| 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 | 30.6 | Very low | 28.6 | Very low | 224 Ų | 224 | 135.1 Ų | 135.1 | 100% | 1.103 | 64% | 0.637 | S | S | * | * | 0 | 142.9 | 0 | -64 | 179 | -174.5 | 0 | 0 | 106.5 | |||||
| 2 | F | 25.6 | Very low | 28.5 | Very low | 203 Ų | 203 | 133.8 Ų | 133.8 | 89% | 0.89 | 64% | 0.636 | S | S | * | * | trans | 61.7 | 100.9 | -162.3 | -45.9 | -77.1 | 0 | 0 | 0 | 110.7 | ||||
| 3 | Q | 22.6 | Very low | 28.4 | Very low | 147 Ų | 147 | 137.7 Ų | 137.7 | 69% | 0.687 | 65% | 0.65 | S | S | * | * | cis | 85.5 | 94.9 | 12.3 | -162.1 | 162.3 | 10.8 | 0 | 0 | 117 | ||||
| 4 | E | 32.2 | Very low | 28.3 | Very low | 105 Ų | 105 | 138.6 Ų | 138.6 | 49% | 0.491 | 65% | 0.653 | S | S | . | * | trans | 67.9 | 159.6 | 153.2 | -73.3 | 166.1 | -159.5 | 0 | 0 | 119.3 | R313 | E4-R313 IonicContact OE1-CZ 3.97Å; E4-R313 IonicContact OE1-NH1 2.78Å; E4-R313 PolarHBondContact OE1-NH1 2.88Å; E4-R313 VanDerWaalsContact OE2-CD 3.23Å; E4-R313 WeakPolarHBondContact OE2-CD 3.47Å; E4-R313 IonicContact OE2-CZ 2.98Å; E4-R313 IonicContact OE2-NE 3.38Å; E4-R313 IonicContact OE2-NH1 3.45Å; E4-R313 PolarHBondContact OE2-NH1 3.43Å | ||
| 5 | P | 35.2 | Very low | 28.1 | Very low | 60 Ų | 60 | 140.3 Ų | 140.3 | 39% | 0.39 | 67% | 0.667 | S | S | . | * | cis | -114.4 | 179.2 | -4 | 23.1 | -1.2 | 0 | 0 | 0 | 114.3 | H317 | P5-H317 HydrophobicContact CG-CB 4.15Š| ||
| 6 | V | 29 | Very low | 27.9 | Very low | 108 Ų | 108 | 140.9 Ų | 140.9 | 66% | 0.655 | 68% | 0.675 | S | S | * | * | P | Polyproline II helix | trans | -100.1 | 122.2 | 173.4 | 174.1 | 0 | 0 | 0 | 0 | 108.8 | ||
| 7 | Y | 28.1 | Very low | 27.9 | Very low | 205 Ų | 205 | 139.1 Ų | 139.1 | 80% | 0.804 | 68% | 0.681 | S | S | * | * | P | Polyproline II helix | trans | -63.3 | 136.8 | 176.7 | -86.3 | -92.7 | 0 | 0 | 0 | 111.5 | Q9 | Y7-Q9 PolarHBondContact O-N 2.76Š|
| 8 | F | 28.6 | Very low | 27.9 | Very low | 73 Ų | 73 | 135.8 Ų | 135.8 | 32% | 0.32 | 69% | 0.689 | S | S | . | * | P | Polyproline II helix | trans | -79.7 | 119.2 | -176.8 | -90.4 | -112.8 | 0 | 0 | 0 | 111.2 | I10 V291 E314 | F8-I10 HydrophobicContact CB-CG1 4.43Å; F8-I10 PolarHBondContact O-N 2.83Å; F8-V291 HydrophobicContact CD1-CG2 3.97Å; F8-V291 HydrophobicContact CE1-CB 4.37Å; F8-V291 HydrophobicContact CE1-CG1 3.84Å; F8-V291 HydrophobicContact CE1-CG2 4Å; F8-V291 HydrophobicContact CZ-CG1 4.32Å; F8-E314 HydrophobicContact CD2-CG 4.34Å; F8-E314 HydrophobicContact CE2-CB 4.13Å; F8-E314 HydrophobicContact CE2-CG 3.46Å; F8-E314 VanDerWaalsContact CE2-CG 3.46Å; F8-E314 HydrophobicContact CZ-CG 3.84Å |
| 9 | Q | 27.1 | Very low | 27.9 | Very low | 111 Ų | 111 | 133.8 Ų | 133.8 | 52% | 0.519 | 70% | 0.696 | S | S | . | * | trans | -67.7 | 94.6 | 168.1 | -161.2 | 79.4 | 9 | 0 | 0 | 108.7 | Y7 V510 | Y7-Q9 PolarHBondContact O-N 2.76Å; Q9-V510 HydrophobicContact CG-CG1 4.12Å | ||
| 10 | I | 30.7 | Very low | 28.2 | Very low | 76 Ų | 76 | 134 Ų | 134 | 39% | 0.39 | 71% | 0.709 | S | S | . | * | trans | -93.6 | 121 | 169.6 | -59.1 | -179.8 | 0 | 0 | 0 | 107.3 | F8 L12 F326 | F8-I10 HydrophobicContact CB-CG1 4.43Å; F8-I10 PolarHBondContact O-N 2.83Å; I10-L12 HydrophobicContact CG2-CD1 4.21Å; I10-L12 HydrophobicContact CG2-CG 4.1Å; I10-L12 PolarHBondContact O-N 2.88Å; I10-L12 VanDerWaalsContact O-N 3.1Å; I10-F326 HydrophobicContact CD1-CZ 3.93Å | ||
| 11 | F | 25.5 | Very low | 28.1 | Very low | 174 Ų | 174 | 130.8 Ų | 130.8 | 76% | 0.763 | 71% | 0.708 | S | S | * | * | trans | -69.7 | 103.6 | 169.5 | -82.5 | -93.8 | 0 | 0 | 0 | 109.5 | F13 | F11-F13 HydrophobicContact CD1-CE2 4.48Š| ||
| 12 | L | 26.6 | Very low | 28 | Very low | 119 Ų | 119 | 129 Ų | 129 | 62% | 0.623 | 70% | 0.697 | S | S | * | * | trans | -131.1 | 108 | 162.2 | -77 | 168.9 | 0 | 0 | 0 | 107 | I10 Q14 I325 | I10-L12 HydrophobicContact CG2-CD1 4.21Å; I10-L12 HydrophobicContact CG2-CG 4.1Å; I10-L12 PolarHBondContact O-N 2.88Å; I10-L12 VanDerWaalsContact O-N 3.1Å; L12-Q14 PolarHBondContact O-N 3.01Å; L12-I325 HydrophobicContact CD1-CD1 3.57Å | ||
| 13 | F | 26.9 | Very low | 28.6 | Very low | 185 Ų | 185 | 124.9 Ų | 124.9 | 81% | 0.811 | 69% | 0.69 | S | S | * | * | trans | -69.4 | 111.4 | 173 | -84.5 | -86.4 | 0 | 0 | 0 | 109.3 | F11 L15 | F11-F13 HydrophobicContact CD1-CE2 4.48Å; F13-L15 PolarHBondContact O-N 3.16Å | ||
| 14 | Q | 27.1 | Very low | 28.9 | Very low | 150 Ų | 150 | 120.6 Ų | 120.6 | 70% | 0.701 | 69% | 0.686 | S | S | * | * | trans | -72.4 | 114.4 | 160.7 | -75.7 | -82.6 | 83 | 0 | 0 | 107.8 | L12 | L12-Q14 PolarHBondContact O-N 3.01Š| ||
| 15 | L | 25.8 | Very low | 28.5 | Very low | 164 Ų | 164 | 124.7 Ų | 124.7 | 86% | 0.859 | 71% | 0.705 | S | S | * | * | trans | -83.5 | 124.1 | 164.3 | -78.5 | 171.3 | 0 | 0 | 0 | 108.6 | F13 | F13-L15 PolarHBondContact O-N 3.16Š| ||
| 16 | D | 25.2 | Very low | 28.2 | Very low | 150 Ų | 150 | 127.3 Ų | 127.3 | 80% | 0.802 | 73% | 0.725 | S | S | * | * | trans | -73 | 155.4 | 174.8 | -164.6 | 4.4 | 0 | 0 | 0 | 110.7 | ||||
| 17 | S | 27.1 | Very low | 28.1 | Very low | 111 Ų | 111 | 131.1 Ų | 131.1 | 78% | 0.776 | 74% | 0.74 | S | S | * | * | trans | -155 | 85.7 | 173.8 | -78 | 0 | 0 | 0 | 0 | 109 | A19 | S17-A19 PolarHBondContact O-N 3.05Š| ||
| 18 | G | 28.8 | Very low | 27.9 | Very low | 80 Ų | 80 | 124 Ų | 124 | 83% | 0.825 | 73% | 0.729 | S | S | * | * | trans | -63.9 | 115.3 | -174.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 19 | A | 27.2 | Very low | 28 | Very low | 98 Ų | 98 | 126.6 Ų | 126.6 | 81% | 0.81 | 75% | 0.746 | S | S | * | * | trans | -134.7 | 123.2 | 162.9 | 0 | 0 | 0 | 0 | 0 | 109.1 | S17 | S17-A19 PolarHBondContact O-N 3.05Š| ||
| 20 | S | 34.3 | Very low | 27.8 | Very low | 137 Ų | 137 | 127.8 Ų | 127.8 | 96% | 0.958 | 76% | 0.761 | S | S | * | * | trans | -84 | 132.1 | -176.5 | 178.3 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 21 | G | 27 | Very low | 27.7 | Very low | 67 Ų | 67 | 129.6 Ų | 129.6 | 69% | 0.691 | 77% | 0.77 | S | S | * | * | trans | 170.4 | 76.4 | 172.4 | 0 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 22 | E | 28 | Very low | 27.6 | Very low | 186 Ų | 186 | 125 Ų | 125 | 87% | 0.869 | 77% | 0.772 | S | S | * | * | trans | 59.2 | 156.4 | 157.6 | -77.6 | -73.5 | 99.5 | 0 | 0 | 119.8 | ||||
| 23 | P | 37 | Very low | 27.7 | Very low | 116 Ų | 116 | 126 Ų | 126 | 75% | 0.753 | 77% | 0.771 | S | S | * | * | trans | -95.2 | 114 | -165.6 | 34.7 | -33 | 0 | 0 | 0 | 114.8 | ||||
| 24 | G | 29.3 | Very low | 27.7 | Very low | 58 Ų | 58 | 123.1 Ų | 123.1 | 60% | 0.598 | 78% | 0.775 | S | S | * | * | trans | -177.5 | 111.5 | 167.7 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 25 | H | 24.9 | Very low | 27.6 | Very low | 191 Ų | 191 | 123.9 Ų | 123.9 | 88% | 0.884 | 78% | 0.778 | S | S | * | * | S | Bend | trans | 76.2 | 148.1 | 167.2 | -50.4 | -79.2 | 0 | 0 | 0 | 118.8 | ||
