O-N 3.28Å; I263-Q267 VanDerWaalsContact O-CB 3.28Å; I263-Q267 WeakPolarHBondContact O-CB 3.28Å; I263-Q267 PolarHBondContact O-N 2.93Å |
| 264 | E | 85.2 | Confident | 76.2 | Confident | 117 Ų | 117 | 85.4 Ų | 85.4 | 55% | 0.547 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -64.9 | -40.8 | 177.6 | -173 | 172.7 | -175.2 | 0 | 0 | 111 | M260 D261 Q267 A268 | M260-E264 WeakPolarHBondContact O-CB 3.31Å; M260-E264 PolarHBondContact O-N 2.93Å; D261-E264 PolarHBondContact O-N 3.33Å; E264-Q267 WeakPolarHBondContact O-CB 3.42Å; E264-Q267 PolarHBondContact O-N 3.16Å; E264-A268 WeakPolarHBondContact O-CB 3.37Å; E264-A268 PolarHBondContact O-N 2.89Å |
| 265 | L | 82.8 | Confident | 76.9 | Confident | 60 Ų | 60 | 87.4 Ų | 87.4 | 31% | 0.314 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -63.6 | -44.5 | 173.7 | -177.8 | 60.1 | 0 | 0 | 0 | 111.6 | D261 I263 Q267 A268 R269 | D261-L265 VanDerWaalsContact O-CB 3.24Å; D261-L265 WeakPolarHBondContact O-CB 3.45Å; D261-L265 PolarHBondContact O-N 2.97Å; I263-L265 VanDerWaalsContact C-N 3.35Å; L265-Q267 VanDerWaalsContact C-N 3.33Å; L265-Q267 PolarHBondContact O-N 3.48Å; L265-A268 PolarHBondContact O-N 3.23Å; L265-R269 VanDerWaalsContact O-CG 3.24Å; L265-R269 WeakPolarHBondContact O-CG 3.28Å; L265-R269 PolarHBondContact O-N 3.06Å |
| 266 | L | 82 | Confident | 77.8 | Confident | 83 Ų | 83 | 84.3 Ų | 84.3 | 44% | 0.435 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -61.4 | -42 | 173.3 | -77.6 | 166.4 | 0 | 0 | 0 | 111.4 | V254 T262 I263 A268 R269 V270 | V254-L266 HydrophobicContact CG1-CD1 3.88Å; V254-L266 HydrophobicContact CG1-CD2 3.92Å; V254-L266 HydrophobicContact CG1-CG 3.62Å; V254-L266 HydrophobicContact CG2-CD2 4.3Å; T262-L266 WeakPolarHBondContact O-CB 3.47Å; T262-L266 VanDerWaalsContact O-CG 3.3Å; T262-L266 WeakPolarHBondContact O-CG 3.4Å; T262-L266 PolarHBondContact O-N 2.83Å; I263-L266 PolarHBondContact O-N 3.28Å; L266-A268 VanDerWaalsContact C-N 3.34Å; L266-A268 PolarHBondContact O-N 3.4Å; L266-R269 PolarHBondContact O-N 3.22Å; L266-V270 WeakPolarHBondContact O-CB 3.41Å; L266-V270 VanDerWaalsContact O-CG2 3.22Å; L266-V270 WeakPolarHBondContact O-CG2 3.45Å; L266-V270 PolarHBondContact O-N 3.17Å |
| 267 | Q | 83.9 | Confident | 78.4 | Confident | 117 Ų | 117 | 85.9 Ų | 85.9 | 55% | 0.547 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -63.1 | -40.3 | 176.5 | -178.4 | 177.7 | -9.3 | 0 | 0 | 111.5 | I263 E264 L265 V270 S271 | I263-Q267 VanDerWaalsContact O-CB 3.28Å; I263-Q267 WeakPolarHBondContact O-CB 3.28Å; I263-Q267 PolarHBondContact O-N 2.93Å; E264-Q267 WeakPolarHBondContact O-CB 3.42Å; E264-Q267 PolarHBondContact O-N 3.16Å; L265-Q267 VanDerWaalsContact C-N 3.33Å; L265-Q267 PolarHBondContact O-N 3.48Å; Q267-V270 PolarHBondContact O-N 3.03Å; Q267-S271 WeakPolarHBondContact O-CB 3.42Å; Q267-S271 PolarHBondContact O-N 2.82Å; Q267-S271 PolarHBondContact O-OG 2.95Å |
| 268 | A | 81.8 | Confident | 79 | Confident | 55 Ų | 55 | 84 Ų | 84 | 46% | 0.455 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -64.5 | -41.6 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | E264 L265 L266 S271 A272 | E264-A268 WeakPolarHBondContact O-CB 3.37Å; E264-A268 PolarHBondContact O-N 2.89Å; L265-A268 PolarHBondContact O-N 3.23Å; L266-A268 VanDerWaalsContact C-N 3.34Å; L266-A268 PolarHBondContact O-N 3.4Å; A268-S271 PolarHBondContact O-N 3.19Å; A268-A272 WeakPolarHBondContact O-CB 3.49Å; A268-A272 PolarHBondContact O-N 3.39Å |
| 269 | R | 78.3 | Confident | 79.5 | Confident | 168 Ų | 168 | 86.9 Ų | 86.9 | 63% | 0.634 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -65.1 | -38.7 | 174.4 | -66.2 | -69.2 | -174.4 | -175 | 1.2 | 112.3 | L265 L266 A272 L273 | L265-R269 VanDerWaalsContact O-CG 3.24Å; L265-R269 WeakPolarHBondContact O-CG 3.28Å; L265-R269 PolarHBondContact O-N 3.06Å; L266-R269 PolarHBondContact O-N 3.22Å; R269-A272 PolarHBondContact O-N 3.38Å; R269-L273 PolarHBondContact O-N 2.9Å |
| 270 | V | 82.8 | Confident | 79.7 | Confident | 95 Ų | 95 | 87.3 Ų | 87.3 | 58% | 0.576 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -68.3 | -37.4 | 174.5 | 171 | 0 | 0 | 0 | 0 | 111.4 | L266 Q267 A272 L273 | L266-V270 WeakPolarHBondContact O-CB 3.41Å; L266-V270 VanDerWaalsContact O-CG2 3.22Å; L266-V270 WeakPolarHBondContact O-CG2 3.45Å; L266-V270 PolarHBondContact O-N 3.17Å; Q267-V270 PolarHBondContact O-N 3.03Å; V270-A272 VanDerWaalsContact C-N 3.29Å; V270-A272 PolarHBondContact O-N 3.45Å; V270-L273 WeakPolarHBondContact O-CB 3.26Å; V270-L273 PolarHBondContact O-N 2.88Å; V270-L273 VanDerWaalsContact O-N 3.16Å |
| 271 | S | 79 | Confident | 79.5 | Confident | 71 Ų | 71 | 85.2 Ų | 85.2 | 50% | 0.497 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -67.9 | -32.6 | 174.3 | -55.9 | 0 | 0 | 0 | 0 | 111.4 | Q267 A268 L273 D274 | Q267-S271 WeakPolarHBondContact O-CB 3.42Å; Q267-S271 PolarHBondContact O-N 2.82Å; Q267-S271 PolarHBondContact O-OG 2.95Å; A268-S271 PolarHBondContact O-N 3.19Å; S271-L273 VanDerWaalsContact C-N 3.25Å; S271-L273 PolarHBondContact O-N 3.46Å; S271-D274 PolarHBondContact O-N 3.27Å |
| 272 | A | 73.3 | Confident | 79.5 | Confident | 48 Ų | 48 | 86.6 Ų | 86.6 | 40% | 0.397 | 48% | 0.479 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -71.9 | -15 | 173.3 | 0 | 0 | 0 | 0 | 0 | 113.9 | A268 R269 V270 D274 | A268-A272 WeakPolarHBondContact O-CB 3.49Å; A268-A272 PolarHBondContact O-N 3.39Å; R269-A272 PolarHBondContact O-N 3.38Å; V270-A272 VanDerWaalsContact C-N 3.29Å; V270-A272 PolarHBondContact O-N 3.45Å; A272-D274 PolarHBondContact O-N 3.42Å |
| 273 | L | 75.5 | Confident | 79.7 | Confident | 141 Ų | 141 | 88.2 Ų | 88.2 | 74% | 0.738 | 50% | 0.496 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.2 | -14.7 | 173.4 | -84.1 | 145.5 | 0 | 0 | 0 | 112.5 | R269 V270 S271 S275 | R269-L273 PolarHBondContact O-N 2.9Å; V270-L273 WeakPolarHBondContact O-CB 3.26Å; V270-L273 PolarHBondContact O-N 2.88Å; V270-L273 VanDerWaalsContact O-N 3.16Å; S271-L273 VanDerWaalsContact C-N 3.25Å; S271-L273 PolarHBondContact O-N 3.46Å; L273-S275 PolarHBondContact O-N 3.36Å |
| 274 | D | 81.1 | Confident | 79.9 | Confident | 78 Ų | 78 | 92.3 Ų | 92.3 | 42% | 0.417 | 51% | 0.506 | S | S | . | . | trans | -86.1 | 82.1 | 172.1 | -174.2 | 12.8 | 0 | 0 | 0 | 111.3 | S271 A272 A276 T277 L278 | S271-D274 PolarHBondContact O-N 3.27Å; A272-D274 PolarHBondContact O-N 3.42Å; D274-A276 PolarHBondContact O-N 3.39Å; D274-A276 VanDerWaalsContact O-N 3.13Å; D274-T277 WeakPolarHBondContact CB-OG1 3.47Å; D274-T277 PolarHBondContact O-N 2.84Å; D274-T277 PolarHBondContact O-OG1 3.18Å; D274-T277 WeakPolarHBondContact OD2-CB 3.46Å; D274-T277 WeakPolarHBondContact OD2-CG2 3.33Å; D274-T277 PolarHBondContact OD2-OG1 3.35Å; D274-L278 WeakPolarHBondContact O-CB 3.21Å; D274-L278 PolarHBondContact O-N 3.4Å | ||
| 275 | S | 73.4 | Confident | 79.8 | Confident | 84 Ų | 84 | 91.9 Ų | 91.9 | 59% | 0.587 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -52.5 | -34 | -177.1 | 58.1 | 0 | 0 | 0 | 0 | 114.8 | L273 D279 | L273-S275 PolarHBondContact O-N 3.36Å; S275-D279 PolarHBondContact O-N 2.93Å |
| 276 | A | 77 | Confident | 80 | Confident | 69 Ų | 69 | 95 Ų | 95 | 57% | 0.57 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -74.2 | -34.7 | -175.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | D274 | D274-A276 PolarHBondContact O-N 3.39Å; D274-A276 VanDerWaalsContact O-N 3.13Å |
| 277 | T | 72.9 | Confident | 80.4 | Confident | 64 Ų | 64 | 94.3 Ų | 94.3 | 39% | 0.393 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -82.9 | -29.9 | 174.8 | 56.9 | 0 | 0 | 0 | 0 | 111.5 | D274 Q280 V281 | D274-T277 WeakPolarHBondContact CB-OG1 3.47Å; D274-T277 PolarHBondContact O-N 2.84Å; D274-T277 PolarHBondContact O-OG1 3.18Å; D274-T277 WeakPolarHBondContact OD2-CB 3.46Å; D274-T277 WeakPolarHBondContact OD2-CG2 3.33Å; D274-T277 PolarHBondContact OD2-OG1 3.35Å; T277-Q280 PolarHBondContact O-N 3.46Å; T277-V281 WeakPolarHBondContact O-CB 3.45Å; T277-V281 VanDerWaalsContact O-CG2 3.23Å; T277-V281 WeakPolarHBondContact O-CG2 3.32Å; T277-V281 PolarHBondContact O-N 3.4Å |
| 278 | L | 77.3 | Confident | 80.6 | Confident | 72 Ų | 72 | 92.9 Ų | 92.9 | 38% | 0.377 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -61.7 | -48.6 | 176 | -169.8 | 67 | 0 | 0 | 0 | 112 | D274 Q280 V281 E282 | D274-L278 WeakPolarHBondContact O-CB 3.21Å; D274-L278 PolarHBondContact O-N 3.4Å; L278-Q280 VanDerWaalsContact C-N 3.29Å; L278-Q280 PolarHBondContact O-N 2.98Å; L278-V281 PolarHBondContact O-N 3.45Å; L278-E282 WeakPolarHBondContact O-CB 3.4Å; L278-E282 PolarHBondContact O-N 2.87Å |
| 279 | D | 81.3 | Confident | 80.9 | Confident | 108 Ų | 108 | 95.2 Ų | 95.2 | 58% | 0.578 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -60.6 | -38.8 | 179.2 | -72.8 | -14.6 | 0 | 0 | 0 | 112.1 | S275 A283 | S275-D279 PolarHBondContact O-N 2.93Å; D279-A283 WeakPolarHBondContact O-CB 3.48Å; D279-A283 PolarHBondContact O-N 3.29Å |
| 280 | Q | 82.3 | Confident | 81.4 | Confident | 110 Ų | 110 | 89 Ų | 89 | 51% | 0.514 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -70.8 | -37.7 | 178.4 | -169.1 | 178.3 | 37.9 | 0 | 0 | 112.1 | T277 L278 R284 | T277-Q280 PolarHBondContact O-N 3.46Å; L278-Q280 VanDerWaalsContact C-N 3.29Å; L278-Q280 PolarHBondContact O-N 2.98Å; Q280-R284 WeakPolarHBondContact O-CG 3.4Å; Q280-R284 PolarHBondContact O-N 2.84Å |
| 281 | V | 77.3 | Confident | 81.6 | Confident | 74 Ų | 74 | 90.8 Ų | 90.8 | 45% | 0.448 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -71.9 | -39.9 | 176.5 | 170.9 | 0 | 0 | 0 | 0 | 110.7 | T277 L278 R284 L285 | T277-V281 WeakPolarHBondContact O-CB 3.45Å; T277-V281 VanDerWaalsContact O-CG2 3.23Å; T277-V281 WeakPolarHBondContact O-CG2 3.32Å; T277-V281 PolarHBondContact O-N 3.4Å; L278-V281 PolarHBondContact O-N 3.45Å; V281-R284 PolarHBondContact O-N 2.91Å; V281-L285 HydrophobicContact CG1-CD1 3.89Å; V281-L285 HydrophobicContact CG1-CG 4.43Å; V281-L285 WeakPolarHBondContact O-CB 3.3Å; V281-L285 PolarHBondContact O-N 3.45Å |