| 26 | S | 28.3 | Very low | 27.6 | Very low | 115 Ų | 115 | 121.9 Ų | 121.9 | 80% | 0.804 | 78% | 0.776 | S | S | * | * | trans | 55.8 | 87.8 | 159.3 | -58.2 | 0 | 0 | 0 | 0 | 119.5 | G28 | S26-G28 PolarHBondContact O-N 2.79Š| ||
| 27 | L | 26.1 | Very low | 27.7 | Very low | 187 Ų | 187 | 117.1 Ų | 117.1 | 98% | 0.979 | 76% | 0.762 | S | S | * | * | trans | -74.9 | 77.5 | 153 | -67.8 | 177.3 | 0 | 0 | 0 | 110.1 | ||||
| 28 | G | 23.9 | Very low | 27.8 | Very low | 55 Ų | 55 | 118.3 Ų | 118.3 | 57% | 0.567 | 76% | 0.76 | S | S | * | * | trans | -93.4 | 134.5 | 168.7 | 0 | 0 | 0 | 0 | 0 | 110.9 | S26 T30 | S26-G28 PolarHBondContact O-N 2.79Å; G28-T30 PolarHBondContact O-N 2.95Å; G28-T30 VanDerWaalsContact O-N 3.11Å | ||
| 29 | L | 30.4 | Very low | 27.7 | Very low | 129 Ų | 129 | 120.2 Ų | 120.2 | 68% | 0.675 | 76% | 0.759 | S | S | * | * | trans | -79.1 | 90.2 | 173.8 | -69.8 | 174.6 | 0 | 0 | 0 | 109.9 | L31 | L29-L31 VanDerWaalsContact C-N 3.34Å; L29-L31 PolarHBondContact O-N 2.9Å | ||
| 30 | T | 23.5 | Very low | 27.7 | Very low | 136 Ų | 136 | 124 Ų | 124 | 83% | 0.834 | 76% | 0.76 | S | S | * | * | trans | -72.5 | 85.8 | 177.6 | -53 | 0 | 0 | 0 | 0 | 110.8 | G28 G32 | G28-T30 PolarHBondContact O-N 2.95Å; G28-T30 VanDerWaalsContact O-N 3.11Å; T30-G32 PolarHBondContact O-N 3.32Å; T30-G32 VanDerWaalsContact O-N 3.08Å | ||
| 31 | L | 28.4 | Very low | 27.3 | Very low | 113 Ų | 113 | 123.4 Ų | 123.4 | 59% | 0.592 | 75% | 0.751 | S | S | * | * | trans | -63.6 | 106.5 | 166.9 | -96.8 | 164.9 | 0 | 0 | 0 | 109.7 | L29 F33 | L29-L31 VanDerWaalsContact C-N 3.34Å; L29-L31 PolarHBondContact O-N 2.9Å; L31-F33 VanDerWaalsContact C-N 3.28Å; L31-F33 HydrophobicContact CB-CD2 4.01Å; L31-F33 HydrophobicContact CB-CE2 3.93Å; L31-F33 HydrophobicContact CD1-CE2 4.36Å; L31-F33 HydrophobicContact CD2-CE2 4.16Å; L31-F33 HydrophobicContact CG-CE2 4.39Å; L31-F33 PolarHBondContact O-N 3.29Å | ||
| 32 | G | 23.2 | Very low | 27.2 | Very low | 77 Ų | 77 | 124.2 Ų | 124.2 | 79% | 0.794 | 75% | 0.751 | S | S | * | * | trans | -69.9 | 71.6 | -176.9 | 0 | 0 | 0 | 0 | 0 | 114.2 | T30 | T30-G32 PolarHBondContact O-N 3.32Å; T30-G32 VanDerWaalsContact O-N 3.08Å | ||
| 33 | F | 30.3 | Very low | 27.1 | Very low | 140 Ų | 140 | 121.4 Ų | 121.4 | 61% | 0.614 | 75% | 0.746 | S | S | * | * | trans | -79.8 | 120.7 | 167.1 | -76.4 | -88.9 | 0 | 0 | 0 | 110.2 | L31 H35 | L31-F33 VanDerWaalsContact C-N 3.28Å; L31-F33 HydrophobicContact CB-CD2 4.01Å; L31-F33 HydrophobicContact CB-CE2 3.93Å; L31-F33 HydrophobicContact CD1-CE2 4.36Å; L31-F33 HydrophobicContact CD2-CE2 4.16Å; L31-F33 HydrophobicContact CG-CE2 4.39Å; L31-F33 PolarHBondContact O-N 3.29Å; F33-H35 PolarHBondContact O-N 2.74Å | ||
| 34 | S | 25.9 | Very low | 26.4 | Very low | 126 Ų | 126 | 122.2 Ų | 122.2 | 88% | 0.881 | 75% | 0.749 | S | S | * | * | trans | -65.2 | 102.2 | 172.1 | -176.6 | 0 | 0 | 0 | 0 | 110.2 | C36 | S34-C36 PolarHBondContact O-N 3Š| ||
| 35 | H | 25.7 | Very low | 26.2 | Very low | 166 Ų | 166 | 124.5 Ų | 124.5 | 77% | 0.769 | 76% | 0.756 | S | S | * | * | trans | -78.4 | 104 | 177 | 175.7 | -87.3 | 0 | 0 | 0 | 109.9 | F33 G37 | F33-H35 PolarHBondContact O-N 2.74Å; H35-G37 VanDerWaalsContact C-N 3.28Å; H35-G37 VanDerWaalsContact CE1-CA 3.5Å; H35-G37 WeakPolarHBondContact CE1-CA 3.31Å; H35-G37 WeakPolarHBondContact ND1-CA 3.49Å; H35-G37 PolarHBondContact O-N 2.66Å | ||
| 36 | C | 24.5 | Very low | 26.3 | Very low | 122 Ų | 122 | 119.6 Ų | 119.6 | 82% | 0.824 | 75% | 0.748 | S | S | * | * | trans | -66.8 | 86.6 | 171.6 | -172 | 0 | 0 | 0 | 0 | 110.3 | S34 N38 | S34-C36 PolarHBondContact O-N 3Å; C36-N38 PolarHBondContact O-N 2.96Å | ||
| 37 | G | 29 | Very low | 26.2 | Very low | 49 Ų | 49 | 122.7 Ų | 122.7 | 51% | 0.505 | 75% | 0.75 | S | S | . | * | trans | -79.6 | 79.1 | -170 | 0 | 0 | 0 | 0 | 0 | 114.2 | H35 | H35-G37 VanDerWaalsContact C-N 3.28Å; H35-G37 VanDerWaalsContact CE1-CA 3.5Å; H35-G37 WeakPolarHBondContact CE1-CA 3.31Å; H35-G37 WeakPolarHBondContact ND1-CA 3.49Å; H35-G37 PolarHBondContact O-N 2.66Å | ||
| 38 | N | 27.3 | Very low | 26.3 | Very low | 136 Ų | 136 | 119.3 Ų | 119.3 | 73% | 0.727 | 74% | 0.739 | S | S | * | * | trans | -155 | 70.4 | 157.4 | -115.4 | -23.4 | 0 | 0 | 0 | 114.9 | C36 | C36-N38 PolarHBondContact O-N 2.96Š| ||
| 39 | C | 26.6 | Very low | 26.5 | Very low | 121 Ų | 121 | 126 Ų | 126 | 82% | 0.818 | 76% | 0.756 | S | S | * | * | trans | -124.7 | 66.9 | 167.9 | -77 | 0 | 0 | 0 | 0 | 111.1 | T41 | C39-T41 PolarHBondContact O-N 3.45Š| ||
| 40 | Q | 28.5 | Very low | 26.3 | Very low | 176 Ų | 176 | 123.4 Ų | 123.4 | 82% | 0.822 | 76% | 0.76 | S | S | * | * | trans | -70.1 | 100.6 | 173.7 | -69.9 | -166.9 | 18 | 0 | 0 | 111.1 | A42 | Q40-A42 PolarHBondContact O-N 3.12Š| ||
| 41 | T | 25.4 | Very low | 26.5 | Very low | 126 Ų | 126 | 126.2 Ų | 126.2 | 77% | 0.773 | 77% | 0.766 | S | S | * | * | trans | -73.8 | 92.1 | 170.9 | -60.7 | 0 | 0 | 0 | 0 | 109.6 | C39 V43 | C39-T41 PolarHBondContact O-N 3.45Å; T41-V43 PolarHBondContact O-N 3.1Å | ||
| 42 | A | 24.7 | Very low | 26.6 | Very low | 83 Ų | 83 | 125.6 Ų | 125.6 | 69% | 0.686 | 78% | 0.777 | S | S | * | * | trans | -68.7 | 98.7 | 179 | 0 | 0 | 0 | 0 | 0 | 111.7 | Q40 V44 | Q40-A42 PolarHBondContact O-N 3.12Å; A42-V44 PolarHBondContact O-N 2.94Å | ||
| 43 | V | 25.5 | Very low | 26.9 | Very low | 128 Ų | 128 | 127.6 Ų | 127.6 | 78% | 0.776 | 78% | 0.779 | S | S | * | * | trans | -73.5 | 88.8 | 173.4 | -177.8 | 0 | 0 | 0 | 0 | 109.6 | T41 S45 | T41-V43 PolarHBondContact O-N 3.1Å; V43-S45 PolarHBondContact O-N 3.03Å | ||
| 44 | V | 23.7 | Very low | 26.9 | Very low | 132 Ų | 132 | 128.4 Ų | 128.4 | 80% | 0.8 | 79% | 0.789 | S | S | * | * | trans | -71.1 | 92.3 | 173.1 | -179.4 | 0 | 0 | 0 | 0 | 109.5 | A42 A46 | A42-V44 PolarHBondContact O-N 2.94Å; V44-A46 PolarHBondContact O-N 3.26Å | ||
| 45 | S | 25.1 | Very low | 27 | Very low | 106 Ų | 106 | 126.1 Ų | 126.1 | 74% | 0.741 | 79% | 0.786 | S | S | * | * | trans | -72.8 | 109.7 | 170.5 | -172.2 | 0 | 0 | 0 | 0 | 110.1 | V43 Q47 | V43-S45 PolarHBondContact O-N 3.03Å; S45-Q47 PolarHBondContact O-N 2.86Å | ||
| 46 | A | 26.3 | Very low | 27.1 | Very low | 89 Ų | 89 | 123 Ų | 123 | 74% | 0.736 | 79% | 0.789 | S | S | * | * | trans | -78.1 | 112.4 | 176 | 0 | 0 | 0 | 0 | 0 | 110.7 | V44 | V44-A46 PolarHBondContact O-N 3.26Š| ||
| 47 | Q | 25 | Very low | 27.3 | Very low | 180 Ų | 180 | 127.9 Ų | 127.9 | 84% | 0.841 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -64.3 | 140.5 | 170.5 | -74.7 | -168.2 | -95.7 | 0 | 0 | 111.9 | S45 | S45-Q47 PolarHBondContact O-N 2.86Š|