| 282 | E | 79.6 | Confident | 81.8 | Confident | 96 Ų | 96 | 93.2 Ų | 93.2 | 45% | 0.449 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -62.7 | -45.2 | 176.7 | -171.4 | 176.4 | 169.3 | 0 | 0 | 111.5 | L278 R284 L285 Q286 | L278-E282 WeakPolarHBondContact O-CB 3.4Å; L278-E282 PolarHBondContact O-N 2.87Å; E282-R284 VanDerWaalsContact C-N 3.28Å; E282-R284 PolarHBondContact O-N 2.98Å; E282-L285 PolarHBondContact O-N 3.27Å; E282-Q286 WeakPolarHBondContact O-CG 3.34Å; E282-Q286 PolarHBondContact O-N 3.44Å |
| 283 | A | 85.5 | Confident | 82.3 | Confident | 65 Ų | 65 | 95.8 Ų | 95.8 | 54% | 0.537 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -60 | -37.6 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | D279 S287 | D279-A283 WeakPolarHBondContact O-CB 3.48Å; D279-A283 PolarHBondContact O-N 3.29Å; A283-S287 PolarHBondContact O-N 3.27Å |
| 284 | R | 84.8 | Confident | 82.7 | Confident | 163 Ų | 163 | 95.5 Ų | 95.5 | 62% | 0.615 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -71.6 | -41.5 | 175 | -71.3 | 178 | -178.6 | 179.3 | 4.2 | 111.8 | Q280 V281 E282 S287 V288 | Q280-R284 WeakPolarHBondContact O-CG 3.4Å; Q280-R284 PolarHBondContact O-N 2.84Å; V281-R284 PolarHBondContact O-N 2.91Å; E282-R284 VanDerWaalsContact C-N 3.28Å; E282-R284 PolarHBondContact O-N 2.98Å; R284-S287 WeakPolarHBondContact O-CB 3.32Å; R284-S287 PolarHBondContact O-N 3.44Å; R284-V288 WeakPolarHBondContact O-CG2 3.4Å; R284-V288 PolarHBondContact O-N 3.42Å |
| 285 | L | 84.1 | Confident | 82.5 | Confident | 108 Ų | 108 | 97.1 Ų | 97.1 | 57% | 0.565 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -62.2 | -41.8 | 176.1 | -85.8 | 167.6 | 0 | 0 | 0 | 111.8 | V281 E282 S287 V288 L289 | V281-L285 HydrophobicContact CG1-CD1 3.89Å; V281-L285 HydrophobicContact CG1-CG 4.43Å; V281-L285 WeakPolarHBondContact O-CB 3.3Å; V281-L285 PolarHBondContact O-N 3.45Å; E282-L285 PolarHBondContact O-N 3.27Å; L285-S287 VanDerWaalsContact C-N 3.3Å; L285-S287 PolarHBondContact O-N 3.5Å; L285-V288 PolarHBondContact O-N 2.81Å; L285-L289 WeakPolarHBondContact O-CB 3.36Å; L285-L289 PolarHBondContact O-N 3.02Å |
| 286 | Q | 87.8 | Confident | 82.5 | Confident | 126 Ų | 126 | 95.4 Ų | 95.4 | 59% | 0.589 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -61.1 | -39.2 | 174.8 | -73.9 | -166.6 | 9.8 | 0 | 0 | 112 | E282 L289 G290 | E282-Q286 WeakPolarHBondContact O-CG 3.34Å; E282-Q286 PolarHBondContact O-N 3.44Å; Q286-L289 PolarHBondContact O-N 3.49Å; Q286-G290 PolarHBondContact O-N 2.9Å |
| 287 | S | 88.9 | Confident | 82.6 | Confident | 69 Ų | 69 | 100.2 Ų | 100.2 | 48% | 0.483 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -64.9 | -40.5 | 174.6 | -172.2 | 0 | 0 | 0 | 0 | 112.5 | A283 R284 L285 G290 K291 | A283-S287 PolarHBondContact O-N 3.27Å; R284-S287 WeakPolarHBondContact O-CB 3.32Å; R284-S287 PolarHBondContact O-N 3.44Å; L285-S287 VanDerWaalsContact C-N 3.3Å; L285-S287 PolarHBondContact O-N 3.5Å; S287-G290 PolarHBondContact O-N 3.02Å; S287-K291 PolarHBondContact O-N 3.33Å |
| 288 | V | 87.9 | Confident | 82.6 | Confident | 87 Ų | 87 | 102.6 Ų | 102.6 | 53% | 0.527 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -67.3 | -42.5 | 175.9 | 172.5 | 0 | 0 | 0 | 0 | 111.2 | R284 L285 G290 K291 M292 | R284-V288 WeakPolarHBondContact O-CG2 3.4Å; R284-V288 PolarHBondContact O-N 3.42Å; L285-V288 PolarHBondContact O-N 2.81Å; V288-G290 VanDerWaalsContact C-N 3.31Å; V288-G290 PolarHBondContact O-N 3.38Å; V288-K291 PolarHBondContact O-N 3.41Å; V288-M292 WeakPolarHBondContact O-CB 3.4Å; V288-M292 PolarHBondContact O-N 2.81Å |
| 289 | L | 88.8 | Confident | 82.1 | Confident | 103 Ų | 103 | 104 Ų | 104 | 54% | 0.539 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -59.2 | -42.1 | 176 | -167.1 | 89.1 | 0 | 0 | 0 | 111.2 | L285 Q286 K291 M292 N293 | L285-L289 WeakPolarHBondContact O-CB 3.36Å; L285-L289 PolarHBondContact O-N 3.02Å; Q286-L289 PolarHBondContact O-N 3.49Å; L289-K291 PolarHBondContact O-N 3.16Å; L289-M292 PolarHBondContact O-N 2.94Å; L289-N293 WeakPolarHBondContact O-CB 3.39Å; L289-N293 PolarHBondContact O-N 3.43Å; L289-N293 PolarHBondContact O-ND2 3.16Å |
| 290 | G | 89.5 | Confident | 81.2 | Confident | 38 Ų | 38 | 102.8 Ų | 102.8 | 39% | 0.392 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -57.6 | -47.8 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | Q286 S287 V288 N293 E294 | Q286-G290 PolarHBondContact O-N 2.9Å; S287-G290 PolarHBondContact O-N 3.02Å; V288-G290 VanDerWaalsContact C-N 3.31Å; V288-G290 PolarHBondContact O-N 3.38Å; G290-N293 PolarHBondContact O-N 3.37Å; G290-E294 PolarHBondContact O-N 3.29Å |
| 291 | K | 86.9 | Confident | 80.3 | Confident | 132 Ų | 132 | 101.7 Ų | 101.7 | 57% | 0.574 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -67.1 | -37.2 | 176.7 | -67.3 | 179.9 | -178.3 | 179.1 | 0 | 112.7 | S287 V288 L289 N293 E294 I295 | S287-K291 PolarHBondContact O-N 3.33Å; V288-K291 PolarHBondContact O-N 3.41Å; L289-K291 PolarHBondContact O-N 3.16Å; K291-N293 VanDerWaalsContact C-N 3.34Å; K291-E294 PolarHBondContact O-N 2.89Å; K291-I295 WeakPolarHBondContact O-CG1 3.42Å; K291-I295 PolarHBondContact O-N 3.46Å |
| 292 | M | 82.1 | Confident | 79.6 | Confident | 123 Ų | 123 | 105 Ų | 105 | 61% | 0.606 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -65.6 | -37.3 | 176.9 | -178.2 | 165.2 | 156.5 | 0 | 0 | 111.7 | V288 L289 I295 A296 | V288-M292 WeakPolarHBondContact O-CB 3.4Å; V288-M292 PolarHBondContact O-N 2.81Å; L289-M292 PolarHBondContact O-N 2.94Å; M292-I295 PolarHBondContact O-N 2.91Å; M292-A296 VanDerWaalsContact O-CB 3.31Å; M292-A296 WeakPolarHBondContact O-CB 3.49Å; M292-A296 PolarHBondContact O-N 3.37Å |
| 293 | N | 84.4 | Confident | 78.8 | Confident | 102 Ų | 102 | 105.1 Ų | 105.1 | 55% | 0.545 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -66 | -37.5 | 173.7 | -78.9 | -29.3 | 0 | 0 | 0 | 112.6 | L289 G290 K291 A296 K297 | L289-N293 WeakPolarHBondContact O-CB 3.39Å; L289-N293 PolarHBondContact O-N 3.43Å; L289-N293 PolarHBondContact O-ND2 3.16Å; G290-N293 PolarHBondContact O-N 3.37Å; K291-N293 VanDerWaalsContact C-N 3.34Å; N293-A296 PolarHBondContact O-N 3.08Å; N293-K297 WeakPolarHBondContact O-CB 3.33Å; N293-K297 PolarHBondContact O-N 3.43Å |
| 294 | E | 83.5 | Confident | 78.2 | Confident | 135 Ų | 135 | 106.5 Ų | 106.5 | 63% | 0.631 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -64 | -41.3 | 172.3 | -73 | -176.1 | 156.2 | 0 | 0 | 112 | G290 K291 K297 N298 | G290-E294 PolarHBondContact O-N 3.29Å; K291-E294 PolarHBondContact O-N 2.89Å; E294-K297 PolarHBondContact O-N 3.35Å; E294-N298 PolarHBondContact O-N 3.3Å; E294-N298 PolarHBondContact O-ND2 3.47Å |
| 295 | I | 76.6 | Confident | 77.7 | Confident | 112 Ų | 112 | 102.3 Ų | 102.3 | 57% | 0.574 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -67.3 | -43 | 176.3 | -65.7 | 165.7 | 0 | 0 | 0 | 111 | K291 M292 K297 N298 K299 | K291-I295 WeakPolarHBondContact O-CG1 3.42Å; K291-I295 PolarHBondContact O-N 3.46Å; M292-I295 PolarHBondContact O-N 2.91Å; I295-K297 VanDerWaalsContact C-N 3.31Å; I295-K297 PolarHBondContact O-N 2.99Å; I295-N298 PolarHBondContact O-N 3.28Å; I295-N298 VanDerWaalsContact O-N 3.14Å; I295-K299 WeakPolarHBondContact O-CB 3.42Å; I295-K299 PolarHBondContact O-N 3.28Å |
| 296 | A | 74.4 | Confident | 77.1 | Confident | 48 Ų | 48 | 102.6 Ų | 102.6 | 40% | 0.397 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -61.7 | -38.8 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | M292 N293 N298 K299 A300 | M292-A296 VanDerWaalsContact O-CB 3.31Å; M292-A296 WeakPolarHBondContact O-CB 3.49Å; M292-A296 PolarHBondContact O-N 3.37Å; N293-A296 PolarHBondContact O-N 3.08Å; A296-N298 VanDerWaalsContact C-N 3.31Å; A296-N298 PolarHBondContact O-N 3.41Å; A296-K299 PolarHBondContact O-N 2.8Å; A296-A300 WeakPolarHBondContact O-CB 3.37Å; A296-A300 PolarHBondContact O-N 3Å |
| 297 | K | 78.2 | Confident | 76.7 | Confident | 169 Ų | 169 | 99.9 Ų | 99.9 | 74% | 0.735 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -63 | -36.5 | 174.7 | -168.5 | 176.4 | -178.3 | 177.9 | 0 | 112.5 | N293 E294 I295 | N293-K297 WeakPolarHBondContact O-CB 3.33Å; N293-K297 PolarHBondContact O-N 3.43Å; E294-K297 PolarHBondContact O-N 3.35Å; I295-K297 VanDerWaalsContact C-N 3.31Å; I295-K297 PolarHBondContact O-N 2.99Å |
| 298 | N | 73.4 | Confident | 76.3 | Confident | 114 Ų | 114 | 102.5 Ų | 102.5 | 61% | 0.61 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -76 | -30.1 | 175 | -67.3 | -20.8 | 0 | 0 | 0 | 112.6 | E294 I295 A296 | E294-N298 PolarHBondContact O-N 3.3Å; E294-N298 PolarHBondContact O-ND2 3.47Å; I295-N298 PolarHBondContact O-N 3.28Å; I295-N298 VanDerWaalsContact O-N 3.14Å; A296-N298 VanDerWaalsContact C-N 3.31Å; A296-N298 PolarHBondContact O-N 3.41Å |
| 299 | K | 65.8 | Low | 76.3 | Confident | 102 Ų | 102 | 102.9 Ų | 102.9 | 44% | 0.443 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -80.5 | -37.4 | -178.2 | -167.7 | 177.6 | -173.1 | -140.5 | 0 | 113.5 | I295 A296 A301 I302 E303 | I295-K299 WeakPolarHBondContact O-CB 3.42Å; I295-K299 PolarHBondContact O-N 3.28Å; A296-K299 PolarHBondContact O-N 2.8Å; K299-A301 PolarHBondContact O-N 3.32Å; K299-A301 VanDerWaalsContact O-N 3.1Å; K299-I302 PolarHBondContact O-N 2.82Å; K299-E303 WeakPolarHBondContact CE-OE1 3.31Å; K299-E303 WeakPolarHBondContact CE-OE2 3.36Å; K299-E303 IonicContact NZ-OE1 2.69Å; K299-E303 PolarHBondContact NZ-OE1 3.39Å; K299-E303 IonicContact NZ-OE2 2.73Å; K299-E303 PolarHBondContact NZ-OE2 2.93Å; K299-E303 PolarHBondContact O-N 3.21Å |
| 300 | A | 62.8 | Low | 76.1 | Confident | 83 Ų | 83 | 103.1 Ų | 103.1 | 69% | 0.686 | 56% | 0.559 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.6 | -17.1 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113.5 | A296 I302 | A296-A300 WeakPolarHBondContact O-CB 3.37Å; A296-A300 PolarHBondContact O-N 3Å; A300-I302 VanDerWaalsContact C-N 3.3Å |
| 301 | A | 63.4 | Low | 76.1 | Confident | 87 Ų | 87 | 105.8 Ų | 105.8 | 72% | 0.719 | 57% | 0.568 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.5 | -7.1 | 173.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | K299 | K299-A301 PolarHBondContact O-N 3.32Å; K299-A301 VanDerWaalsContact O-N 3.1Å |
| 302 | I | 62.1 | Low | 76.2 | Confident | 143 Ų | 143 | 102.5 Ų | 102.5 | 73% | 0.733 | 56% | 0.561 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -125.3 | -24.3 | -166.6 | -58.9 | 175.5 | 0 | 0 | 0 | 113.4 | K299 A300 | K299-I302 PolarHBondContact O-N 2.82Å; A300-I302 VanDerWaalsContact C-N 3.3Å |
| 303 | E | 63.7 | Low | 76.5 | Confident | 99 Ų | 99 | 101.9 Ų | 101.9 | 46% | 0.463 | 56% | 0.557 | S | S | . | * | trans | -94.4 | 137.9 | -176.3 | -79.7 | -179.2 | 158.2 | 0 | 0 | 114.3 | K299 | K299-E303 WeakPolarHBondContact CE-OE1 3.31Å; K299-E303 WeakPolarHBondContact CE-OE2 3.36Å; K299-E303 IonicContact NZ-OE1 2.69Å; K299-E303 PolarHBondContact NZ-OE1 3.39Å; K299-E303 IonicContact NZ-OE2 2.73Å; K299-E303 PolarHBondContact NZ-OE2 2.93Å; K299-E303 PolarHBondContact O-N 3.21Å | ||
| 304 | D | 73.9 | Confident | 76.7 | Confident | 93 Ų | 93 | 102.5 Ų | 102.5 | 50% | 0.497 | 56% | 0.56 | S | S | . | * | trans | -84.4 | 124.4 | 177.9 | 176.3 | 25.4 | 0 | 0 | 0 | 111.1 | E306 T307 Q308 | D304-E306 PolarHBondContact O-N 3.47Å; D304-E306 VanDerWaalsContact O-N 3.13Å; D304-E306 PolarHBondContact OD1-N 3.35Å; D304-T307 HydrophobicContact CB-CG2 4.19Å; D304-T307 PolarHBondContact O-N 3.36Å; D304-T307 PolarHBondContact O-OG1 2.91Å; D304-Q308 PolarHBondContact O-N 2.95Å | ||
| 305 | A | 72.8 | Confident | 77 | Confident | 76 Ų | 76 | 103.2 Ų | 103.2 | 63% | 0.628 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -58.9 | -27.4 | -175.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | Q308 N309 | A305-Q308 PolarHBondContact O-N 3.22Å; A305-N309 PolarHBondContact O-N 2.96Å; A305-N309 VanDerWaalsContact O-N 3.09Å |
| 306 | E | 73.1 | Confident | 77.7 | Confident | 113 Ų | 113 | 101.4 Ų | 101.4 | 53% | 0.528 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -69.6 | -36.6 | 177.6 | -159.5 | -175.1 | 146.5 | 0 | 0 | 111.9 | D304 K310 | D304-E306 PolarHBondContact O-N 3.47Å; D304-E306 VanDerWaalsContact O-N 3.13Å; D304-E306 PolarHBondContact OD1-N 3.35Å; E306-K310 WeakPolarHBondContact O-CG 3.49Å; E306-K310 PolarHBondContact O-N 2.89Å; E306-K310 VanDerWaalsContact O-N 3.11Å; E306-K310 WeakPolarHBondContact OE1-CE 3.4Å; E306-K310 IonicContact OE1-NZ 3.98Å; E306-K310 PolarHBondContact OE1-NZ 3.5Å |
| 307 | T | 79.1 | Confident | 78.3 | Confident | 70 Ų | 70 | 102.8 Ų | 102.8 | 43% | 0.429 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -68.1 | -38.7 | 175.6 | 66.1 | 0 | 0 | 0 | 0 | 111.5 | D304 K310 V311 | D304-T307 HydrophobicContact CB-CG2 4.19Å; D304-T307 PolarHBondContact O-N 3.36Å; D304-T307 PolarHBondContact O-OG1 2.91Å; T307-K310 PolarHBondContact O-N 3.49Å; T307-V311 WeakPolarHBondContact O-CB 3.49Å; T307-V311 VanDerWaalsContact O-CG2 3.25Å; T307-V311 WeakPolarHBondContact O-CG2 3.4Å; T307-V311 PolarHBondContact O-N 2.91Å |
| 308 | Q | 80.9 | Confident | 78.8 | Confident | 124 Ų | 124 | 99.3 Ų | 99.3 | 58% | 0.579 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -67.9 | -37.8 | 178.7 | -165.6 | 165.9 | -3.1 | 0 | 0 | 112 | D304 A305 V311 S312 | D304-Q308 PolarHBondContact O-N 2.95Å; A305-Q308 PolarHBondContact O-N 3.22Å; Q308-V311 PolarHBondContact O-N 3.35Å; Q308-S312 WeakPolarHBondContact O-CB 3.19Å; Q308-S312 PolarHBondContact O-N 2.96Å |
| 309 | N | 86 | Confident | 79.5 | Confident | 94 Ų | 94 | 99.6 Ų | 99.6 | 50% | 0.503 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -67 | -41.8 | 175 | -159.5 | -11 | 0 | 0 | 0 | 111.5 | A305 V311 S312 Q313 | A305-N309 PolarHBondContact O-N 2.96Å; A305-N309 VanDerWaalsContact O-N 3.09Å; N309-V311 PolarHBondContact O-N 3.21Å; N309-S312 PolarHBondContact O-N 3.11Å; N309-Q313 VanDerWaalsContact O-CG 3.3Å; N309-Q313 WeakPolarHBondContact O-CG 3.41Å; N309-Q313 PolarHBondContact O-N 3Å; N309-Q313 PolarHBondContact OD1-NE2 3.35Å; N309-Q313 VanDerWaalsContact OD1-NE2 3.11Å |
| 310 | K | 86.3 | Confident | 80.5 | Confident | 108 Ų | 108 | 102.4 Ų | 102.4 | 47% | 0.47 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -62.7 | -41 | 173.9 | -72.1 | 170.4 | -173.6 | 165.3 | 0 | 112.3 | E306 T307 Q313 L314 | E306-K310 WeakPolarHBondContact O-CG 3.49Å; E306-K310 PolarHBondContact O-N 2.89Å; E306-K310 VanDerWaalsContact O-N 3.11Å; E306-K310 WeakPolarHBondContact OE1-CE 3.4Å; E306-K310 IonicContact OE1-NZ 3.98Å; E306-K310 PolarHBondContact OE1-NZ 3.5Å; T307-K310 PolarHBondContact O-N 3.49Å; K310-Q313 PolarHBondContact O-N 3.46Å; K310-L314 WeakPolarHBondContact O-CG 3.35Å; K310-L314 PolarHBondContact O-N 2.95Å |
| 311 | V | 88.4 | Confident | 81.7 | Confident | 95 Ų | 95 | 106.4 Ų | 106.4 | 58% | 0.576 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -66.2 | -41.3 | 176.6 | 170.8 | 0 | 0 | 0 | 0 | 111.3 | T307 Q308 N309 L314 Y315 | T307-V311 WeakPolarHBondContact O-CB 3.49Å; T307-V311 VanDerWaalsContact O-CG2 3.25Å; T307-V311 WeakPolarHBondContact O-CG2 3.4Å; T307-V311 PolarHBondContact O-N 2.91Å; Q308-V311 PolarHBondContact O-N 3.35Å; N309-V311 PolarHBondContact O-N 3.21Å; V311-L314 PolarHBondContact O-N 3.45Å; V311-Y315 PolarHBondContact O-N 3.02Å |
| 312 | S | 89 | Confident | 82.7 | Confident | 62 Ų | 62 | 107 Ų | 107 | 43% | 0.434 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -61.7 | -44.8 | 175 | -164.3 | 0 | 0 | 0 | 0 | 111.6 | Q308 N309 L314 Y315 D316 | Q308-S312 WeakPolarHBondContact O-CB 3.19Å; Q308-S312 PolarHBondContact O-N 2.96Å; N309-S312 PolarHBondContact O-N 3.11Å; S312-L314 VanDerWaalsContact C-N 3.32Å; S312-L314 PolarHBondContact O-N 3.25Å; S312-Y315 WeakPolarHBondContact O-CB 3.49Å; S312-Y315 PolarHBondContact O-N 3.28Å; S312-Y315 VanDerWaalsContact O-N 3.16Å; S312-D316 PolarHBondContact O-N 2.83Å |
| 313 | Q | 89.2 | Confident | 83.7 | Confident | 110 Ų | 110 | 103.5 Ų | 103.5 | 51% | 0.514 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -61.8 | -39.4 | 176.2 | -71.4 | 171.4 | 24.5 | 0 | 0 | 112.1 | N309 K310 D316 V317 | N309-Q313 VanDerWaalsContact O-CG 3.3Å; N309-Q313 WeakPolarHBondContact O-CG 3.41Å; N309-Q313 PolarHBondContact O-N 3Å; N309-Q313 PolarHBondContact OD1-NE2 3.35Å; N309-Q313 VanDerWaalsContact OD1-NE2 3.11Å; K310-Q313 PolarHBondContact O-N 3.46Å; Q313-D316 PolarHBondContact O-N 3.42Å; Q313-V317 VanDerWaalsContact O-CG2 3.31Å; Q313-V317 WeakPolarHBondContact O-CG2 3.23Å; Q313-V317 PolarHBondContact O-N 3.34Å; Q313-V317 VanDerWaalsContact O-N 3.08Å |
| 314 | L | 88.4 | Confident | 84.7 | Confident | 116 Ų | 116 | 101.8 Ų | 101.8 | 61% | 0.607 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -65.3 | -39.5 | 174.5 | -74.4 | 172.1 | 0 | 0 | 0 | 111.9 | K310 V311 S312 V317 V318 | K310-L314 WeakPolarHBondContact O-CG 3.35Å; K310-L314 PolarHBondContact O-N 2.95Å; V311-L314 PolarHBondContact O-N 3.45Å; S312-L314 VanDerWaalsContact C-N 3.32Å; S312-L314 PolarHBondContact O-N 3.25Å; L314-V317 PolarHBondContact O-N 2.77Å; L314-V318 VanDerWaalsContact O-CG2 3.3Å; L314-V318 WeakPolarHBondContact O-CG2 3.4Å; L314-V318 PolarHBondContact O-N 2.85Å |
| 315 | Y | 90.3 | Very high | 85.3 | Confident | 150 Ų | 150 | 101.1 Ų | 101.1 | 59% | 0.588 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -61.7 | -45.8 | 175.7 | -175.5 | -91.3 | 0 | 0 | 0 | 111.5 | V311 S312 V317 V318 Q319 | V311-Y315 PolarHBondContact O-N 3.02Å; S312-Y315 WeakPolarHBondContact O-CB 3.49Å; S312-Y315 PolarHBondContact O-N 3.28Å; S312-Y315 VanDerWaalsContact O-N 3.16Å; Y315-V317 VanDerWaalsContact C-N 3.3Å; Y315-V317 PolarHBondContact O-N 3.27Å; Y315-V318 PolarHBondContact O-N 3.12Å; Y315-Q319 WeakPolarHBondContact O-CB 3.41Å; Y315-Q319 PolarHBondContact O-N 3.37Å |
| 316 | D | 89.7 | Confident | 85.9 | Confident | 74 Ų | 74 | 101.9 Ų | 101.9 | 40% | 0.396 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -61.7 | -38.9 | 177.5 | -64.4 | -21.9 | 0 | 0 | 0 | 112 | S312 Q313 K320 | S312-D316 PolarHBondContact O-N 2.83Å; Q313-D316 PolarHBondContact O-N 3.42Å; D316-K320 VanDerWaalsContact O-CG 3.28Å; D316-K320 WeakPolarHBondContact O-CG 3.44Å; D316-K320 PolarHBondContact O-N 2.9Å; D316-K320 VanDerWaalsContact O-N 3.07Å |
| 317 | V | 88.2 | Confident | 86.6 | Confident | 76 Ų | 76 | 98.6 Ų | 98.6 | 46% | 0.461 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -65.7 | -47.4 | 174.8 | 172.8 | 0 | 0 | 0 | 0 | 110.4 | Q313 L314 Y315 Q319 K320 W321 | Q313-V317 VanDerWaalsContact O-CG2 3.31Å; Q313-V317 WeakPolarHBondContact O-CG2 3.23Å; Q313-V317 PolarHBondContact O-N 3.34Å; Q313-V317 VanDerWaalsContact O-N 3.08Å; L314-V317 PolarHBondContact O-N 2.77Å; Y315-V317 VanDerWaalsContact C-N 3.3Å; Y315-V317 PolarHBondContact O-N 3.27Å; V317-Q319 VanDerWaalsContact C-N 3.32Å; V317-Q319 PolarHBondContact O-N 3.4Å; V317-K320 PolarHBondContact O-N 3.15Å; V317-W321 PolarHBondContact O-N 2.93Å; V317-W321 VanDerWaalsContact O-N 3.08Å |
| 318 | V | 88.3 | Confident | 87.1 | Confident | 96 Ų | 96 | 98.8 Ų | 98.8 | 58% | 0.582 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -60.1 | -44.2 | 178.6 | 170.3 | 0 | 0 | 0 | 0 | 110.8 | L314 Y315 K320 W321 D322 | L314-V318 VanDerWaalsContact O-CG2 3.3Å; L314-V318 WeakPolarHBondContact O-CG2 3.4Å; L314-V318 PolarHBondContact O-N 2.85Å; Y315-V318 PolarHBondContact O-N 3.12Å; V318-K320 PolarHBondContact O-N 3.47Å; V318-W321 CarbonylContact O-C 3.56Å; V318-W321 PolarHBondContact O-N 2.9Å; V318-W321 VanDerWaalsContact O-N 3.15Å; V318-D322 WeakPolarHBondContact O-CB 3.37Å; V318-D322 PolarHBondContact O-N 3.38Å |