| 48 | P | 29.1 | Very low | 27.8 | Very low | 115 Ų | 115 | 131.3 Ų | 131.3 | 75% | 0.747 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -85.9 | 134.7 | 143.8 | 33.1 | -28.1 | 0 | 0 | 0 | 110.3 | ||
| 49 | E | 27.4 | Very low | 27.9 | Very low | 197 Ų | 197 | 128.9 Ų | 128.9 | 92% | 0.921 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -72.2 | 141.5 | 171.1 | -73.2 | 174.2 | 86.9 | 0 | 0 | 111.8 | ||
| 50 | G | 27.9 | Very low | 28 | Very low | 73 Ų | 73 | 131.9 Ų | 131.9 | 75% | 0.753 | 81% | 0.811 | S | S | * | * | trans | 176.4 | 86.5 | 176.8 | 0 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 51 | M | 27.7 | Very low | 28 | Very low | 195 Ų | 195 | 126.3 Ų | 126.3 | 96% | 0.961 | 80% | 0.8 | S | S | * | * | trans | 59.4 | 96 | 149.5 | -65 | -171.8 | 167.9 | 0 | 0 | 121.5 | ||||
| 52 | A | 30.1 | Very low | 28.7 | Very low | 100 Ų | 100 | 127 Ų | 127 | 83% | 0.826 | 81% | 0.807 | S | S | * | * | trans | 0.6 | 142.9 | 140.5 | 0 | 0 | 0 | 0 | 0 | 122.9 | ||||
| 53 | S | 29 | Very low | 28.8 | Very low | 120 Ų | 120 | 126.4 Ų | 126.4 | 84% | 0.839 | 81% | 0.809 | S | S | * | * | -151.2 | 171.7 | 128.6 | -163.2 | 0 | 0 | 0 | 0 | 111 | |||||
| 54 | N | 30.1 | Very low | 29 | Very low | 156 Ų | 156 | 126.6 Ų | 126.6 | 83% | 0.834 | 81% | 0.81 | S | S | * | * | trans | -111.5 | 150.7 | -159.1 | -62.7 | -69.5 | 0 | 0 | 0 | 116.4 | ||||
| 55 | G | 28.9 | Very low | 29.3 | Very low | 78 Ų | 78 | 126.4 Ų | 126.4 | 80% | 0.804 | 81% | 0.81 | S | S | * | * | trans | 89 | 158.5 | 150.5 | 0 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 56 | A | 26.7 | Very low | 29.4 | Very low | 100 Ų | 100 | 125.2 Ų | 125.2 | 83% | 0.826 | 81% | 0.806 | S | S | * | * | cis | -162.1 | 158.1 | -11.5 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 57 | Y | 28.6 | Very low | 29.8 | Very low | 225 Ų | 225 | 128.7 Ų | 128.7 | 88% | 0.882 | 81% | 0.812 | S | S | * | * | trans | -94.7 | 148.9 | 167.8 | -70.1 | -85.4 | 0 | 0 | 0 | 110.8 | ||||
| 58 | P | 40.4 | Very low | 30.6 | Very low | 121 Ų | 121 | 126.1 Ų | 126.1 | 79% | 0.786 | 81% | 0.811 | S | S | * | * | -136.6 | 153.8 | 98.7 | 37 | -25.4 | 0 | 0 | 0 | 112.7 | |||||
| 59 | A | 28.8 | Very low | 30.6 | Very low | 86 Ų | 86 | 123.9 Ų | 123.9 | 71% | 0.711 | 81% | 0.809 | S | S | * | * | cis | 86.7 | 92.3 | 28 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 60 | L | 29.8 | Very low | 30.8 | Very low | 183 Ų | 183 | 120.7 Ų | 120.7 | 96% | 0.958 | 80% | 0.803 | S | S | * | * | trans | -169.3 | 143.5 | 153 | -110.7 | 149.5 | 0 | 0 | 0 | 111.7 | ||||
| 61 | G | 27.7 | Very low | 30.8 | Very low | 59 Ų | 59 | 123.2 Ų | 123.2 | 61% | 0.608 | 81% | 0.81 | S | S | * | * | trans | -144.4 | -153.7 | 168.1 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 62 | P | 41.3 | Very low | 30.9 | Very low | 140 Ų | 140 | 120.7 Ų | 120.7 | 91% | 0.909 | 80% | 0.799 | S | S | * | * | cis | -127 | 177 | -7 | 41.2 | -26.6 | 0 | 0 | 0 | 113.7 | ||||
| 63 | G | 25.9 | Very low | 30.7 | Very low | 71 Ų | 71 | 121.2 Ų | 121.2 | 73% | 0.732 | 80% | 0.796 | S | S | * | * | trans | 178.2 | 80.6 | 173.8 | 0 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 64 | V | 30.6 | Very low | 30.7 | Very low | 132 Ų | 132 | 121.4 Ų | 121.4 | 80% | 0.8 | 79% | 0.792 | S | S | * | * | trans | 9.1 | 125.8 | 141.2 | -171.1 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 65 | T | 28.1 | Very low | 30.5 | Very low | 129 Ų | 129 | 123.2 Ų | 123.2 | 79% | 0.791 | 79% | 0.793 | S | S | * | * | cis | -160.6 | 153.7 | 45.8 | -19.4 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 66 | A | 28.3 | Very low | 30.6 | Very low | 80 Ų | 80 | 125.2 Ų | 125.2 | 66% | 0.661 | 79% | 0.79 | S | S | * | * | trans | 60.4 | 100.9 | 142.6 | 0 | 0 | 0 | 0 | 0 | 123.4 | ||||
| 67 | N | 34.8 | Very low | 30.7 | Very low | 162 Ų | 162 | 124.7 Ų | 124.7 | 87% | 0.866 | 79% | 0.786 | S | S | * | * | trans | 77.6 | 153.9 | 130.3 | -68.8 | 4.5 | 0 | 0 | 0 | 121.9 | ||||
| 68 | P | 40.9 | Very low | 30.8 | Very low | 127 Ų | 127 | 121 Ų | 121 | 83% | 0.825 | 78% | 0.78 | S | S | * | * | trans | -121.4 | 163 | -147.2 | 41.5 | -29.1 | 0 | 0 | 0 | 116.1 | ||||
| 69 | G | 30.1 | Very low | 30.3 | Very low | 68 Ų | 68 | 120.8 Ų | 120.8 | 70% | 0.701 | 78% | 0.779 | S | S | * | * | trans | -178.2 | 143.2 | 164.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 70 | T | 30.7 | Very low | 30.2 | Very low | 130 Ų | 130 | 126.4 Ų | 126.4 | 80% | 0.798 | 79% | 0.788 | S | S | * | * | trans | 60.4 | 84.8 | 165.9 | -39.3 | 0 | 0 | 0 | 0 | 116.9 | L72 | T70-L72 HydrophobicContact CG2-CG 4.48Š| ||
| 71 | S | 28.5 | Very low | 30.1 | Very low | 126 Ų | 126 | 124.3 Ų | 124.3 | 88% | 0.881 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -83.1 | 117.5 | 156.2 | -171.3 | 0 | 0 | 0 | 0 | 109.4 | ||
| 72 | L | 30.4 | Very low | 30.3 | Very low | 142 Ų | 142 | 128 Ų | 128 | 74% | 0.743 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -78.1 | 133.4 | 172.8 | -74.8 | 165.2 | 0 | 0 | 0 | 110.1 | T70 V74 | T70-L72 HydrophobicContact CG2-CG 4.48Å; L72-V74 PolarHBondContact O-N 3.34Å |
| 73 | S | 25.9 | Very low | 29.8 | Very low | 110 Ų | 110 | 126.9 Ų | 126.9 | 77% | 0.769 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -67.9 | 117.7 | 171.2 | -173.7 | 0 | 0 | 0 | 0 | 110.1 | F75 | S73-F75 PolarHBondContact O-N 3.46Š|
| 74 | V | 27.9 | Very low | 29.9 | Very low | 124 Ų | 124 | 128 Ų | 128 | 75% | 0.752 | 79% | 0.789 | S | S | * | * | trans | -89.8 | 97 | 179.7 | -179.7 | 0 | 0 | 0 | 0 | 109.5 | L72 | L72-V74 PolarHBondContact O-N 3.34Š| ||
| 75 | F | 26.8 | Very low | 30.2 | Very low | 195 Ų | 195 | 128.2 Ų | 128.2 | 86% | 0.855 | 79% | 0.793 | S | S | * | * | trans | -88.7 | 113.7 | 167.3 | -120 | -87.6 | 0 | 0 | 0 | 110.4 | S73 A77 | S73-F75 PolarHBondContact O-N 3.46Å; F75-A77 PolarHBondContact O-N 3.2Å | ||
| 76 | T | 30.1 | Very low | 30.1 | Very low | 120 Ų | 120 | 125.4 Ų | 125.4 | 74% | 0.736 | 79% | 0.79 | S | S | * | * | trans | -77.6 | 100.1 | -178.3 | -54.3 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 77 | A | 29.2 | Very low | 30.5 | Very low | 89 Ų | 89 | 127.4 Ų | 127.4 | 74% | 0.736 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -90.7 | 131.7 | 168 | 0 | 0 | 0 | 0 | 0 | 111 | F75 | F75-A77 PolarHBondContact O-N 3.2Š|
| 78 | L | 30.2 | Very low | 30.4 | Very low | 146 Ų | 146 | 124.3 Ų | 124.3 | 76% | 0.764 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -72.4 | 137 | 171.1 | -95.1 | 72.6 | 0 | 0 | 0 | 110.5 | ||
| 79 | P | 31.1 | Very low | 29.9 | Very low | 118 Ų | 118 | 126.9 Ų | 126.9 | 77% | 0.766 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -76 | 129.1 | 170.8 | 30.7 | -32.8 | 0 | 0 | 0 | 111 | ||
| 80 | F | 26.4 | Very low | 30.2 | Very low | 203 Ų | 203 | 127.1 Ų | 127.1 | 89% | 0.89 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -72.9 | 145 | 168 | -72.3 | -91.8 | 0 | 0 | 0 | 110.7 | ||
| 81 | T | 27.8 | Very low | 30.2 | Very low | 139 Ų | 139 | 127.4 Ų | 127.4 | 85% | 0.853 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -91.5 | 130 | -178.8 | 43 | 0 | 0 | 0 | 0 | 112.6 | ||
| 82 | T | 30.3 | Very low | 30.2 | Very low | 137 Ų | 137 | 129.8 Ų | 129.8 | 84% | 0.84 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -84.2 | 130.7 | -177.1 | -39.8 | 0 | 0 | 0 | 0 | 112.5 | ||
| 83 | P | 32.6 | Very low | 30.2 | Very low | 116 Ų | 116 | 130.3 Ų | 130.3 | 75% | 0.753 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -74.6 | 147.1 | 166.2 | -15.2 | 31.1 | 0 | 0 | 0 | 112.5 | ||
| 84 | A | 27.3 | Very low | 30.3 | Very low | 95 Ų | 95 | 131.5 Ų | 131.5 | 79% | 0.785 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -80.9 | 154.5 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||
| 85 | P | 35.9 | Very low | 30.3 | Very low | 137 Ų | 137 | 131.3 Ų | 131.3 | 89% | 0.89 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -79.7 | 148.3 | -173.1 | 31.5 | -36 | 0 | 0 | 0 | 114.5 | ||
| 86 | G | 26 | Very low | 30.2 | Very low | 70 Ų | 70 | 126.9 Ų | 126.9 | 72% | 0.722 | 81% | 0.806 | S | S | * | * | trans | -127.1 | 161.8 | 170.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 87 | P | 36.8 | Very low | 29.9 | Very low | 122 Ų | 122 | 125 Ų | 125 | 79% | 0.792 | 81% | 0.81 | S | S | * | * | trans | -81.2 | 155 | -158.7 | 31.6 | -36.8 | 0 | 0 | 0 | 115.4 | ||||
| 88 | A | 34.4 | Very low | 29.9 | Very low | 97 Ų | 97 | 125.3 Ų | 125.3 | 80% | 0.802 | 81% | 0.812 | S | S | * | * | trans | -85.5 | 137.3 | -179 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 89 | H | 30.3 | Very low | 31.2 | Very low | 181 Ų | 181 | 124 Ų | 124 | 84% | 0.838 | 81% | 0.813 | S | S | * | * | trans | -130.6 | 125.9 | 161.6 | -69.7 | -70.3 | 0 | 0 | 0 | 108.8 | ||||
| 90 | G | 34.8 | Very low | 31.8 | Very low | 73 Ų | 73 | 124.6 Ų | 124.6 | 75% | 0.753 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -86 | 159.7 | 178.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||
| 91 | P | 32.3 | Very low | 31.9 | Very low | 136 Ų | 136 | 118.8 Ų | 118.8 | 88% | 0.883 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -82.3 | 149.9 | 179.2 | 33.1 | -34.4 | 0 | 0 | 0 | 113.3 | ||
| 92 | L | 27 | Very low | 31.9 | Very low | 175 Ų | 175 | 115.6 Ų | 115.6 | 92% | 0.916 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -96.2 | 159.1 | 175.8 | -163.2 | 73.9 | 0 | 0 | 0 | 110.9 | ||
| 93 | L | 30.6 | Very low | 32.1 | Very low | 154 Ų | 154 | 115.1 Ų | 115.1 | 81% | 0.806 | 81% | 0.808 | S | S | * | * | trans | -82.3 | 177.6 | 170.1 | -81.5 | 165.1 | 0 | 0 | 0 | 112.7 | ||||
| 94 | V | 29.3 | Very low | 31.9 | Very low | 134 Ų | 134 | 117.3 Ų | 117.3 | 81% | 0.812 | 81% | 0.812 | S | S | * | * | trans | 89.2 | 135.2 | 162.8 | -177.1 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 95 | T | 26.1 | Very low | 32.1 | Very low | 120 Ų | 120 | 119.6 Ų | 119.6 | 74% | 0.736 | 82% | 0.817 | S | S | * | * | cis | -169.3 | 144.6 | -22.1 | -91.6 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 96 | A | 25.7 | Very low | 31.7 | Very low | 103 Ų | 103 | 120 Ų | 120 | 85% | 0.851 | 81% | 0.811 | S | S | * | * | trans | 52.2 | 147.2 | 154.9 | 0 | 0 | 0 | 0 | 0 | 124.2 | ||||
| 97 | G | 23.6 | Very low | 31.6 | Very low | 79 Ų | 79 | 121.8 Ų | 121.8 | 81% | 0.814 | 81% | 0.812 | S | S | * | * | trans | -165 | 113.2 | 155.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 98 | A | 28.9 | Very low | 31.1 | Very low | 96 Ų | 96 | 122.9 Ų | 122.9 | 79% | 0.793 | 81% | 0.811 | S | S | * | * | trans | -174 | 170.7 | -179.2 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 99 | P | 57.9 | Low | 30.7 | Very low | 120 Ų | 120 | 127.2 Ų | 127.2 | 78% | 0.779 | 81% | 0.812 | S | S | * | * | cis | -114.4 | -143.9 | -20.5 | 36.4 | -15.8 | 0 | 0 | 0 | 109.2 | ||||
| 100 | P | 43.8 | Very low | 30.7 | Very low | 129 Ų | 129 | 124.3 Ų | 124.3 | 84% | 0.838 | 81% | 0.809 | S | S | * | * | -140.3 | 171.2 | 50.3 | 40.4 | -21.2 | 0 | 0 | 0 | 116.5 | |||||
| 101 | G | 27.5 | Very low | 30.4 | Very low | 81 Ų | 81 | 125.8 Ų | 125.8 | 84% | 0.835 | 81% | 0.808 | S | S | * | * | trans | 131.3 | 77.9 | 161.7 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 102 | G | 28.2 | Very low | 30.5 | Very low | 72 Ų | 72 | 125.7 Ų | 125.7 | 74% | 0.742 | 81% | 0.805 | S | S | * | * | trans | -88.6 | -167.6 | 168.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 103 | P | 34.7 | Very low | 30.6 | Very low | 128 Ų | 128 | 123.1 Ų | 123.1 | 83% | 0.831 | 80% | 0.799 | S | S | * | * | cis | -110.4 | 156.5 | 22.3 | 38.8 | -32.8 | 0 | 0 | 0 | 115.7 | ||||
| 104 | L | 28.6 | Very low | 30.5 | Very low | 161 Ų | 161 | 123.2 Ų | 123.2 | 84% | 0.843 | 80% | 0.8 | S | S | * | * | trans | -100.1 | 147.3 | 163.9 | -69.3 | 166.6 | 0 | 0 | 0 | 109.6 | ||||
| 105 | V | 30.6 | Very low | 30.5 | Very low | 144 Ų | 144 | 123.6 Ų | 123.6 | 87% | 0.873 | 80% | 0.802 | S | S | * | * | trans | -116.5 | 135.2 | 161.7 | 179.9 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 106 | L | 28 | Very low | 30.7 | Very low | 146 Ų | 146 | 123.4 Ų | 123.4 | 76% | 0.764 | 80% | 0.8 | S | S | * | * | trans | -110.2 | 160.1 | -174.1 | -73.5 | 169 | 0 | 0 | 0 | 111.6 | ||||
| 107 | S | 24.2 | Very low | 30.7 | Very low | 106 Ų | 106 | 127 Ų | 127 | 74% | 0.741 | 80% | 0.8 | S | S | * | * | trans | 71.7 | 159.5 | 157.7 | -75.8 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 108 | N | 25.6 | Very low | 30.9 | Very low | 145 Ų | 145 | 130.9 Ų | 130.9 | 78% | 0.775 | 80% | 0.797 | S | S | * | * | cis | -145.8 | 160.5 | 12.9 | -132.6 | -11.3 | 0 | 0 | 0 | 113.4 | ||||
| 109 | F | 26.3 | Very low | 31 | Very low | 188 Ų | 188 | 133.2 Ų | 133.2 | 83% | 0.825 | 80% | 0.796 | S | S | * | * | trans | -70.3 | 144 | 156.3 | -82.9 | -103.3 | 0 | 0 | 0 | 109.5 | ||||
| 110 | P | 30.6 | Very low | 29.7 | Very low | 121 Ų | 121 | 130.5 Ų | 130.5 | 79% | 0.786 | 79% | 0.79 | S | S | * | * | trans | -85 | 132.9 | 168 | 32.5 | -30.2 | 0 | 0 | 0 | 110.9 | ||||
| 111 | S | 28.6 | Very low | 29.1 | Very low | 104 Ų | 104 | 131.3 Ų | 131.3 | 73% | 0.727 | 80% | 0.797 | S | S | * | * | trans | -144.2 | 129.2 | 167.7 | -74 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 112 | T | 33.7 | Very low | 29.1 | Very low | 134 Ų | 134 | 130.7 Ų | 130.7 | 82% | 0.822 | 79% | 0.791 | S | S | * | * | trans | 56.3 | 159.6 | 165.3 | 58.4 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 113 | P | 30.1 | Very low | 30.4 | Very low | 121 Ų | 121 | 133.8 Ų | 133.8 | 79% | 0.786 | 80% | 0.798 | S | S | * | * | -125.8 | 168.2 | 109 | 37.7 | -33.4 | 0 | 0 | 0 | 114.5 | |||||