| 319 | Q | 88.4 | Confident | 87.6 | Confident | 120 Ų | 120 | 97 Ų | 97 | 56% | 0.561 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -62.4 | -40.3 | 179.1 | -170.7 | 175.5 | 3.3 | 0 | 0 | 112.4 | Y315 V317 W321 | Y315-Q319 WeakPolarHBondContact O-CB 3.41Å; Y315-Q319 PolarHBondContact O-N 3.37Å; V317-Q319 VanDerWaalsContact C-N 3.32Å; V317-Q319 PolarHBondContact O-N 3.4Å; Q319-W321 VanDerWaalsContact C-N 3.31Å; Q319-W321 PolarHBondContact O-N 3.29Å |
| 320 | K | 87.4 | Confident | 87.8 | Confident | 161 Ų | 161 | 99.2 Ų | 99.2 | 70% | 0.7 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -64.1 | -35.8 | 174.9 | -74.7 | 173.5 | -177.9 | -179.4 | 0 | 112.7 | D316 V317 V318 | D316-K320 VanDerWaalsContact O-CG 3.28Å; D316-K320 WeakPolarHBondContact O-CG 3.44Å; D316-K320 PolarHBondContact O-N 2.9Å; D316-K320 VanDerWaalsContact O-N 3.07Å; V317-K320 PolarHBondContact O-N 3.15Å; V318-K320 PolarHBondContact O-N 3.47Å |
| 321 | W | 86.3 | Confident | 88 | Confident | 167 Ų | 167 | 98 Ų | 98 | 63% | 0.633 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -91.6 | -9 | -176.3 | -77.2 | 84.9 | 0 | 0 | 0 | 114.1 | V317 V318 Q319 A323 V324 S325 | V317-W321 PolarHBondContact O-N 2.93Å; V317-W321 VanDerWaalsContact O-N 3.08Å; V318-W321 CarbonylContact O-C 3.56Å; V318-W321 PolarHBondContact O-N 2.9Å; V318-W321 VanDerWaalsContact O-N 3.15Å; Q319-W321 VanDerWaalsContact C-N 3.31Å; Q319-W321 PolarHBondContact O-N 3.29Å; W321-A323 PolarHBondContact O-N 2.97Å; W321-V324 HydrophobicContact CE3-CB 4.1Å; W321-V324 HydrophobicContact CE3-CG1 4Å; W321-V324 HydrophobicContact CZ3-CG1 4.08Å; W321-V324 CarbonylContact O-C 3.58Å; W321-V324 PolarHBondContact O-N 3.19Å; W321-V324 VanDerWaalsContact O-N 3.13Å; W321-S325 WeakPolarHBondContact O-CB 3.45Å; W321-S325 PolarHBondContact O-N 2.9Å |
| 322 | D | 86.2 | Confident | 88.2 | Confident | 100 Ų | 100 | 97.2 Ų | 97.2 | 54% | 0.535 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -63 | -44.6 | -178.1 | -166.3 | 41.3 | 0 | 0 | 0 | 112.4 | V318 V324 S325 T326 | V318-D322 WeakPolarHBondContact O-CB 3.37Å; V318-D322 PolarHBondContact O-N 3.38Å; D322-V324 VanDerWaalsContact C-N 3.27Å; D322-V324 PolarHBondContact O-N 3.29Å; D322-S325 PolarHBondContact O-N 3.04Å; D322-T326 PolarHBondContact O-N 2.69Å; D322-T326 VanDerWaalsContact O-N 3.09Å; D322-T326 PolarHBondContact O-OG1 3.05Å; D322-T326 VanDerWaalsContact O-OG1 3.12Å |
| 323 | A | 81.8 | Confident | 88.2 | Confident | 69 Ų | 69 | 100.5 Ų | 100.5 | 57% | 0.57 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -63.2 | -32.5 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | W321 T326 S327 | W321-A323 PolarHBondContact O-N 2.97Å; A323-T326 PolarHBondContact O-OG1 3.32Å; A323-S327 PolarHBondContact O-N 3.42Å; A323-S327 PolarHBondContact O-OG 3.17Å |
| 324 | V | 85.3 | Confident | 88.3 | Confident | 63 Ų | 63 | 104.3 Ų | 104.3 | 38% | 0.382 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -75 | -42.3 | 176.4 | -177.6 | 0 | 0 | 0 | 0 | 110.2 | W321 D322 T326 S327 V328 | W321-V324 HydrophobicContact CE3-CB 4.1Å; W321-V324 HydrophobicContact CE3-CG1 4Å; W321-V324 HydrophobicContact CZ3-CG1 4.08Å; W321-V324 CarbonylContact O-C 3.58Å; W321-V324 PolarHBondContact O-N 3.19Å; W321-V324 VanDerWaalsContact O-N 3.13Å; D322-V324 VanDerWaalsContact C-N 3.27Å; D322-V324 PolarHBondContact O-N 3.29Å; V324-T326 VanDerWaalsContact C-N 3.31Å; V324-T326 PolarHBondContact O-N 3.31Å; V324-S327 WeakPolarHBondContact CA-OG 3.2Å; V324-S327 PolarHBondContact O-N 2.96Å; V324-S327 VanDerWaalsContact O-N 3.1Å; V324-S327 PolarHBondContact O-OG 2.68Å; V324-V328 HydrophobicContact CG1-CG2 4.36Å; V324-V328 VanDerWaalsContact O-CG2 3.31Å; V324-V328 WeakPolarHBondContact O-CG2 3.46Å; V324-V328 PolarHBondContact O-N 3.14Å |
| 325 | S | 85.8 | Confident | 88.4 | Confident | 80 Ų | 80 | 103.3 Ų | 103.3 | 56% | 0.559 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -58.5 | -42.5 | 179.3 | -173 | 0 | 0 | 0 | 0 | 112 | W321 D322 S327 P329 | W321-S325 WeakPolarHBondContact O-CB 3.45Å; W321-S325 PolarHBondContact O-N 2.9Å; D322-S325 PolarHBondContact O-N 3.04Å; S325-S327 VanDerWaalsContact C-N 3.33Å; S325-S327 PolarHBondContact O-N 3.4Å; S325-P329 WeakPolarHBondContact O-CD 3.43Å |
| 326 | T | 85.6 | Confident | 88.5 | Confident | 92 Ų | 92 | 100.4 Ų | 100.4 | 56% | 0.564 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -69.4 | -27.4 | 177.6 | 50.3 | 0 | 0 | 0 | 0 | 113.5 | D322 A323 V324 | D322-T326 PolarHBondContact O-N 2.69Å; D322-T326 VanDerWaalsContact O-N 3.09Å; D322-T326 PolarHBondContact O-OG1 3.05Å; D322-T326 VanDerWaalsContact O-OG1 3.12Å; A323-T326 PolarHBondContact O-OG1 3.32Å; V324-T326 VanDerWaalsContact C-N 3.31Å; V324-T326 PolarHBondContact O-N 3.31Å |
| 327 | S | 88.6 | Confident | 88.5 | Confident | 43 Ų | 43 | 100.7 Ų | 100.7 | 30% | 0.301 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -89.7 | -19.4 | 178.4 | 56.2 | 0 | 0 | 0 | 0 | 114.2 | A323 V324 S325 Q330 V331 | A323-S327 PolarHBondContact O-N 3.42Å; A323-S327 PolarHBondContact O-OG 3.17Å; V324-S327 WeakPolarHBondContact CA-OG 3.2Å; V324-S327 PolarHBondContact O-N 2.96Å; V324-S327 VanDerWaalsContact O-N 3.1Å; V324-S327 PolarHBondContact O-OG 2.68Å; S325-S327 VanDerWaalsContact C-N 3.33Å; S325-S327 PolarHBondContact O-N 3.4Å; S327-Q330 WeakPolarHBondContact O-CB 3.4Å; S327-Q330 PolarHBondContact O-N 3.22Å; S327-V331 WeakPolarHBondContact O-CG2 3.46Å; S327-V331 PolarHBondContact O-N 3.46Å |
| 328 | V | 89.9 | Confident | 88.6 | Confident | 75 Ų | 75 | 99.1 Ų | 99.1 | 46% | 0.455 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -53.5 | -47.6 | 178.9 | 163.6 | 0 | 0 | 0 | 0 | 113.3 | V324 Q330 V331 V332 | V324-V328 HydrophobicContact CG1-CG2 4.36Å; V324-V328 VanDerWaalsContact O-CG2 3.31Å; V324-V328 WeakPolarHBondContact O-CG2 3.46Å; V324-V328 PolarHBondContact O-N 3.14Å; V328-Q330 VanDerWaalsContact C-N 3.27Å; V328-Q330 PolarHBondContact O-N 3.45Å; V328-V331 PolarHBondContact O-N 3.1Å; V328-V332 HydrophobicContact CG1-CG2 4.47Å; V328-V332 WeakPolarHBondContact O-CG2 3.39Å; V328-V332 PolarHBondContact O-N 3.01Å |
| 329 | P | 91.2 | Very high | 88.8 | Confident | 86 Ų | 86 | 100.6 Ų | 100.6 | 56% | 0.558 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -59.8 | -37 | 176.8 | -25 | 34.9 | 0 | 0 | 0 | 113.1 | S325 V332 Q333 | S325-P329 WeakPolarHBondContact O-CD 3.43Å; P329-V332 PolarHBondContact O-N 3.12Å; P329-Q333 WeakPolarHBondContact O-CB 3.46Å; P329-Q333 PolarHBondContact O-N 2.95Å |
| 330 | Q | 88.6 | Confident | 89 | Confident | 141 Ų | 141 | 101.8 Ų | 101.8 | 66% | 0.659 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -67.8 | -40.9 | 177.2 | -60.1 | -179.8 | -6.1 | 0 | 0 | 111.4 | S327 V328 V332 Q333 R334 | S327-Q330 WeakPolarHBondContact O-CB 3.4Å; S327-Q330 PolarHBondContact O-N 3.22Å; V328-Q330 VanDerWaalsContact C-N 3.27Å; V328-Q330 PolarHBondContact O-N 3.45Å; Q330-V332 VanDerWaalsContact C-N 3.35Å; Q330-Q333 PolarHBondContact O-N 3.47Å; Q330-R334 WeakPolarHBondContact O-CB 3.34Å; Q330-R334 PolarHBondContact O-N 3.35Å |
| 331 | V | 90.7 | Very high | 89.2 | Confident | 82 Ų | 82 | 99.3 Ų | 99.3 | 50% | 0.497 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -62.6 | -42.5 | 175.3 | 174.9 | 0 | 0 | 0 | 0 | 110.9 | S327 V328 R334 L335 | S327-V331 WeakPolarHBondContact O-CG2 3.46Å; S327-V331 PolarHBondContact O-N 3.46Å; V328-V331 PolarHBondContact O-N 3.1Å; V331-R334 PolarHBondContact O-N 2.98Å; V331-L335 HydrophobicContact CG1-CD1 4.15Å; V331-L335 WeakPolarHBondContact O-CG 2.97Å; V331-L335 PolarHBondContact O-N 2.69Å |
| 332 | V | 92.6 | Very high | 89.4 | Confident | 78 Ų | 78 | 96.5 Ų | 96.5 | 47% | 0.473 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -64.1 | -44 | 175.5 | 176.7 | 0 | 0 | 0 | 0 | 110.9 | V328 P329 Q330 R334 L335 V336 | V328-V332 HydrophobicContact CG1-CG2 4.47Å; V328-V332 WeakPolarHBondContact O-CG2 3.39Å; V328-V332 PolarHBondContact O-N 3.01Å; P329-V332 PolarHBondContact O-N 3.12Å; Q330-V332 VanDerWaalsContact C-N 3.35Å; V332-R334 VanDerWaalsContact C-N 3.31Å; V332-R334 PolarHBondContact O-N 3.14Å; V332-L335 WeakPolarHBondContact O-CB 3.4Å; V332-L335 PolarHBondContact O-N 3.12Å; V332-L335 VanDerWaalsContact O-N 3.15Å; V332-V336 WeakPolarHBondContact O-CG2 3.23Å; V332-V336 PolarHBondContact O-N 3.15Å |
| 333 | Q | 89.1 | Confident | 89.7 | Confident | 131 Ų | 131 | 96.4 Ų | 96.4 | 61% | 0.612 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -61.9 | -40.4 | 177.7 | -168.5 | 66.1 | 14.7 | 0 | 0 | 111.8 | P329 Q330 V336 A337 | P329-Q333 WeakPolarHBondContact O-CB 3.46Å; P329-Q333 PolarHBondContact O-N 2.95Å; Q330-Q333 PolarHBondContact O-N 3.47Å; Q333-V336 PolarHBondContact O-N 3.02Å; Q333-A337 WeakPolarHBondContact O-CB 3.47Å; Q333-A337 PolarHBondContact O-N 2.75Å |
| 334 | R | 91.6 | Very high | 90.2 | Very high | 191 Ų | 191 | 99 Ų | 99 | 72% | 0.721 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -64.6 | -40.5 | 174.1 | -178.1 | 177.4 | 155 | -172.6 | -6.1 | 111.6 | Q330 V331 V332 V336 A337 V338 | Q330-R334 WeakPolarHBondContact O-CB 3.34Å; Q330-R334 PolarHBondContact O-N 3.35Å; V331-R334 PolarHBondContact O-N 2.98Å; V332-R334 VanDerWaalsContact C-N 3.31Å; V332-R334 PolarHBondContact O-N 3.14Å; R334-V336 VanDerWaalsContact C-N 3.32Å; R334-V336 PolarHBondContact O-N 3.5Å; R334-A337 PolarHBondContact O-N 3.29Å; R334-V338 HydrophobicContact CG-CG2 4.34Å; R334-V338 WeakPolarHBondContact O-CB 3.31Å; R334-V338 WeakPolarHBondContact O-CG2 3.3Å; R334-V338 PolarHBondContact O-N 3.37Å |
| 335 | L | 89.9 | Confident | 90.5 | Very high | 95 Ų | 95 | 98.8 Ų | 98.8 | 50% | 0.497 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -61.6 | -39.5 | 173.5 | -81.5 | 160.9 | 0 | 0 | 0 | 112.1 | V331 V332 V338 K339 | V331-L335 HydrophobicContact CG1-CD1 4.15Å; V331-L335 WeakPolarHBondContact O-CG 2.97Å; V331-L335 PolarHBondContact O-N 2.69Å; V332-L335 WeakPolarHBondContact O-CB 3.4Å; V332-L335 PolarHBondContact O-N 3.12Å; V332-L335 VanDerWaalsContact O-N 3.15Å; L335-V338 PolarHBondContact O-N 3.1Å; L335-K339 PolarHBondContact O-N 2.74Å |