| 114 | L | 28.3 | Very low | 30.2 | Very low | 156 Ų | 156 | 134 Ų | 134 | 82% | 0.817 | 80% | 0.802 | S | S | * | * | trans | -51.4 | 150.5 | -168 | -63 | 68.2 | 0 | 0 | 0 | 117.6 | ||||
| 115 | V | 28.4 | Very low | 30.2 | Very low | 141 Ų | 141 | 129.4 Ų | 129.4 | 86% | 0.855 | 79% | 0.794 | S | S | * | * | -131.6 | 129.5 | 125.3 | 175.6 | 0 | 0 | 0 | 0 | 109.7 | |||||
| 116 | T | 31 | Very low | 30.3 | Very low | 116 Ų | 116 | 128 Ų | 128 | 71% | 0.712 | 80% | 0.798 | S | S | * | * | trans | 7.2 | 114.5 | 163.1 | -33.1 | 0 | 0 | 0 | 0 | 121.6 | ||||
| 117 | E | 25.7 | Very low | 30.2 | Very low | 179 Ų | 179 | 125 Ų | 125 | 84% | 0.836 | 80% | 0.801 | S | S | * | * | 8.5 | 133.7 | 124.3 | -177.1 | 177.5 | -171.1 | 0 | 0 | 120.2 | |||||
| 118 | Q | 27.8 | Very low | 30.6 | Very low | 161 Ų | 161 | 124.8 Ų | 124.8 | 75% | 0.752 | 81% | 0.807 | S | S | * | * | 170.1 | 133 | 120.5 | 180 | 161.4 | 6 | 0 | 0 | 112.7 | |||||
| 119 | D | 31.1 | Very low | 30.5 | Very low | 144 Ų | 144 | 123 Ų | 123 | 77% | 0.77 | 81% | 0.805 | S | S | * | * | trans | 45.6 | 149.2 | 162.5 | -59.2 | -35 | 0 | 0 | 0 | 120.9 | ||||
| 120 | G | 30.2 | Very low | 30.5 | Very low | 64 Ų | 64 | 121.1 Ų | 121.1 | 66% | 0.66 | 80% | 0.804 | S | S | * | * | cis | 165.6 | 151 | -3.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 121 | C | 31 | Very low | 30.4 | Very low | 145 Ų | 145 | 120.9 Ų | 120.9 | 98% | 0.98 | 80% | 0.8 | S | S | * | * | trans | 68.8 | 148.6 | 175.3 | -72.5 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 122 | G | 28.7 | Very low | 30.2 | Very low | 69 Ų | 69 | 126 Ų | 126 | 71% | 0.711 | 81% | 0.809 | S | S | * | * | trans | -123.3 | -133.7 | 169.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 123 | P | 55.6 | Low | 30 | Very low | 136 Ų | 136 | 125.8 Ų | 125.8 | 88% | 0.883 | 81% | 0.808 | S | S | * | * | -121.4 | 148.4 | -92.7 | 37.9 | -31.7 | 0 | 0 | 0 | 115.3 | |||||
| 124 | S | 29.8 | Very low | 29.8 | Very low | 132 Ų | 132 | 129.3 Ų | 129.3 | 92% | 0.923 | 81% | 0.814 | S | S | * | * | trans | -167.6 | 155.3 | 164.1 | -161.8 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 125 | G | 29.6 | Very low | 29.6 | Very low | 66 Ų | 66 | 129.6 Ų | 129.6 | 68% | 0.68 | 81% | 0.813 | S | S | * | * | cis | -167.3 | -176.9 | 1.8 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 126 | A | 31.2 | Very low | 29.4 | Very low | 114 Ų | 114 | 134.3 Ų | 134.3 | 94% | 0.942 | 82% | 0.815 | S | S | * | * | trans | -84.4 | 153 | -174 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 127 | G | 27.6 | Very low | 29.3 | Very low | 82 Ų | 82 | 133.8 Ų | 133.8 | 85% | 0.845 | 81% | 0.812 | S | S | * | * | trans | -173.5 | 127.5 | 169.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 128 | A | 30.8 | Very low | 29.3 | Very low | 103 Ų | 103 | 134.7 Ų | 134.7 | 85% | 0.851 | 82% | 0.816 | S | S | * | * | trans | -141.4 | 134.7 | 178.3 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 129 | S | 23.8 | Very low | 29.3 | Very low | 107 Ų | 107 | 133.4 Ų | 133.4 | 75% | 0.748 | 82% | 0.819 | S | S | * | * | trans | -179.8 | 115.5 | 151.8 | 51.1 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 130 | N | 27.2 | Very low | 29.3 | Very low | 149 Ų | 149 | 129.9 Ų | 129.9 | 80% | 0.797 | 82% | 0.817 | S | S | * | * | 44.5 | 119 | 125.9 | -51.9 | -15.1 | 0 | 0 | 0 | 121.6 | |||||
| 131 | V | 27.6 | Very low | 29.4 | Very low | 116 Ų | 116 | 133.2 Ų | 133.2 | 70% | 0.703 | 83% | 0.827 | S | S | * | * | 58.9 | 124.5 | 122.9 | 178.9 | 0 | 0 | 0 | 0 | 119.6 | |||||
| 132 | F | 26 | Very low | 29.5 | Very low | 210 Ų | 210 | 133.1 Ų | 133.1 | 92% | 0.921 | 82% | 0.822 | S | S | * | * | -154.8 | 139.4 | 119.9 | -96.7 | -64.8 | 0 | 0 | 0 | 111.9 | |||||
| 133 | V | 29.5 | Very low | 29.3 | Very low | 131 Ų | 131 | 139.5 Ų | 139.5 | 79% | 0.794 | 83% | 0.83 | S | S | * | * | trans | -100.4 | 136.5 | 168.9 | 171.4 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 134 | Q | 24.5 | Very low | 28 | Very low | 195 Ų | 195 | 137.8 Ų | 137.8 | 91% | 0.911 | 83% | 0.827 | S | S | * | * | trans | -122.1 | 109.8 | 170.1 | -167.4 | 170 | 30.9 | 0 | 0 | 111 | ||||
| 135 | M | 23.7 | Very low | 27.8 | Very low | 162 Ų | 162 | 136.3 Ų | 136.3 | 80% | 0.798 | 82% | 0.823 | S | S | * | * | trans | -101.1 | 139.1 | 171.3 | 177.1 | -179.6 | 173.3 | 0 | 0 | 108.7 | ||||
| 136 | R | 25.1 | Very low | 27.7 | Very low | 239 Ų | 239 | 140.9 Ų | 140.9 | 90% | 0.902 | 83% | 0.826 | S | S | * | * | trans | -144.8 | 140.2 | 163.9 | 82.7 | -177.8 | -158.5 | -167.2 | 6 | 110.5 | ||||
| 137 | T | 28.8 | Very low | 27.5 | Very low | 106 Ų | 106 | 139.9 Ų | 139.9 | 65% | 0.65 | 82% | 0.818 | S | S | * | * | trans | -136.4 | 131.3 | -177.5 | -56.4 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 138 | E | 25 | Very low | 27.6 | Very low | 197 Ų | 197 | 143.6 Ų | 143.6 | 92% | 0.921 | 81% | 0.814 | S | S | * | * | trans | -153.6 | 163.3 | 159.9 | -135 | 175.3 | 169.4 | 0 | 0 | 110 | ||||
| 139 | V | 28.6 | Very low | 27.4 | Very low | 134 Ų | 134 | 145 Ų | 145 | 81% | 0.812 | 81% | 0.811 | S | S | * | * | trans | -130 | 123.4 | -147.9 | 175.1 | 0 | 0 | 0 | 0 | 115 | ||||
| 140 | G | 31.6 | Very low | 27.5 | Very low | 70 Ų | 70 | 147.5 Ų | 147.5 | 72% | 0.722 | 82% | 0.816 | S | S | * | * | trans | 76.7 | 176.4 | 154 | 0 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 141 | P | 32.1 | Very low | 27.5 | Very low | 134 Ų | 134 | 146 Ų | 146 | 87% | 0.87 | 81% | 0.812 | S | S | * | * | cis | -116.4 | -174.5 | -0.2 | 41.1 | -29.2 | 0 | 0 | 0 | 114.4 | ||||
| 142 | V | 32.9 | Very low | 27.3 | Very low | 143 Ų | 143 | 148 Ų | 148 | 87% | 0.867 | 82% | 0.818 | S | S | * | * | trans | -90.9 | 137.5 | -169.7 | 175.7 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 143 | K | 23.5 | Very low | 27.3 | Very low | 204 Ų | 204 | 143.4 Ų | 143.4 | 89% | 0.887 | 81% | 0.807 | S | S | * | * | trans | -155.1 | 149.6 | 140.4 | -145.3 | 169.6 | -173.9 | 176.5 | 0 | 112.4 | ||||
| 144 | A | 29 | Very low | 27.3 | Very low | 100 Ų | 100 | 145.9 Ų | 145.9 | 83% | 0.826 | 81% | 0.81 | S | S | * | * | trans | -92 | 150.7 | -171.9 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 145 | A | 26.5 | Very low | 27.3 | Very low | 100 Ų | 100 | 142.2 Ų | 142.2 | 83% | 0.826 | 80% | 0.801 | S | S | * | * | trans | -161.5 | 149.5 | 168.3 | 0 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 146 | Q | 27.2 | Very low | 27.5 | Very low | 162 Ų | 162 | 140.3 Ų | 140.3 | 76% | 0.757 | 80% | 0.801 | S | S | * | * | cis | -157.5 | 142.3 | -15.1 | 171.8 | 179.4 | 1.8 | 0 | 0 | 106.1 | Q148 | Q146-Q148 PolarHBondContact O-N 3.21Š| ||