| 336 | V | 92.6 | Very high | 90.7 | Very high | 89 Ų | 89 | 101 Ų | 101 | 54% | 0.539 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -66.2 | -46.1 | 175.5 | 172.9 | 0 | 0 | 0 | 0 | 110.9 | V332 Q333 R334 V338 K339 | V332-V336 WeakPolarHBondContact O-CG2 3.23Å; V332-V336 PolarHBondContact O-N 3.15Å; Q333-V336 PolarHBondContact O-N 3.02Å; R334-V336 VanDerWaalsContact C-N 3.32Å; R334-V336 PolarHBondContact O-N 3.5Å; V336-V338 VanDerWaalsContact C-N 3.27Å; V336-V338 PolarHBondContact O-N 2.9Å; V336-K339 WeakPolarHBondContact O-CB 3.44Å; V336-K339 PolarHBondContact O-N 2.82Å |
| 337 | A | 89.8 | Confident | 91.1 | Very high | 80 Ų | 80 | 101.9 Ų | 101.9 | 66% | 0.661 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -62.1 | -34.8 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | Q333 R334 | Q333-A337 WeakPolarHBondContact O-CB 3.47Å; Q333-A337 PolarHBondContact O-N 2.75Å; R334-A337 PolarHBondContact O-N 3.29Å |
| 338 | V | 91.7 | Very high | 91.3 | Very high | 42 Ų | 42 | 106.1 Ų | 106.1 | 26% | 0.255 | 55% | 0.546 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -91.7 | -0.8 | -179.1 | -177.1 | 0 | 0 | 0 | 0 | 112.2 | R334 L335 V336 E340 L341 H342 | R334-V338 HydrophobicContact CG-CG2 4.34Å; R334-V338 WeakPolarHBondContact O-CB 3.31Å; R334-V338 WeakPolarHBondContact O-CG2 3.3Å; R334-V338 PolarHBondContact O-N 3.37Å; L335-V338 PolarHBondContact O-N 3.1Å; V336-V338 VanDerWaalsContact C-N 3.27Å; V336-V338 PolarHBondContact O-N 2.9Å; V338-E340 PolarHBondContact O-N 3.47Å; V338-L341 HydrophobicContact CG1-CB 4.21Å; V338-L341 HydrophobicContact CG1-CD2 4.2Å; V338-L341 PolarHBondContact O-N 3.21Å; V338-H342 PolarHBondContact O-N 2.9Å |
| 339 | K | 92.1 | Very high | 91.5 | Very high | 128 Ų | 128 | 104.2 Ų | 104.2 | 56% | 0.557 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -55.4 | -49.6 | -177.5 | -179.2 | -163.2 | 166.6 | -170.1 | 0 | 112.2 | L335 V336 L341 H342 E343 | L335-K339 PolarHBondContact O-N 2.74Å; V336-K339 WeakPolarHBondContact O-CB 3.44Å; V336-K339 PolarHBondContact O-N 2.82Å; K339-L341 VanDerWaalsContact C-N 3.29Å; K339-L341 PolarHBondContact O-N 3.15Å; K339-H342 PolarHBondContact O-N 3.38Å; K339-E343 PolarHBondContact O-N 3.14Å |
| 340 | E | 91.6 | Very high | 91.6 | Very high | 145 Ų | 145 | 105.7 Ų | 105.7 | 68% | 0.678 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -62.8 | -38.4 | -178.3 | -67.1 | -174.5 | 173 | 0 | 0 | 111.6 | V338 E343 Q344 | V338-E340 PolarHBondContact O-N 3.47Å; E340-E343 PolarHBondContact O-N 3.31Å; E340-Q344 VanDerWaalsContact O-CG 3.32Å; E340-Q344 WeakPolarHBondContact O-CG 3.41Å; E340-Q344 PolarHBondContact O-N 2.76Å |
| 341 | L | 92.5 | Very high | 91.9 | Very high | 108 Ų | 108 | 104.2 Ų | 104.2 | 57% | 0.565 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -65.8 | -43 | 175.7 | -176.2 | 65.8 | 0 | 0 | 0 | 111.6 | V338 K339 E343 Q344 A345 | V338-L341 HydrophobicContact CG1-CB 4.21Å; V338-L341 HydrophobicContact CG1-CD2 4.2Å; V338-L341 PolarHBondContact O-N 3.21Å; K339-L341 VanDerWaalsContact C-N 3.29Å; K339-L341 PolarHBondContact O-N 3.15Å; L341-E343 VanDerWaalsContact C-N 3.33Å; L341-E343 PolarHBondContact O-N 3.12Å; L341-Q344 PolarHBondContact O-N 3.31Å; L341-A345 WeakPolarHBondContact O-CB 3.28Å; L341-A345 PolarHBondContact O-N 2.73Å |
| 342 | H | 90.4 | Very high | 92.2 | Very high | 109 Ų | 109 | 105 Ų | 105 | 51% | 0.505 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -62.9 | -39.4 | 174.7 | -74.9 | 170.8 | 0 | 0 | 0 | 112.2 | V338 K339 A345 M346 | V338-H342 PolarHBondContact O-N 2.9Å; K339-H342 PolarHBondContact O-N 3.38Å; H342-A345 PolarHBondContact O-N 3.33Å; H342-M346 PolarHBondContact O-N 2.88Å |
| 343 | E | 92.1 | Very high | 92.3 | Very high | 98 Ų | 98 | 105.6 Ų | 105.6 | 46% | 0.458 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -65 | -43.7 | 176.4 | -171.7 | 170.4 | 174.4 | 0 | 0 | 111.5 | K339 E340 L341 A345 M346 Q347 | K339-E343 PolarHBondContact O-N 3.14Å; E340-E343 PolarHBondContact O-N 3.31Å; L341-E343 VanDerWaalsContact C-N 3.33Å; L341-E343 PolarHBondContact O-N 3.12Å; E343-A345 PolarHBondContact O-N 3.12Å; E343-M346 PolarHBondContact O-N 3.09Å; E343-Q347 WeakPolarHBondContact O-CG 3.49Å; E343-Q347 PolarHBondContact O-N 3.13Å |
| 344 | Q | 92.6 | Very high | 92.6 | Very high | 122 Ų | 122 | 105 Ų | 105 | 57% | 0.57 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -61.7 | -42.3 | 173.2 | -73.3 | 177 | 3.7 | 0 | 0 | 112.2 | E340 L341 M346 Q347 F348 | E340-Q344 VanDerWaalsContact O-CG 3.32Å; E340-Q344 WeakPolarHBondContact O-CG 3.41Å; E340-Q344 PolarHBondContact O-N 2.76Å; L341-Q344 PolarHBondContact O-N 3.31Å; Q344-M346 VanDerWaalsContact C-N 3.32Å; Q344-M346 PolarHBondContact O-N 2.98Å; Q344-Q347 PolarHBondContact O-N 2.78Å; Q344-F348 WeakPolarHBondContact O-CB 3.44Å; Q344-F348 PolarHBondContact O-N 2.92Å |
| 345 | A | 91.4 | Very high | 92.9 | Very high | 60 Ų | 60 | 100.1 Ų | 100.1 | 50% | 0.496 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -63.2 | -38.3 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112 | L341 H342 E343 F348 G349 | L341-A345 WeakPolarHBondContact O-CB 3.28Å; L341-A345 PolarHBondContact O-N 2.73Å; H342-A345 PolarHBondContact O-N 3.33Å; E343-A345 PolarHBondContact O-N 3.12Å; A345-F348 PolarHBondContact O-N 3.09Å; A345-G349 PolarHBondContact O-N 3.5Å |
| 346 | M | 90.3 | Very high | 93.2 | Very high | 127 Ų | 127 | 99.3 Ų | 99.3 | 63% | 0.626 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -64.6 | -45.7 | 174.3 | -175.6 | 178.5 | 179.5 | 0 | 0 | 111.7 | H342 E343 Q344 F348 G349 Q350 | H342-M346 PolarHBondContact O-N 2.88Å; E343-M346 PolarHBondContact O-N 3.09Å; Q344-M346 VanDerWaalsContact C-N 3.32Å; Q344-M346 PolarHBondContact O-N 2.98Å; M346-F348 VanDerWaalsContact C-N 3.31Å; M346-F348 PolarHBondContact O-N 3.03Å; M346-G349 PolarHBondContact O-N 3.26Å; M346-Q350 PolarHBondContact O-N 3.34Å; M346-Q350 VanDerWaalsContact O-N 3.11Å |
| 347 | Q | 93.7 | Very high | 93.4 | Very high | 109 Ų | 109 | 99.3 Ų | 99.3 | 51% | 0.509 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -61.9 | -39.6 | 175.5 | -70.4 | 176.5 | 4.2 | 0 | 0 | 111.6 | E343 Q344 G349 Q350 L351 | E343-Q347 WeakPolarHBondContact O-CG 3.49Å; E343-Q347 PolarHBondContact O-N 3.13Å; Q344-Q347 PolarHBondContact O-N 2.78Å; Q347-G349 PolarHBondContact O-N 2.86Å; Q347-Q350 PolarHBondContact O-N 3.46Å; Q347-L351 WeakPolarHBondContact O-CB 3.37Å; Q347-L351 PolarHBondContact O-N 3.4Å |
| 348 | F | 93.4 | Very high | 93.7 | Very high | 133 Ų | 133 | 98 Ų | 98 | 58% | 0.583 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -61.4 | -43.7 | 175.3 | -178.7 | -96.7 | 0 | 0 | 0 | 111.8 | Q344 A345 M346 Q350 L351 L352 | Q344-F348 WeakPolarHBondContact O-CB 3.44Å; Q344-F348 PolarHBondContact O-N 2.92Å; A345-F348 PolarHBondContact O-N 3.09Å; M346-F348 VanDerWaalsContact C-N 3.31Å; M346-F348 PolarHBondContact O-N 3.03Å; F348-Q350 VanDerWaalsContact C-N 3.33Å; F348-Q350 PolarHBondContact O-N 2.9Å; F348-L351 PolarHBondContact O-N 2.7Å; F348-L352 WeakPolarHBondContact O-CB 3.38Å; F348-L352 PolarHBondContact O-N 2.74Å |
| 349 | G | 93.3 | Very high | 93.8 | Very high | 34 Ų | 34 | 101.5 Ų | 101.5 | 35% | 0.351 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -58.8 | -42.7 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | A345 M346 Q347 L352 T353 | A345-G349 PolarHBondContact O-N 3.5Å; M346-G349 PolarHBondContact O-N 3.26Å; Q347-G349 PolarHBondContact O-N 2.86Å; G349-L352 PolarHBondContact O-N 3.33Å; G349-T353 WeakPolarHBondContact O-CG2 3.32Å; G349-T353 PolarHBondContact O-N 3.37Å; G349-T353 VanDerWaalsContact O-N 3.16Å; G349-T353 PolarHBondContact O-OG1 2.87Å |
| 350 | Q | 93.6 | Very high | 94.1 | Very high | 117 Ų | 117 | 100.4 Ų | 100.4 | 55% | 0.547 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -68.6 | -39.8 | 175.7 | -69.2 | -179.5 | -10.4 | 0 | 0 | 112.9 | M346 Q347 F348 L352 T353 H354 | M346-Q350 PolarHBondContact O-N 3.34Å; M346-Q350 VanDerWaalsContact O-N 3.11Å; Q347-Q350 PolarHBondContact O-N 3.46Å; F348-Q350 VanDerWaalsContact C-N 3.33Å; F348-Q350 PolarHBondContact O-N 2.9Å; Q350-L352 VanDerWaalsContact C-N 3.28Å; Q350-L352 PolarHBondContact O-N 2.81Å; Q350-T353 PolarHBondContact O-N 3.23Å; Q350-T353 PolarHBondContact O-OG1 3.05Å; Q350-H354 WeakPolarHBondContact O-CB 3.45Å; Q350-H354 PolarHBondContact O-N 3.06Å |
| 351 | L | 95 | Very high | 94.3 | Very high | 111 Ų | 111 | 100.4 Ų | 100.4 | 58% | 0.581 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -63.8 | -38.4 | 176.2 | -176.6 | 64.3 | 0 | 0 | 0 | 110.8 | Q347 F348 H354 L355 | Q347-L351 WeakPolarHBondContact O-CB 3.37Å; Q347-L351 PolarHBondContact O-N 3.4Å; F348-L351 PolarHBondContact O-N 2.7Å; L351-H354 PolarHBondContact O-N 3.48Å; L351-L355 VanDerWaalsContact O-CB 3.3Å; L351-L355 WeakPolarHBondContact O-CB 3.48Å; L351-L355 PolarHBondContact O-N 2.82Å |
| 352 | L | 96.2 | Very high | 94.4 | Very high | 99 Ų | 99 | 100.3 Ų | 100.3 | 52% | 0.518 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -66 | -43.2 | 178.7 | -171.2 | 66.2 | 0 | 0 | 0 | 111.9 | F348 G349 Q350 L355 D356 | F348-L352 WeakPolarHBondContact O-CB 3.38Å; F348-L352 PolarHBondContact O-N 2.74Å; G349-L352 PolarHBondContact O-N 3.33Å; Q350-L352 VanDerWaalsContact C-N 3.28Å; Q350-L352 PolarHBondContact O-N 2.81Å; L352-L355 PolarHBondContact O-N 3.31Å; L352-D356 PolarHBondContact O-N 3.47Å |
| 353 | T | 95.8 | Very high | 94.8 | Very high | 89 Ų | 89 | 99.1 Ų | 99.1 | 55% | 0.546 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -67.3 | -37.7 | 175.6 | 56.2 | 0 | 0 | 0 | 0 | 112.1 | G349 Q350 D356 T357 | G349-T353 WeakPolarHBondContact O-CG2 3.32Å; G349-T353 PolarHBondContact O-N 3.37Å; G349-T353 VanDerWaalsContact O-N 3.16Å; G349-T353 PolarHBondContact O-OG1 2.87Å; Q350-T353 PolarHBondContact O-N 3.23Å; Q350-T353 PolarHBondContact O-OG1 3.05Å; T353-D356 PolarHBondContact O-N 2.8Å; T353-T357 PolarHBondContact O-N 3.22Å; T353-T357 PolarHBondContact O-OG1 2.94Å |
| 354 | H | 95.5 | Very high | 95 | Very high | 119 Ų | 119 | 98.6 Ų | 98.6 | 55% | 0.551 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -63.7 | -43.7 | 172.8 | -173.8 | -88.9 | 0 | 0 | 0 | 111.3 | Q350 L351 T357 T358 | Q350-H354 WeakPolarHBondContact O-CB 3.45Å; Q350-H354 PolarHBondContact O-N 3.06Å; L351-H354 PolarHBondContact O-N 3.48Å; H354-T357 PolarHBondContact O-N 2.88Å; H354-T358 WeakPolarHBondContact O-CG2 3.22Å; H354-T358 PolarHBondContact O-N 3.07Å; H354-T358 PolarHBondContact O-OG1 3.15Å |
| 355 | L | 96.8 | Very high | 95.1 | Very high | 88 Ų | 88 | 95.7 Ų | 95.7 | 46% | 0.461 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -60.2 | -48.6 | 176.8 | -165.3 | 164.9 | 0 | 0 | 0 | 110.7 | L351 L352 T357 T358 Q359 | L351-L355 VanDerWaalsContact O-CB 3.3Å; L351-L355 WeakPolarHBondContact O-CB 3.48Å; L351-L355 PolarHBondContact O-N 2.82Å; L352-L355 PolarHBondContact O-N 3.31Å; L355-T357 VanDerWaalsContact C-N 3.32Å; L355-T357 PolarHBondContact O-N 3.46Å; L355-T358 WeakPolarHBondContact CA-OG1 3.19Å; L355-T358 PolarHBondContact O-N 3.27Å; L355-T358 VanDerWaalsContact O-N 3.16Å; L355-T358 PolarHBondContact O-OG1 3.08Å; L355-Q359 WeakPolarHBondContact O-CB 3.32Å; L355-Q359 PolarHBondContact O-N 2.79Å |
| 356 | D | 96.7 | Very high | 95.4 | Very high | 79 Ų | 79 | 98 Ų | 98 | 42% | 0.422 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -57.4 | -44.8 | 176.5 | -177.1 | 50.6 | 0 | 0 | 0 | 111.7 | L352 T353 T358 Q359 Q360 | L352-D356 PolarHBondContact O-N 3.47Å; T353-D356 PolarHBondContact O-N 2.8Å; D356-T358 PolarHBondContact O-N 2.85Å; D356-Q359 PolarHBondContact O-N 3.34Å; D356-Q360 WeakPolarHBondContact O-CG 3.42Å; D356-Q360 PolarHBondContact O-N 3.27Å; D356-Q360 PolarHBondContact OD2-NE2 3.5Å |
| 357 | T | 96.7 | Very high | 95.7 | Very high | 88 Ų | 88 | 97.7 Ų | 97.7 | 54% | 0.54 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -60.3 | -46 | 176.3 | -53.3 | 0 | 0 | 0 | 0 | 111.7 | T353 H354 L355 Q359 Q360 M361 | T353-T357 PolarHBondContact O-N 3.22Å; T353-T357 PolarHBondContact O-OG1 2.94Å; H354-T357 PolarHBondContact O-N 2.88Å; L355-T357 VanDerWaalsContact C-N 3.32Å; L355-T357 PolarHBondContact O-N 3.46Å; T357-Q359 VanDerWaalsContact C-N 3.33Å; T357-Q359 PolarHBondContact O-N 3.5Å; T357-Q360 PolarHBondContact O-N 2.89Å; T357-M361 PolarHBondContact O-N 3.42Å |
| 358 | T | 95.6 | Very high | 95.8 | Very high | 54 Ų | 54 | 97.4 Ų | 97.4 | 33% | 0.331 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -65.2 | -36.9 | 177.2 | 59 | 0 | 0 | 0 | 0 | 112.2 | H354 L355 D356 M361 I362 | H354-T358 WeakPolarHBondContact O-CG2 3.22Å; H354-T358 PolarHBondContact O-N 3.07Å; H354-T358 PolarHBondContact O-OG1 3.15Å; L355-T358 WeakPolarHBondContact CA-OG1 3.19Å; L355-T358 PolarHBondContact O-N 3.27Å; L355-T358 VanDerWaalsContact O-N 3.16Å; L355-T358 PolarHBondContact O-OG1 3.08Å; D356-T358 PolarHBondContact O-N 2.85Å; T358-M361 PolarHBondContact O-N 3.41Å; T358-I362 VanDerWaalsContact O-CG1 3.28Å; T358-I362 WeakPolarHBondContact O-CG1 3.08Å; T358-I362 PolarHBondContact O-N 3.2Å |
| 359 | Q | 95.6 | Very high | 95.9 | Very high | 115 Ų | 115 | 95.1 Ų | 95.1 | 54% | 0.537 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -66.9 | -41 | 177.5 | -173.7 | 173.2 | 0 | 0 | 0 | 111.3 | L355 D356 T357 M361 I362 N363 | L355-Q359 WeakPolarHBondContact O-CB 3.32Å; L355-Q359 PolarHBondContact O-N 2.79Å; D356-Q359 PolarHBondContact O-N 3.34Å; T357-Q359 VanDerWaalsContact C-N 3.33Å; T357-Q359 PolarHBondContact O-N 3.5Å; Q359-M361 VanDerWaalsContact C-N 3.34Å; Q359-I362 PolarHBondContact O-N 3.26Å; Q359-N363 WeakPolarHBondContact O-CB 3.46Å; Q359-N363 PolarHBondContact O-N 3.16Å |
| 360 | Q | 96.5 | Very high | 96 | Very high | 105 Ų | 105 | 98.4 Ų | 98.4 | 49% | 0.491 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -62.1 | -41.5 | 172.8 | -70.1 | 179.3 | 25.4 | 0 | 0 | 111.6 | D356 T357 N363 N364 | D356-Q360 WeakPolarHBondContact O-CG 3.42Å; D356-Q360 PolarHBondContact O-N 3.27Å; D356-Q360 PolarHBondContact OD2-NE2 3.5Å; T357-Q360 PolarHBondContact O-N 2.89Å; Q360-N363 PolarHBondContact O-N 3.33Å; Q360-N364 VanDerWaalsContact O-CG 3.32Å; Q360-N364 PolarHBondContact O-N 3.05Å; Q360-N364 PolarHBondContact O-ND2 3.28Å |
| 361 | M | 95.8 | Very high | 96.1 | Very high | 144 Ų | 144 | 96.8 Ų | 96.8 | 71% | 0.709 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -63.6 | -44.4 | 176.5 | -164.5 | -177.2 | -145.4 | 0 | 0 | 112.3 | T357 T358 Q359 N363 N364 S365 | T357-M361 PolarHBondContact O-N 3.42Å; T358-M361 PolarHBondContact O-N 3.41Å; Q359-M361 VanDerWaalsContact C-N 3.34Å; M361-N363 VanDerWaalsContact C-N 3.34Å; M361-N363 PolarHBondContact O-N 3.25Å; M361-N364 PolarHBondContact O-N 3.19Å; M361-S365 PolarHBondContact O-N 3.33Å |
| 362 | I | 96.4 | Very high | 96.1 | Very high | 106 Ų | 106 | 96.5 Ų | 96.5 | 54% | 0.544 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -62.6 | -42.1 | 175.9 | -69.5 | 165.3 | 0 | 0 | 0 | 110.6 | T358 Q359 N364 S365 L366 | T358-I362 VanDerWaalsContact O-CG1 3.28Å; T358-I362 WeakPolarHBondContact O-CG1 3.08Å; T358-I362 PolarHBondContact O-N 3.2Å; Q359-I362 PolarHBondContact O-N 3.26Å; I362-N364 VanDerWaalsContact C-N 3.35Å; I362-N364 PolarHBondContact O-N 3.26Å; I362-S365 PolarHBondContact O-N 3.41Å; I362-L366 HydrophobicContact CG2-CD1 4.14Å; I362-L366 WeakPolarHBondContact O-CB 3.36Å; I362-L366 PolarHBondContact O-N 3.4Å |
| 363 | N | 97.2 | Very high | 96.1 | Very high | 85 Ų | 85 | 97.5 Ų | 97.5 | 46% | 0.455 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -63.3 | -41.5 | 178.3 | -163.3 | -20.5 | 0 | 0 | 0 | 111.5 | Q359 Q360 M361 L366 K367 | Q359-N363 WeakPolarHBondContact O-CB 3.46Å; Q359-N363 PolarHBondContact O-N 3.16Å; Q360-N363 PolarHBondContact O-N 3.33Å; M361-N363 VanDerWaalsContact C-N 3.34Å; M361-N363 PolarHBondContact O-N 3.25Å; N363-L366 PolarHBondContact O-N 3.19Å; N363-K367 WeakPolarHBondContact O-CG 3.45Å; N363-K367 PolarHBondContact O-N 3.13Å |
| 364 | N | 96.6 | Very high | 96.1 | Very high | 87 Ų | 87 | 96.7 Ų | 96.7 | 47% | 0.465 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -63.8 | -45.3 | 173.6 | -69 | -18.9 | 0 | 0 | 0 | 111.8 | Q360 M361 I362 L366 K367 D368 | Q360-N364 VanDerWaalsContact O-CG 3.32Å; Q360-N364 PolarHBondContact O-N 3.05Å; Q360-N364 PolarHBondContact O-ND2 3.28Å; M361-N364 PolarHBondContact O-N 3.19Å; I362-N364 VanDerWaalsContact C-N 3.35Å; I362-N364 PolarHBondContact O-N 3.26Å; N364-L366 VanDerWaalsContact C-N 3.3Å; N364-L366 PolarHBondContact O-N 2.9Å; N364-K367 WeakPolarHBondContact O-CB 3.43Å; N364-K367 PolarHBondContact O-N 3.45Å; N364-K367 VanDerWaalsContact O-N 3.09Å; N364-D368 PolarHBondContact O-N 3.48Å |
| 365 | S | 96.1 | Very high | 96.1 | Very high | 60 Ų | 60 | 96.9 Ų | 96.9 | 42% | 0.42 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -61.3 | -36.4 | 175.3 | -179.3 | 0 | 0 | 0 | 0 | 112.8 | M361 I362 D368 N369 | M361-S365 PolarHBondContact O-N 3.33Å; I362-S365 PolarHBondContact O-N 3.41Å; S365-D368 PolarHBondContact O-N 2.94Å; S365-N369 WeakPolarHBondContact O-CB 3.27Å; S365-N369 PolarHBondContact O-N 2.97Å; S365-N369 PolarHBondContact O-ND2 3.03Å; S365-N369 VanDerWaalsContact O-ND2 3.07Å |
| 366 | L | 96.2 | Very high | 96 | Very high | 110 Ų | 110 | 96.2 Ų | 96.2 | 58% | 0.576 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -64 | -40.8 | 173.2 | -101 | 157.5 | 0 | 0 | 0 | 112.1 | I362 N363 N364 N369 N370 | I362-L366 HydrophobicContact CG2-CD1 4.14Å; I362-L366 WeakPolarHBondContact O-CB 3.36Å; I362-L366 PolarHBondContact O-N 3.4Å; N363-L366 PolarHBondContact O-N 3.19Å; N364-L366 VanDerWaalsContact C-N 3.3Å; N364-L366 PolarHBondContact O-N 2.9Å; L366-N369 PolarHBondContact O-N 2.97Å; L366-N370 WeakPolarHBondContact O-CB 3.36Å; L366-N370 PolarHBondContact O-N 3.32Å |
| 367 | K | 96.5 | Very high | 95.9 | Very high | 120 Ų | 120 | 99.2 Ų | 99.2 | 52% | 0.522 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -62.6 | -44.3 | 173.3 | -70.3 | 173.1 | -175.6 | 172.9 | 0 | 111.1 | N363 N364 N370 T371 | N363-K367 WeakPolarHBondContact O-CG 3.45Å; N363-K367 PolarHBondContact O-N 3.13Å; N364-K367 WeakPolarHBondContact O-CB 3.43Å; N364-K367 PolarHBondContact O-N 3.45Å; N364-K367 VanDerWaalsContact O-N 3.09Å; K367-N370 WeakPolarHBondContact O-CB 3.24Å; K367-N370 PolarHBondContact O-N 3Å; K367-T371 WeakPolarHBondContact O-CG2 3.24Å; K367-T371 PolarHBondContact O-N 3.37Å; K367-T371 PolarHBondContact O-OG1 3.08Å |
| 368 | D | 96.2 | Very high | 95.8 | Very high | 103 Ų | 103 | 99.6 Ų | 99.6 | 55% | 0.551 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -64.1 | -40 | 177.8 | -64.3 | -20.9 | 0 | 0 | 0 | 112.1 | N364 S365 N370 T371 L372 | N364-D368 PolarHBondContact O-N 3.48Å; S365-D368 PolarHBondContact O-N 2.94Å; D368-N370 VanDerWaalsContact C-N 3.3Å; D368-N370 PolarHBondContact O-N 3.45Å; D368-T371 WeakPolarHBondContact CA-OG1 3.49Å; D368-T371 PolarHBondContact O-N 3.48Å; D368-T371 PolarHBondContact O-OG1 3.35Å; D368-L372 WeakPolarHBondContact O-CB 3.3Å; D368-L372 PolarHBondContact O-N 3.18Å |
| 369 | N | 95.3 | Very high | 95.8 | Very high | 85 Ų | 85 | 99.7 Ų | 99.7 | 46% | 0.455 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -65.4 | -36 | 174.6 | -76.2 | -42.6 | 0 | 0 | 0 | 112 | S365 L366 L372 L373 | S365-N369 WeakPolarHBondContact O-CB 3.27Å; S365-N369 PolarHBondContact O-N 2.97Å; S365-N369 PolarHBondContact O-ND2 3.03Å; S365-N369 VanDerWaalsContact O-ND2 3.07Å; L366-N369 PolarHBondContact O-N 2.97Å; N369-L372 PolarHBondContact O-N 2.91Å; N369-L373 WeakPolarHBondContact O-CB 3.49Å; N369-L373 PolarHBondContact O-N 2.88Å |
| 370 | N | 96.3 | Very high | 95.7 | Very high | 103 Ų | 103 | 100.3 Ų | 100.3 | 55% | 0.551 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -68.1 | -41.5 | 176.4 | -166.8 | 4.7 | 0 | 0 | 0 | 111.8 | L366 K367 D368 L372 L373 T374 | L366-N370 WeakPolarHBondContact O-CB 3.36Å; L366-N370 PolarHBondContact O-N 3.32Å; K367-N370 WeakPolarHBondContact O-CB 3.24Å; K367-N370 PolarHBondContact O-N 3Å; D368-N370 VanDerWaalsContact C-N 3.3Å; D368-N370 PolarHBondContact O-N 3.45Å; N370-L372 VanDerWaalsContact C-N 3.34Å; N370-L373 PolarHBondContact O-N 3.33Å; N370-T374 PolarHBondContact O-N 3.06Å; N370-T374 PolarHBondContact O-OG1 3.39Å |