| 147 | A | 27.1 | Very low | 27.6 | Very low | 94 Ų | 94 | 137.4 Ų | 137.4 | 78% | 0.777 | 80% | 0.802 | S | S | * | * | trans | -63.3 | 126.9 | 179 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 148 | Q | 28.8 | Very low | 27.5 | Very low | 160 Ų | 160 | 137.7 Ų | 137.7 | 75% | 0.748 | 80% | 0.803 | S | S | * | * | trans | -130.8 | 103.1 | 168.1 | -66.9 | -166.7 | 16.8 | 0 | 0 | 109.3 | Q146 L150 | Q146-Q148 PolarHBondContact O-N 3.21Å; Q148-L150 PolarHBondContact O-N 2.91Å | ||
| 149 | T | 26.9 | Very low | 27.5 | Very low | 131 Ų | 131 | 139.6 Ų | 139.6 | 80% | 0.804 | 80% | 0.802 | S | S | * | * | trans | -68 | 112.4 | 173.7 | -54.2 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 150 | L | 25.3 | Very low | 27.6 | Very low | 160 Ų | 160 | 140.7 Ų | 140.7 | 84% | 0.838 | 80% | 0.798 | S | S | * | * | trans | -105.9 | 114 | 166.6 | -94.8 | 163.1 | 0 | 0 | 0 | 109.1 | Q148 L152 | Q148-L150 PolarHBondContact O-N 2.91Å; L150-L152 PolarHBondContact O-N 3.36Å | ||
| 151 | V | 27.2 | Very low | 27.5 | Very low | 117 Ų | 117 | 141.2 Ų | 141.2 | 71% | 0.709 | 80% | 0.796 | S | S | * | * | trans | -71.2 | 113.1 | -179.4 | 176.8 | 0 | 0 | 0 | 0 | 108.9 | T153 | V151-T153 HydrophobicContact CG1-CG2 4.4Å; V151-T153 PolarHBondContact O-N 3.24Å; V151-T153 VanDerWaalsContact O-N 3.08Å | ||
| 152 | L | 23.8 | Very low | 27.5 | Very low | 159 Ų | 159 | 141 Ų | 141 | 83% | 0.832 | 80% | 0.795 | S | S | * | * | trans | -78.8 | 90.1 | 173.9 | -164.4 | 75.8 | 0 | 0 | 0 | 109.6 | L150 Q154 | L150-L152 PolarHBondContact O-N 3.36Å; L152-Q154 PolarHBondContact O-N 3.11Å; L152-Q154 VanDerWaalsContact O-N 3.08Å | ||
| 153 | T | 26.3 | Very low | 27.4 | Very low | 114 Ų | 114 | 138 Ų | 138 | 70% | 0.699 | 79% | 0.793 | S | S | * | * | trans | -64.2 | 107 | 171.7 | 47.4 | 0 | 0 | 0 | 0 | 109.9 | V151 T155 | V151-T153 HydrophobicContact CG1-CG2 4.4Å; V151-T153 PolarHBondContact O-N 3.24Å; V151-T153 VanDerWaalsContact O-N 3.08Å; T153-T155 PolarHBondContact O-N 3.24Å | ||
| 154 | Q | 29.7 | Very low | 27.7 | Very low | 183 Ų | 183 | 133.2 Ų | 133.2 | 86% | 0.855 | 79% | 0.791 | S | S | * | * | trans | -69.5 | 128.7 | 173.1 | -67.6 | -140.3 | 68.6 | 0 | 0 | 110.9 | L152 | L152-Q154 PolarHBondContact O-N 3.11Å; L152-Q154 VanDerWaalsContact O-N 3.08Å | ||
| 155 | T | 24.4 | Very low | 28 | Very low | 118 Ų | 118 | 136.8 Ų | 136.8 | 72% | 0.724 | 80% | 0.796 | S | S | * | * | trans | -130.8 | 133.5 | 161.2 | 45.1 | 0 | 0 | 0 | 0 | 108 | T153 L157 | T153-T155 PolarHBondContact O-N 3.24Å; T155-L157 PolarHBondContact O-N 2.89Å | ||
| 156 | P | 27.2 | Very low | 28.1 | Very low | 121 Ų | 121 | 138.3 Ų | 138.3 | 79% | 0.786 | 80% | 0.799 | S | S | * | * | trans | -71.6 | 128.4 | -166.5 | 27.7 | -34.9 | 0 | 0 | 0 | 112 | V158 | P156-V158 PolarHBondContact O-N 3.35Š| ||
| 157 | L | 27.1 | Very low | 28.3 | Very low | 178 Ų | 178 | 134.6 Ų | 134.6 | 93% | 0.932 | 80% | 0.804 | S | S | * | * | trans | -81.9 | 102.4 | 172.4 | -143.7 | 78.4 | 0 | 0 | 0 | 109 | T155 W159 | T155-L157 PolarHBondContact O-N 2.89Å; L157-W159 PolarHBondContact O-N 3.01Å | ||
| 158 | V | 27.6 | Very low | 28.4 | Very low | 112 Ų | 112 | 133.9 Ų | 133.9 | 68% | 0.679 | 81% | 0.806 | S | S | * | * | trans | -65.3 | 115.1 | 178.5 | 177.4 | 0 | 0 | 0 | 0 | 109.7 | P156 Q160 | P156-V158 PolarHBondContact O-N 3.35Å; V158-Q160 PolarHBondContact O-N 3.39Å | ||
| 159 | W | 25.5 | Very low | 28.4 | Very low | 238 Ų | 238 | 133.3 Ų | 133.3 | 90% | 0.902 | 81% | 0.812 | S | S | * | * | trans | -69.6 | 113.3 | 176.9 | -173.2 | -99.4 | 0 | 0 | 0 | 110.6 | L157 | L157-W159 PolarHBondContact O-N 3.01Š| ||
| 160 | Q | 29.6 | Very low | 28.7 | Very low | 156 Ų | 156 | 133.8 Ų | 133.8 | 73% | 0.729 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -87.2 | 130.8 | -179 | -70.3 | -72.3 | 3.9 | 0 | 0 | 111.1 | V158 | V158-Q160 PolarHBondContact O-N 3.39Š|
| 161 | A | 29.8 | Very low | 28.8 | Very low | 81 Ų | 81 | 131.8 Ų | 131.8 | 67% | 0.669 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -73.4 | 147.8 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | G163 | A161-G163 PolarHBondContact O-N 3.23Š|
| 162 | P | 33.2 | Very low | 29.3 | Very low | 131 Ų | 131 | 131.6 Ų | 131.6 | 85% | 0.851 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -63.3 | 125.1 | 178 | -22.6 | 34.3 | 0 | 0 | 0 | 112.8 | ||
| 163 | G | 29.4 | Very low | 29.7 | Very low | 79 Ų | 79 | 129.6 Ų | 129.6 | 81% | 0.814 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -78.6 | 137.4 | -176.1 | 0 | 0 | 0 | 0 | 0 | 114.3 | A161 | A161-G163 PolarHBondContact O-N 3.23Š|
| 164 | A | 30.2 | Very low | 30 | Very low | 104 Ų | 104 | 130.3 Ų | 130.3 | 86% | 0.86 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -88.6 | 133.4 | 167 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||
| 165 | L | 34.4 | Very low | 30.1 | Very low | 175 Ų | 175 | 129.9 Ų | 129.9 | 92% | 0.916 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -82 | 119.2 | 176 | -73.6 | 172.5 | 0 | 0 | 0 | 111.1 | ||
| 166 | C | 29.8 | Very low | 30.4 | Very low | 132 Ų | 132 | 132 Ų | 132 | 89% | 0.892 | 83% | 0.826 | S | S | * | * | trans | -144.5 | 149.6 | 160.9 | -94.7 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 167 | G | 31.4 | Very low | 30.6 | Very low | 84 Ų | 84 | 134.6 Ų | 134.6 | 87% | 0.866 | 83% | 0.833 | S | S | * | * | trans | -69.2 | 145.1 | -171.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 168 | G | 28.3 | Very low | 30.6 | Very low | 79 Ų | 79 | 130.6 Ų | 130.6 | 81% | 0.814 | 83% | 0.825 | S | S | * | * | trans | -89 | 159.4 | -175.2 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 169 | V | 28.9 | Very low | 30.6 | Very low | 147 Ų | 147 | 130.3 Ų | 130.3 | 89% | 0.891 | 84% | 0.835 | S | S | * | * | trans | -130.9 | 138.7 | 158.2 | 178.1 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 170 | V | 33 | Very low | 30.7 | Very low | 141 Ų | 141 | 123.7 Ų | 123.7 | 86% | 0.855 | 83% | 0.831 | S | S | * | * | trans | -90.4 | 133.3 | -175 | 176.1 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 171 | C | 28.3 | Very low | 31 | Very low | 118 Ų | 118 | 121.7 Ų | 121.7 | 80% | 0.797 | 83% | 0.831 | S | S | * | * | trans | -148 | 150.2 | 159.4 | -109.6 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 172 | P | 37.3 | Very low | 31 | Very low | 113 Ų | 113 | 124.2 Ų | 124.2 | 73% | 0.734 | 84% | 0.838 | S | S | * | * | P | Polyproline II helix | trans | -87.3 | 163.8 | -171.4 | 35.2 | -36.7 | 0 | 0 | 0 | 114.4 | ||
| 173 | P | 31.6 | Very low | 30.8 | Very low | 118 Ų | 118 | 124 Ų | 124 | 77% | 0.766 | 83% | 0.834 | S | S | * | * | P | Polyproline II helix | trans | -86.7 | 147.3 | -174 | 34 | -35.9 | 0 | 0 | 0 | 114.5 | ||