| 371 | T | 95.6 | Very high | 95.6 | Very high | 83 Ų | 83 | 102 Ų | 102 | 51% | 0.509 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -64 | -39.1 | 173 | 57.9 | 0 | 0 | 0 | 0 | 111.6 | K367 D368 T374 Q375 | K367-T371 WeakPolarHBondContact O-CG2 3.24Å; K367-T371 PolarHBondContact O-N 3.37Å; K367-T371 PolarHBondContact O-OG1 3.08Å; D368-T371 WeakPolarHBondContact CA-OG1 3.49Å; D368-T371 PolarHBondContact O-N 3.48Å; D368-T371 PolarHBondContact O-OG1 3.35Å; T371-T374 VanDerWaalsContact CA-OG1 3.28Å; T371-T374 WeakPolarHBondContact CA-OG1 3.47Å; T371-T374 PolarHBondContact O-N 3.39Å; T371-T374 PolarHBondContact O-OG1 2.85Å; T371-Q375 WeakPolarHBondContact O-CB 3.48Å; T371-Q375 PolarHBondContact O-N 3.13Å |
| 372 | L | 95.3 | Very high | 95.5 | Very high | 104 Ų | 104 | 100.3 Ų | 100.3 | 55% | 0.545 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -64.7 | -44.3 | 175.5 | -145.4 | 85.3 | 0 | 0 | 0 | 111.8 | D368 N369 N370 T374 Q375 V376 | D368-L372 WeakPolarHBondContact O-CB 3.3Å; D368-L372 PolarHBondContact O-N 3.18Å; N369-L372 PolarHBondContact O-N 2.91Å; N370-L372 VanDerWaalsContact C-N 3.34Å; L372-T374 PolarHBondContact O-N 3.25Å; L372-Q375 PolarHBondContact O-N 2.79Å; L372-V376 VanDerWaalsContact O-CG2 3.31Å; L372-V376 WeakPolarHBondContact O-CG2 3.42Å; L372-V376 PolarHBondContact O-N 3.18Å |
| 373 | L | 95.6 | Very high | 95.4 | Very high | 120 Ų | 120 | 100 Ų | 100 | 63% | 0.628 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -61.2 | -43.8 | 176.7 | -100.6 | 155.3 | 0 | 0 | 0 | 112 | N369 N370 Q375 V376 Q377 | N369-L373 WeakPolarHBondContact O-CB 3.49Å; N369-L373 PolarHBondContact O-N 2.88Å; N370-L373 PolarHBondContact O-N 3.33Å; L373-Q375 VanDerWaalsContact C-N 3.32Å; L373-Q375 PolarHBondContact O-N 3.32Å; L373-V376 PolarHBondContact O-N 3.18Å; L373-Q377 WeakPolarHBondContact O-CB 3.31Å; L373-Q377 PolarHBondContact O-N 3.28Å |
| 374 | T | 95 | Very high | 95.3 | Very high | 73 Ų | 73 | 101.1 Ų | 101.1 | 45% | 0.448 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -64.9 | -37.6 | 175.5 | 36 | 0 | 0 | 0 | 0 | 111.7 | N370 T371 L372 Q377 Q378 | N370-T374 PolarHBondContact O-N 3.06Å; N370-T374 PolarHBondContact O-OG1 3.39Å; T371-T374 VanDerWaalsContact CA-OG1 3.28Å; T371-T374 WeakPolarHBondContact CA-OG1 3.47Å; T371-T374 PolarHBondContact O-N 3.39Å; T371-T374 PolarHBondContact O-OG1 2.85Å; L372-T374 PolarHBondContact O-N 3.25Å; T374-Q377 PolarHBondContact O-N 2.99Å; T374-Q378 WeakPolarHBondContact O-CB 3.42Å; T374-Q378 PolarHBondContact O-N 3.35Å |
| 375 | Q | 95.3 | Very high | 95.1 | Very high | 123 Ų | 123 | 100.2 Ų | 100.2 | 58% | 0.575 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -66.7 | -39.7 | 173.8 | -170.5 | 177.4 | 3.1 | 0 | 0 | 112.5 | T371 L372 L373 Q378 T379 | T371-Q375 WeakPolarHBondContact O-CB 3.48Å; T371-Q375 PolarHBondContact O-N 3.13Å; L372-Q375 PolarHBondContact O-N 2.79Å; L373-Q375 VanDerWaalsContact C-N 3.32Å; L373-Q375 PolarHBondContact O-N 3.32Å; Q375-Q378 PolarHBondContact O-N 2.84Å; Q375-T379 WeakPolarHBondContact O-CB 3.23Å; Q375-T379 PolarHBondContact O-N 2.96Å; Q375-T379 PolarHBondContact O-OG1 3.16Å |
| 376 | V | 95.9 | Very high | 95 | Very high | 73 Ų | 73 | 99.2 Ų | 99.2 | 44% | 0.442 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -63.9 | -42.4 | 174 | 169.5 | 0 | 0 | 0 | 0 | 110.9 | L372 L373 Q378 T379 M380 | L372-V376 VanDerWaalsContact O-CG2 3.31Å; L372-V376 WeakPolarHBondContact O-CG2 3.42Å; L372-V376 PolarHBondContact O-N 3.18Å; L373-V376 PolarHBondContact O-N 3.18Å; V376-Q378 VanDerWaalsContact C-N 3.34Å; V376-Q378 PolarHBondContact O-N 3.23Å; V376-T379 VanDerWaalsContact CA-OG1 3.25Å; V376-T379 WeakPolarHBondContact CA-OG1 3.28Å; V376-T379 PolarHBondContact O-N 3.01Å; V376-T379 PolarHBondContact O-OG1 3.41Å; V376-M380 WeakPolarHBondContact O-CB 3.43Å; V376-M380 PolarHBondContact O-N 3.16Å |
| 377 | Q | 94.1 | Very high | 94.8 | Very high | 142 Ų | 142 | 98 Ų | 98 | 66% | 0.664 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -62.8 | -42.2 | 176.1 | -173.3 | 177.2 | -1.8 | 0 | 0 | 111.6 | L373 T374 K381 | L373-Q377 WeakPolarHBondContact O-CB 3.31Å; L373-Q377 PolarHBondContact O-N 3.28Å; T374-Q377 PolarHBondContact O-N 2.99Å; Q377-K381 WeakPolarHBondContact O-CB 3.41Å; Q377-K381 PolarHBondContact O-N 3.44Å |
| 378 | Q | 95 | Very high | 94.6 | Very high | 97 Ų | 97 | 98.9 Ų | 98.9 | 45% | 0.453 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -65 | -47.9 | 176.6 | -177.4 | 61.3 | 23.1 | 0 | 0 | 111.6 | T374 Q375 V376 M380 K381 E382 | T374-Q378 WeakPolarHBondContact O-CB 3.42Å; T374-Q378 PolarHBondContact O-N 3.35Å; Q375-Q378 PolarHBondContact O-N 2.84Å; V376-Q378 VanDerWaalsContact C-N 3.34Å; V376-Q378 PolarHBondContact O-N 3.23Å; Q378-M380 PolarHBondContact O-N 2.91Å; Q378-K381 WeakPolarHBondContact O-CB 3.43Å; Q378-K381 PolarHBondContact O-N 3.32Å; Q378-K381 VanDerWaalsContact O-N 3.13Å; Q378-E382 WeakPolarHBondContact CG-OE1 3.44Å; Q378-E382 PolarHBondContact NE2-OE1 3.39Å; Q378-E382 WeakPolarHBondContact O-CG 3.35Å; Q378-E382 PolarHBondContact O-N 2.7Å |
| 379 | T | 95.3 | Very high | 94.5 | Very high | 56 Ų | 56 | 100.2 Ų | 100.2 | 34% | 0.344 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -65 | -36.3 | 177.5 | 43.4 | 0 | 0 | 0 | 0 | 112.6 | Q375 V376 K381 E382 N383 | Q375-T379 WeakPolarHBondContact O-CB 3.23Å; Q375-T379 PolarHBondContact O-N 2.96Å; Q375-T379 PolarHBondContact O-OG1 3.16Å; V376-T379 VanDerWaalsContact CA-OG1 3.25Å; V376-T379 WeakPolarHBondContact CA-OG1 3.28Å; V376-T379 PolarHBondContact O-N 3.01Å; V376-T379 PolarHBondContact O-OG1 3.41Å; T379-K381 VanDerWaalsContact C-N 3.34Å; T379-E382 PolarHBondContact O-N 3.34Å; T379-N383 VanDerWaalsContact O-CB 3.27Å; T379-N383 WeakPolarHBondContact O-CB 3.43Å; T379-N383 PolarHBondContact O-N 2.91Å; T379-N383 PolarHBondContact O-ND2 3.15Å |
| 380 | M | 93.6 | Very high | 94.4 | Very high | 127 Ų | 127 | 101.3 Ų | 101.3 | 63% | 0.626 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -61.7 | -41.9 | 170.7 | -94.3 | -168 | 152.7 | 0 | 0 | 112 | V376 Q378 N383 L384 | V376-M380 WeakPolarHBondContact O-CB 3.43Å; V376-M380 PolarHBondContact O-N 3.16Å; Q378-M380 PolarHBondContact O-N 2.91Å; M380-N383 PolarHBondContact O-N 3.33Å; M380-L384 WeakPolarHBondContact O-CB 3.46Å; M380-L384 WeakPolarHBondContact O-CG 3.3Å; M380-L384 PolarHBondContact O-N 3Å |
| 381 | K | 94.2 | Very high | 94.2 | Very high | 142 Ų | 142 | 103.1 Ų | 103.1 | 62% | 0.617 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -64.8 | -44 | 178.1 | -166.8 | 179.2 | -178.4 | -178.1 | 0 | 111.4 | Q377 Q378 T379 L384 V385 | Q377-K381 WeakPolarHBondContact O-CB 3.41Å; Q377-K381 PolarHBondContact O-N 3.44Å; Q378-K381 WeakPolarHBondContact O-CB 3.43Å; Q378-K381 PolarHBondContact O-N 3.32Å; Q378-K381 VanDerWaalsContact O-N 3.13Å; T379-K381 VanDerWaalsContact C-N 3.34Å; K381-L384 PolarHBondContact O-N 2.85Å; K381-V385 WeakPolarHBondContact O-CG2 3.45Å; K381-V385 PolarHBondContact O-N 3.18Å; K381-V385 VanDerWaalsContact O-N 3.1Å |
| 382 | E | 94.8 | Very high | 94 | Very high | 107 Ų | 107 | 101.7 Ų | 101.7 | 50% | 0.5 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -63.3 | -44.1 | 175.4 | -71.8 | 169.8 | -169.3 | 0 | 0 | 111.8 | Q378 T379 L384 V385 A386 | Q378-E382 WeakPolarHBondContact CG-OE1 3.44Å; Q378-E382 PolarHBondContact NE2-OE1 3.39Å; Q378-E382 WeakPolarHBondContact O-CG 3.35Å; Q378-E382 PolarHBondContact O-N 2.7Å; T379-E382 PolarHBondContact O-N 3.34Å; E382-L384 PolarHBondContact O-N 3.44Å; E382-V385 PolarHBondContact O-N 3.26Å; E382-A386 PolarHBondContact O-N 3.41Å |
| 383 | N | 94.1 | Very high | 93.8 | Very high | 101 Ų | 101 | 99.1 Ų | 99.1 | 54% | 0.54 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -63.6 | -39.1 | 176.2 | -75.3 | -24.3 | 0 | 0 | 0 | 112.4 | T379 M380 A386 I387 | T379-N383 VanDerWaalsContact O-CB 3.27Å; T379-N383 WeakPolarHBondContact O-CB 3.43Å; T379-N383 PolarHBondContact O-N 2.91Å; T379-N383 PolarHBondContact O-ND2 3.15Å; M380-N383 PolarHBondContact O-N 3.33Å; N383-A386 PolarHBondContact O-N 3.41Å; N383-I387 WeakPolarHBondContact O-CB 3.5Å; N383-I387 WeakPolarHBondContact O-CG1 3.47Å; N383-I387 PolarHBondContact O-N 3.47Å |
| 384 | L | 93.5 | Very high | 93.5 | Very high | 108 Ų | 108 | 98.6 Ų | 98.6 | 57% | 0.565 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -62.7 | -44.8 | 175.3 | -81.1 | 170 | 0 | 0 | 0 | 111.5 | M380 K381 E382 A386 I387 E388 | M380-L384 WeakPolarHBondContact O-CB 3.46Å; M380-L384 WeakPolarHBondContact O-CG 3.3Å; M380-L384 PolarHBondContact O-N 3Å; K381-L384 PolarHBondContact O-N 2.85Å; E382-L384 PolarHBondContact O-N 3.44Å; L384-A386 VanDerWaalsContact C-N 3.35Å; L384-A386 PolarHBondContact O-N 2.8Å; L384-I387 PolarHBondContact O-N 3.2Å; L384-E388 WeakPolarHBondContact O-CG 3.35Å; L384-E388 PolarHBondContact O-N 2.84Å |
| 385 | V | 94.2 | Very high | 93.3 | Very high | 68 Ų | 68 | 98.8 Ų | 98.8 | 41% | 0.412 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -60.7 | -45.2 | 175.3 | 173.1 | 0 | 0 | 0 | 0 | 110.7 | K381 E382 I387 E388 E389 | K381-V385 WeakPolarHBondContact O-CG2 3.45Å; K381-V385 PolarHBondContact O-N 3.18Å; K381-V385 VanDerWaalsContact O-N 3.1Å; E382-V385 PolarHBondContact O-N 3.26Å; V385-I387 VanDerWaalsContact C-N 3.32Å; V385-I387 PolarHBondContact O-N 3.49Å; V385-E388 PolarHBondContact O-N 3.31Å; V385-E389 WeakPolarHBondContact O-CG 3.25Å; V385-E389 PolarHBondContact O-N 3.09Å |
| 386 | A | 93.2 | Very high | 93 | Very high | 39 Ų | 39 | 98.9 Ų | 98.9 | 32% | 0.322 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -63.1 | -37.4 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | E382 N383 L384 N390 | E382-A386 PolarHBondContact O-N 3.41Å; N383-A386 PolarHBondContact O-N 3.41Å; L384-A386 VanDerWaalsContact C-N 3.35Å; L384-A386 PolarHBondContact O-N 2.8Å; A386-N390 WeakPolarHBondContact O-CB 3.44Å; A386-N390 PolarHBondContact O-N 2.91Å; A386-N390 PolarHBondContact O-ND2 3.29Å |
| 387 | I | 92.8 | Very high | 92.6 | Very high | 85 Ų | 85 | 104.4 Ų | 104.4 | 44% | 0.436 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -65.8 | -45 | 174.4 | -72.4 | 166.4 | 0 | 0 | 0 | 110.5 | N383 L384 V385 E389 N390 F391 | N383-I387 WeakPolarHBondContact O-CB 3.5Å; N383-I387 WeakPolarHBondContact O-CG1 3.47Å; N383-I387 PolarHBondContact O-N 3.47Å; L384-I387 PolarHBondContact O-N 3.2Å; V385-I387 VanDerWaalsContact C-N 3.32Å; V385-I387 PolarHBondContact O-N 3.49Å; I387-E389 PolarHBondContact O-N 3.31Å; I387-N390 PolarHBondContact O-N 3.04Å; I387-F391 HydrophobicContact CG2-CD2 3.53Å; I387-F391 HydrophobicContact CG2-CE2 3.5Å; I387-F391 VanDerWaalsContact O-CD2 3.25Å; I387-F391 WeakPolarHBondContact O-CD2 3.39Å; I387-F391 PolarHBondContact O-N 2.8Å |
| 388 | E | 92.3 | Very high | 92.1 | Very high | 137 Ų | 137 | 104 Ų | 104 | 64% | 0.64 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -59 | -45.7 | 175.4 | -77.1 | -177.8 | 167.1 | 0 | 0 | 111.9 | L384 V385 N390 F391 A392 | L384-E388 WeakPolarHBondContact O-CG 3.35Å; L384-E388 PolarHBondContact O-N 2.84Å; V385-E388 PolarHBondContact O-N 3.31Å; E388-N390 PolarHBondContact O-N 3.11Å; E388-F391 PolarHBondContact O-N 3.48Å; E388-A392 WeakPolarHBondContact O-CB 3.5Å; E388-A392 PolarHBondContact O-N 2.73Å |
| 389 | E | 93.9 | Very high | 91.8 | Very high | 132 Ų | 132 | 105.3 Ų | 105.3 | 62% | 0.617 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -61.5 | -43.7 | 175.6 | -74.6 | -176.2 | 168.9 | 0 | 0 | 112 | V385 I387 A392 A393 | V385-E389 WeakPolarHBondContact O-CG 3.25Å; V385-E389 PolarHBondContact O-N 3.09Å; I387-E389 PolarHBondContact O-N 3.31Å; E389-A392 PolarHBondContact O-N 3.37Å; E389-A393 WeakPolarHBondContact O-CB 3.31Å; E389-A393 PolarHBondContact O-N 3.46Å |
| 390 | N | 92.9 | Very high | 91.2 | Very high | 108 Ų | 108 | 110.4 Ų | 110.4 | 58% | 0.578 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -62.3 | -44.1 | 176.2 | -77.4 | -38.5 | 0 | 0 | 0 | 111.9 | A386 I387 E388 A393 L394 | A386-N390 WeakPolarHBondContact O-CB 3.44Å; A386-N390 PolarHBondContact O-N 2.91Å; A386-N390 PolarHBondContact O-ND2 3.29Å; I387-N390 PolarHBondContact O-N 3.04Å; E388-N390 PolarHBondContact O-N 3.11Å; N390-A393 PolarHBondContact O-N 2.68Å; N390-L394 WeakPolarHBondContact O-CB 3.23Å; N390-L394 PolarHBondContact O-N 3.13Å |
| 391 | F | 91.3 | Very high | 90.4 | Very high | 141 Ų | 141 | 111 Ų | 111 | 62% | 0.618 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -62.5 | -42 | 175.2 | -88.6 | -68.7 | 0 | 0 | 0 | 111.8 | I387 E388 A393 L394 D395 | I387-F391 HydrophobicContact CG2-CD2 3.53Å; I387-F391 HydrophobicContact CG2-CE2 3.5Å; I387-F391 VanDerWaalsContact O-CD2 3.25Å; I387-F391 WeakPolarHBondContact O-CD2 3.39Å; I387-F391 PolarHBondContact O-N 2.8Å; E388-F391 PolarHBondContact O-N 3.48Å; F391-A393 VanDerWaalsContact C-N 3.35Å; F391-A393 PolarHBondContact O-N 3.41Å; F391-L394 PolarHBondContact O-N 2.98Å; F391-D395 WeakPolarHBondContact O-CB 3.35Å; F391-D395 PolarHBondContact O-N 3.04Å |
| 392 | A | 91.5 | Very high | 88.7 | Confident | 53 Ų | 53 | 109 Ų | 109 | 44% | 0.438 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -62.5 | -41.5 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | E388 E389 D395 Q396 | E388-A392 WeakPolarHBondContact O-CB 3.5Å; E388-A392 PolarHBondContact O-N 2.73Å; E389-A392 PolarHBondContact O-N 3.37Å; A392-D395 PolarHBondContact O-N 3.35Å; A392-Q396 WeakPolarHBondContact O-CG 3.34Å; A392-Q396 PolarHBondContact O-N 3.39Å |
| 393 | A | 90.9 | Very high | 86.4 | Confident | 50 Ų | 50 | 115.6 Ų | 115.6 | 41% | 0.413 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -65.1 | -38.5 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | E389 N390 F391 R397 | E389-A393 WeakPolarHBondContact O-CB 3.31Å; E389-A393 PolarHBondContact O-N 3.46Å; N390-A393 PolarHBondContact O-N 2.68Å; F391-A393 VanDerWaalsContact C-N 3.35Å; F391-A393 PolarHBondContact O-N 3.41Å; A393-R397 PolarHBondContact O-N 3.47Å |
| 394 | L | 89.8 | Confident | 86 | Confident | 108 Ų | 108 | 116.4 Ų | 116.4 | 57% | 0.565 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -66.2 | -44.7 | 176.2 | -129.1 | 157.1 | 0 | 0 | 0 | 111.3 | N390 F391 R397 M398 | N390-L394 WeakPolarHBondContact O-CB 3.23Å; N390-L394 PolarHBondContact O-N 3.13Å; F391-L394 PolarHBondContact O-N 2.98Å; L394-R397 WeakPolarHBondContact O-CB 3.14Å; L394-R397 PolarHBondContact O-N 2.99Å; L394-R397 VanDerWaalsContact O-N 3.16Å; L394-M398 WeakPolarHBondContact O-CB 2.92Å; L394-M398 PolarHBondContact O-N 3.42Å |
| 395 | D | 90 | Very high | 85.6 | Confident | 77 Ų | 77 | 116.8 Ų | 116.8 | 41% | 0.412 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -62.7 | -41.8 | 175.9 | -174.9 | 37.8 | 0 | 0 | 0 | 111.6 | F391 A392 R397 M398 K399 | F391-D395 WeakPolarHBondContact O-CB 3.35Å; F391-D395 PolarHBondContact O-N 3.04Å; A392-D395 PolarHBondContact O-N 3.35Å; D395-R397 VanDerWaalsContact C-N 3.34Å; D395-R397 PolarHBondContact O-N 3.11Å; D395-M398 PolarHBondContact O-N 2.69Å; D395-K399 WeakPolarHBondContact O-CB 3.33Å; D395-K399 WeakPolarHBondContact O-CG 3.31Å; D395-K399 PolarHBondContact O-N 3.22Å; D395-K399 IonicContact OD1-NZ 2.9Å; D395-K399 WeakPolarHBondContact OD2-CE 3.36Å; D395-K399 IonicContact OD2-NZ 3.64Å; D395-K399 PolarHBondContact OD2-NZ 3.24Å |
| 396 | Q | 89.4 | Confident | 85.2 | Confident | 125 Ų | 125 | 119.5 Ų | 119.5 | 58% | 0.584 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -60.4 | -41 | 172 | -77.7 | -173.3 | 4.7 | 0 | 0 | 112.8 | A392 K400 | A392-Q396 WeakPolarHBondContact O-CG 3.34Å; A392-Q396 PolarHBondContact O-N 3.39Å; Q396-K400 WeakPolarHBondContact O-CG 3.41Å; Q396-K400 PolarHBondContact O-N 2.88Å; Q396-K400 VanDerWaalsContact O-N 3.15Å |
| 397 | R | 87.9 | Confident | 84.7 | Confident | 190 Ų | 190 | 124.2 Ų | 124.2 | 72% | 0.717 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -65.4 | -42.8 | 174.6 | -97.2 | -179.5 | 147.9 | -179.1 | -5 | 111.9 | A393 L394 D395 K399 K400 I401 | A393-R397 PolarHBondContact O-N 3.47Å; L394-R397 WeakPolarHBondContact O-CB 3.14Å; L394-R397 PolarHBondContact O-N 2.99Å; L394-R397 VanDerWaalsContact O-N 3.16Å; D395-R397 VanDerWaalsContact C-N 3.34Å; D395-R397 PolarHBondContact O-N 3.11Å; R397-K399 VanDerWaalsContact C-N 3.33Å; R397-K399 PolarHBondContact O-N 2.88Å; R397-K400 WeakPolarHBondContact O-CB 3.36Å; R397-K400 PolarHBondContact O-N 3.2Å; R397-K400 VanDerWaalsContact O-N 3.15Å; R397-I401 WeakPolarHBondContact O-CG1 3.38Å; R397-I401 PolarHBondContact O-N 3.43Å; R397-I401 VanDerWaalsContact O-N 3.13Å |
| 398 | M | 84.3 | Confident | 84.2 | Confident | 133 Ų | 133 | 126.7 Ų | 126.7 | 66% | 0.655 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -63.4 | -41.2 | 179.2 | -150.4 | 162.7 | -155.9 | 0 | 0 | 111 | L394 D395 K400 I401 S402 | L394-M398 WeakPolarHBondContact O-CB 2.92Å; L394-M398 PolarHBondContact O-N 3.42Å; D395-M398 PolarHBondContact O-N 2.69Å; M398-K400 VanDerWaalsContact C-N 3.33Å; M398-K400 PolarHBondContact O-N 3.47Å; M398-I401 PolarHBondContact O-N 3.43Å; M398-I401 VanDerWaalsContact O-N 3.17Å; M398-S402 PolarHBondContact O-N 3.1Å |
| 399 | K | 87 | Confident | 83.6 | Confident | 124 Ų | 124 | 126 Ų | 126 | 54% | 0.539 | 62% | 0.622 | S | S | . | * | H | α-helix | trans | -60.4 | -38.6 | 172.3 | -76.7 | 168.4 | 177.4 | 158.1 | 0 | 113.1 | D395 R397 I401 S402 | D395-K399 WeakPolarHBondContact O-CB 3.33Å; D395-K399 WeakPolarHBondContact O-CG 3.31Å; D395-K399 PolarHBondContact O-N 3.22Å; D395-K399 IonicContact OD1-NZ 2.9Å; D395-K399 WeakPolarHBondContact OD2-CE 3.36Å; D395-K399 IonicContact OD2-NZ 3.64Å; D395-K399 PolarHBondContact OD2-NZ 3.24Å; R397-K399 VanDerWaalsContact C-N 3.33Å; R397-K399 PolarHBondContact O-N 2.88Å; K399-I401 VanDerWaalsContact C-N 3.32Å; K399-I401 PolarHBondContact O-N 3.14Å; K399-S402 PolarHBondContact O-N 3.34Å; K399-S402 PolarHBondContact O-OG 2.93Å |
| 400 | K | 83.2 | Confident | 82.9 | Confident | 163 Ų | 163 | 125.6 Ų | 125.6 | 71% | 0.709 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -68.6 | -26.6 | 175.9 | -75.7 | 177.7 | -178.9 | 177.2 | 0 | 113.7 | Q396 R397 M398 | Q396-K400 WeakPolarHBondContact O-CG 3.41Å; Q396-K400 PolarHBondContact O-N 2.88Å; Q396-K400 VanDerWaalsContact O-N 3.15Å; R397-K400 WeakPolarHBondContact O-CB 3.36Å; R397-K400 PolarHBondContact O-N 3.2Å; R397-K400 VanDerWaalsContact O-N 3.15Å; M398-K400 VanDerWaalsContact C-N 3.33Å; M398-K400 PolarHBondContact O-N 3.47Å |
| 401 | I | 77.4 | Confident | 82.1 | Confident | 140 Ų | 140 | 126.9 Ų | 126.9 | 72% | 0.718 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -85.7 | -22.8 | 177 | -65.4 | 167.8 | 0 | 0 | 0 | 111.6 | R397 M398 K399 K403 | R397-I401 WeakPolarHBondContact O-CG1 3.38Å; R397-I401 PolarHBondContact O-N 3.43Å; R397-I401 VanDerWaalsContact O-N 3.13Å; M398-I401 PolarHBondContact O-N 3.43Å; M398-I401 VanDerWaalsContact O-N 3.17Å; K399-I401 VanDerWaalsContact C-N 3.32Å; K399-I401 PolarHBondContact O-N 3.14Å; I401-K403 PolarHBondContact O-N 3.49Å |
| 402 | S | 57.7 | Low | 81.4 | Confident | 99 Ų | 99 | 125.8 Ų | 125.8 | 69% | 0.692 | 63% | 0.626 | S | S | * | * | trans | -80.1 | 8.7 | 178 | 77.3 | 0 | 0 | 0 | 0 | 115.3 | M398 K399 | M398-S402 PolarHBondContact O-N 3.1Å; K399-S402 PolarHBondContact O-N 3.34Å; K399-S402 PolarHBondContact O-OG 2.93Å | ||
| 403 | K | 47.6 | Very low | 80.5 | Confident | 247 Ų | 247 | 132.4 Ų | 132.4 | 100% | 1.074 | 64% | 0.644 | S | S | * | * | trans | -113.2 | 0 | 167.7 | -94 | -173.5 | 175.1 | -178 | 0 | 108.5 | I401 | I401-K403 PolarHBondContact O-N 3.49Š|
Retrieved 403 of 403 residues in 272.4 ms
(Link to these results)