| 174 | P | 33.7 | Very low | 31.3 | Very low | 128 Ų | 128 | 125.5 Ų | 125.5 | 83% | 0.831 | 83% | 0.829 | S | S | * | * | P | Polyproline II helix | trans | -74.6 | 155.9 | 160.4 | -11.8 | 28.9 | 0 | 0 | 0 | 112.3 | ||
| 175 | L | 32.3 | Very low | 31.1 | Very low | 175 Ų | 175 | 126.5 Ų | 126.5 | 92% | 0.916 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -91.9 | 161.8 | -177.3 | -76.9 | 162.8 | 0 | 0 | 0 | 113.8 | ||
| 176 | L | 29.7 | Very low | 30.9 | Very low | 161 Ų | 161 | 126.2 Ų | 126.2 | 84% | 0.843 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -67.1 | 150.5 | 175.2 | -63.4 | 166.4 | 0 | 0 | 0 | 113.1 | ||
| 177 | L | 30.9 | Very low | 30.7 | Very low | 177 Ų | 177 | 123.8 Ų | 123.8 | 93% | 0.927 | 81% | 0.81 | S | S | * | * | trans | 158.2 | 149.6 | 146.1 | -105.8 | 83.3 | 0 | 0 | 0 | 107.4 | ||||
| 178 | A | 26.9 | Very low | 30.4 | Very low | 93 Ų | 93 | 123.9 Ų | 123.9 | 77% | 0.769 | 80% | 0.802 | S | S | * | * | cis | -157.5 | 167.4 | -16.6 | 0 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 179 | A | 29.2 | Very low | 30.4 | Very low | 107 Ų | 107 | 128.3 Ų | 128.3 | 88% | 0.884 | 80% | 0.802 | S | S | * | * | trans | -92.5 | 149.9 | -176.8 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 180 | A | 27 | Very low | 30.2 | Very low | 99 Ų | 99 | 126.9 Ų | 126.9 | 82% | 0.818 | 79% | 0.793 | S | S | * | * | trans | -152.1 | 155.6 | 162.8 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 181 | P | 36.3 | Very low | 29.9 | Very low | 114 Ų | 114 | 127 Ų | 127 | 74% | 0.74 | 79% | 0.794 | S | S | * | * | trans | -125 | 158.8 | -153.5 | 40.3 | -26.2 | 0 | 0 | 0 | 117.8 | ||||
| 182 | V | 28.9 | Very low | 29.7 | Very low | 133 Ų | 133 | 124.8 Ų | 124.8 | 81% | 0.806 | 79% | 0.791 | S | S | * | * | trans | 58.6 | 113.9 | 140 | 174.6 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 183 | V | 29.8 | Very low | 29.2 | Very low | 128 Ų | 128 | 122.7 Ų | 122.7 | 78% | 0.776 | 79% | 0.79 | S | S | * | * | trans | -8 | 159.1 | 142 | -117.3 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 184 | P | 39.3 | Very low | 29.2 | Very low | 109 Ų | 109 | 124 Ų | 124 | 71% | 0.708 | 80% | 0.796 | S | S | * | * | cis | -152.4 | -172.3 | 24.7 | 44.1 | -21.6 | 0 | 0 | 0 | 120.2 | ||||
| 185 | V | 25.8 | Very low | 29.1 | Very low | 125 Ų | 125 | 127.2 Ų | 127.2 | 76% | 0.758 | 80% | 0.8 | S | S | * | * | trans | 87.2 | 120.1 | 142.8 | 154.1 | 0 | 0 | 0 | 0 | 123.2 | ||||
| 186 | M | 29.5 | Very low | 28.8 | Very low | 169 Ų | 169 | 122.5 Ų | 122.5 | 83% | 0.833 | 79% | 0.786 | S | S | * | * | trans | 67.4 | 118.3 | 144.4 | -76 | 179 | 59.9 | 0 | 0 | 126.6 | ||||
| 187 | A | 25.8 | Very low | 28.6 | Very low | 81 Ų | 81 | 121 Ų | 121 | 67% | 0.669 | 79% | 0.787 | S | S | * | * | 84.7 | 104.5 | 114.4 | 0 | 0 | 0 | 0 | 0 | 124.6 | |||||
| 188 | A | 26 | Very low | 28.4 | Very low | 86 Ų | 86 | 122.2 Ų | 122.2 | 71% | 0.711 | 79% | 0.789 | S | S | * | * | 79.1 | 162.4 | 121.6 | 0 | 0 | 0 | 0 | 0 | 122.9 | |||||
| 189 | Q | 28.6 | Very low | 28.6 | Very low | 173 Ų | 173 | 121.4 Ų | 121.4 | 81% | 0.808 | 79% | 0.789 | S | S | * | * | trans | 75.3 | 153.4 | 173.4 | -49.6 | -67.2 | -25.9 | 0 | 0 | 117.4 | ||||
| 190 | V | 24.9 | Very low | 28.4 | Very low | 117 Ų | 117 | 119.9 Ų | 119.9 | 71% | 0.709 | 78% | 0.784 | S | S | * | * | cis | -169 | 154.3 | -42.2 | 93.8 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 191 | V | 25.6 | Very low | 28.5 | Very low | 143 Ų | 143 | 127 Ų | 127 | 87% | 0.867 | 79% | 0.79 | S | S | * | * | trans | 64.5 | 151.6 | 168.3 | 162.9 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 192 | G | 25.5 | Very low | 28.4 | Very low | 71 Ų | 71 | 126 Ų | 126 | 73% | 0.732 | 79% | 0.786 | S | S | * | * | cis | 155 | 144.5 | -11.9 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 193 | G | 26.1 | Very low | 28.4 | Very low | 69 Ų | 69 | 129.6 Ų | 129.6 | 71% | 0.711 | 79% | 0.793 | S | S | * | * | trans | 107.5 | 117.1 | 176.7 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 194 | T | 31.2 | Very low | 28.3 | Very low | 147 Ų | 147 | 127 Ų | 127 | 90% | 0.902 | 79% | 0.793 | S | S | * | * | 80.1 | 115.5 | 61.9 | 59 | 0 | 0 | 0 | 0 | 116.5 | |||||
| 195 | Q | 31.9 | Very low | 28 | Very low | 194 Ų | 194 | 130 Ų | 130 | 91% | 0.907 | 80% | 0.802 | S | S | * | * | 170 | 147.4 | 117.6 | -169.5 | 178.2 | -19.6 | 0 | 0 | 113.4 | |||||
| 196 | A | 26.5 | Very low | 28.6 | Very low | 77 Ų | 77 | 129.6 Ų | 129.6 | 64% | 0.636 | 80% | 0.802 | S | S | * | * | trans | 58.8 | 131.1 | 161.9 | 0 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 197 | C | 25.2 | Very low | 28.9 | Very low | 128 Ų | 128 | 129 Ų | 129 | 87% | 0.865 | 80% | 0.801 | S | S | * | * | cis | 85.9 | 106.4 | 36 | -63.1 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 198 | E | 26.9 | Very low | 29.7 | Very low | 204 Ų | 204 | 130.6 Ų | 130.6 | 95% | 0.953 | 81% | 0.805 | S | S | * | * | -169.8 | 160 | 104.7 | -165.5 | 148.8 | -165 | 0 | 0 | 110.1 | |||||
| 199 | G | 29.9 | Very low | 30.7 | Very low | 75 Ų | 75 | 132.1 Ų | 132.1 | 77% | 0.773 | 81% | 0.807 | S | S | * | * | trans | -101.4 | 168.9 | -159.1 | 0 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 200 | G | 25.9 | Very low | 31.3 | Very low | 75 Ų | 75 | 129.3 Ų | 129.3 | 77% | 0.773 | 80% | 0.804 | S | S | * | * | trans | -174.7 | 62.5 | -177.2 | 0 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 201 | W | 28.3 | Very low | 32.1 | Very low | 249 Ų | 249 | 129.5 Ų | 129.5 | 94% | 0.943 | 81% | 0.808 | S | S | * | * | trans | -2.9 | 149.7 | 154.1 | -58.2 | 54.9 | 0 | 0 | 0 | 119.7 | ||||
| 202 | S | 33.9 | Very low | 33 | Very low | 94 Ų | 94 | 128.4 Ų | 128.4 | 66% | 0.657 | 80% | 0.803 | S | S | * | * | cis | -179.7 | 133.2 | -12.7 | -90.1 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 203 | Q | 29.3 | Very low | 33.6 | Very low | 208 Ų | 208 | 131.1 Ų | 131.1 | 97% | 0.972 | 81% | 0.808 | S | S | * | * | trans | 162.7 | 135.9 | 155.6 | -96.5 | 168.3 | 37 | 0 | 0 | 109.5 | ||||
| 204 | G | 28 | Very low | 34.1 | Very low | 74 Ų | 74 | 132.9 Ų | 132.9 | 76% | 0.763 | 82% | 0.816 | S | S | * | * | cis | 161.3 | 88.8 | -13.8 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 205 | L | 34.1 | Very low | 34.2 | Very low | 171 Ų | 171 | 130.8 Ų | 130.8 | 90% | 0.895 | 81% | 0.813 | S | S | * | * | trans | -166.4 | 151.8 | 154.3 | -99.2 | 171.4 | 0 | 0 | 0 | 108.3 | ||||
| 206 | P | 37.3 | Very low | 34.4 | Very low | 116 Ų | 116 | 130.4 Ų | 130.4 | 75% | 0.753 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -90.9 | 147.3 | -163.2 | 34.5 | -35.3 | 0 | 0 | 0 | 115.5 | ||
| 207 | L | 35.5 | Very low | 34.7 | Very low | 156 Ų | 156 | 134.7 Ų | 134.7 | 82% | 0.817 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -81.2 | 157.1 | 162.2 | -79.4 | 84.1 | 0 | 0 | 0 | 111 | ||
| 208 | P | 42 | Very low | 34.9 | Very low | 115 Ų | 115 | 134 Ų | 134 | 75% | 0.747 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -66.6 | 152.6 | 171.6 | 29.1 | -35.8 | 0 | 0 | 0 | 112.4 | ||
| 209 | P | 47.2 | Very low | 35.2 | Very low | 119 Ų | 119 | 129.5 Ų | 129.5 | 77% | 0.773 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -75.7 | 149.6 | -177.4 | 31 | -35.6 | 0 | 0 | 0 | 113.2 | ||
| 210 | P | 41.8 | Very low | 35.1 | Very low | 114 Ų | 114 | 133.5 Ų | 133.5 | 74% | 0.74 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -73.8 | 159.5 | 173.8 | 32 | -35.7 | 0 | 0 | 0 | 112.6 | ||
| 211 | P | 41.7 | Very low | 35.1 | Very low | 120 Ų | 120 | 135.6 Ų | 135.6 | 78% | 0.779 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -69.8 | 152.9 | 179.6 | 29.2 | -35.8 | 0 | 0 | 0 | 113.2 | ||
| 212 | P | 45.5 | Very low | 35.1 | Very low | 120 Ų | 120 | 129.7 Ų | 129.7 | 78% | 0.779 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -75 | 151.5 | -179.4 | 31.2 | -35.6 | 0 | 0 | 0 | 113.1 | ||
| 213 | P | 37.8 | Very low | 35 | Very low | 129 Ų | 129 | 134.3 Ų | 134.3 | 84% | 0.838 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -77.1 | 151.8 | -179.8 | 32.1 | -35.8 | 0 | 0 | 0 | 113.1 | ||
| 214 | A | 35.1 | Very low | 34.8 | Very low | 106 Ų | 106 | 127.4 Ų | 127.4 | 88% | 0.876 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -72.9 | 142.9 | 179.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||
| 215 | A | 34.6 | Very low | 34.8 | Very low | 102 Ų | 102 | 131.6 Ų | 131.6 | 84% | 0.843 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -102.7 | 154.3 | 174 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||
| 216 | Q | 35.5 | Very low | 34.5 | Very low | 186 Ų | 186 | 128.5 Ų | 128.5 | 87% | 0.869 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -81.7 | 155.2 | -168.5 | -65.5 | -86.1 | -11.4 | 0 | 0 | 114 | ||
| 217 | L | 32.9 | Very low | 34 | Very low | 167 Ų | 167 | 126.5 Ų | 126.5 | 87% | 0.874 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -78.1 | 150.7 | 170.5 | -79.7 | 167.3 | 0 | 0 | 0 | 112.8 | ||
| 218 | P | 29 | Very low | 34.3 | Very low | 115 Ų | 115 | 125.3 Ų | 125.3 | 75% | 0.747 | 80% | 0.804 | S | S | * | * | trans | -120.6 | 162.8 | 138.3 | 35.8 | -27.9 | 0 | 0 | 0 | 112.4 | ||||
| 219 | P | 34.1 | Very low | 33.7 | Very low | 108 Ų | 108 | 129.6 Ų | 129.6 | 70% | 0.701 | 81% | 0.805 | S | S | * | * | trans | -120.6 | -174.3 | -157.9 | 41.4 | -28.6 | 0 | 0 | 0 | 115.7 | ||||
| 220 | I | 26.6 | Very low | 33.5 | Very low | 160 Ų | 160 | 130 Ų | 130 | 82% | 0.821 | 81% | 0.807 | S | S | * | * | trans | 77.9 | 128.8 | 168.6 | -54.9 | 155.1 | 0 | 0 | 0 | 112.4 | ||||
| 221 | V | 26 | Very low | 33.2 | Very low | 119 Ų | 119 | 133 Ų | 133 | 72% | 0.721 | 81% | 0.811 | S | S | * | * | cis | -132.5 | 155.3 | 30 | -177.9 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 222 | S | 29.3 | Very low | 32.6 | Very low | 125 Ų | 125 | 130.7 Ų | 130.7 | 87% | 0.874 | 81% | 0.81 | S | S | * | * | trans | -130.8 | 121.2 | 152.4 | -66.5 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 223 | Q | 32.1 | Very low | 31.8 | Very low | 191 Ų | 191 | 129.7 Ų | 129.7 | 89% | 0.893 | 81% | 0.812 | S | S | * | * | trans | -92.7 | 122.6 | -174 | -175.5 | 172.5 | -9.6 | 0 | 0 | 110 | ||||
| 224 | G | 25.4 | Very low | 31.7 | Very low | 63 Ų | 63 | 132.9 Ų | 132.9 | 65% | 0.649 | 82% | 0.815 | S | S | * | * | trans | -106.6 | 162.9 | -170.5 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 225 | N | 28.3 | Very low | 31.4 | Very low | 162 Ų | 162 | 131.4 Ų | 131.4 | 87% | 0.866 | 81% | 0.81 | S | S | * | * | trans | -143.7 | 110.2 | 150.2 | -69.1 | -69.2 | 0 | 0 | 0 | 104 | ||||
| 226 | A | 27 | Very low | 31.8 | Very low | 106 Ų | 106 | 136.3 Ų | 136.3 | 88% | 0.876 | 82% | 0.816 | S | S | * | * | 52.8 | 117.8 | 80.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | |||||
| 227 | G | 27.2 | Very low | 31.4 | Very low | 73 Ų | 73 | 130.9 Ų | 130.9 | 75% | 0.753 | 81% | 0.81 | S | S | * | * | cis | 163 | -169.3 | 1.7 | 0 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 228 | P | 40.9 | Very low | 31.5 | Very low | 132 Ų | 132 | 128.6 Ų | 128.6 | 86% | 0.857 | 81% | 0.808 | S | S | * | * | cis | -124.5 | -174.4 | -10.6 | 42.4 | -27.4 | 0 | 0 | 0 | 113.5 | ||||
| 229 | W | 29.8 | Very low | 31.5 | Very low | 205 Ų | 205 | 131.2 Ų | 131.2 | 78% | 0.777 | 82% | 0.815 | S | S | * | * | trans | -120.4 | 136.3 | 176.2 | 177.8 | -56.6 | 0 | 0 | 0 | 110.1 | ||||
| 230 | P | 42 | Very low | 31.2 | Very low | 126 Ų | 126 | 130 Ų | 130 | 82% | 0.818 | 81% | 0.814 | S | S | * | * | trans | -99.7 | 126.7 | 165.3 | 34.6 | -27 | 0 | 0 | 0 | 111.7 | ||||
| 231 | Q | 36.8 | Very low | 31.3 | Very low | 177 Ų | 177 | 128.3 Ų | 128.3 | 83% | 0.827 | 82% | 0.816 | S | S | * | * | trans | -122.5 | 129.6 | -169.6 | -163.4 | 169.4 | -2.5 | 0 | 0 | 112.7 | ||||
| 232 | G | 29.5 | Very low | 31.5 | Very low | 73 Ų | 73 | 128 Ų | 128 | 75% | 0.753 | 82% | 0.819 | S | S | * | * | trans | 152.6 | 150.4 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 233 | A | 28.8 | Very low | 31.5 | Very low | 99 Ų | 99 | 130.8 Ų | 130.8 | 82% | 0.818 | 82% | 0.818 | S | S | * | * | cis | -156.1 | 152.7 | -12.5 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 234 | H | 35.2 | Very low | 31.4 | Very low | 196 Ų | 196 | 126.2 Ų | 126.2 | 91% | 0.907 | 81% | 0.813 | S | S | * | * | trans | 5.6 | 112.6 | 156.6 | -174.7 | -69.3 | 0 | 0 | 0 | 118.6 | ||||
| 235 | G | 29.5 | Very low | 31.6 | Very low | 75 Ų | 75 | 132.2 Ų | 132.2 | 77% | 0.773 | 82% | 0.821 | S | S | * | * | trans | -168.6 | 114.7 | 166.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 236 | E | 41.7 | Very low | 32 | Very low | 204 Ų | 204 | 127.7 Ų | 127.7 | 95% | 0.953 | 81% | 0.806 | S | S | * | * | trans | -98.3 | 135.2 | 175.2 | -174.5 | 177.7 | 162.5 | 0 | 0 | 109.6 | ||||
| 237 | G | 26.9 | Very low | 32.3 | Very low | 73 Ų | 73 | 128 Ų | 128 | 75% | 0.753 | 80% | 0.799 | S | S | * | * | trans | 175.7 | 126 | 179.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 238 | S | 34.6 | Very low | 32.8 | Very low | 119 Ų | 119 | 129.1 Ų | 129.1 | 83% | 0.832 | 79% | 0.793 | S | S | * | * | trans | -69.1 | 147 | -178.3 | -48.5 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 239 | L | 30 | Very low | 32.8 | Very low | 170 Ų | 170 | 130 Ų | 130 | 89% | 0.89 | 79% | 0.791 | S | S | * | * | -174.2 | 151.8 | 126.6 | -102.5 | 162.3 | 0 | 0 | 0 | 113 | |||||
| 240 | A | 28.6 | Very low | 33.2 | Very low | 82 Ų | 82 | 123.7 Ų | 123.7 | 68% | 0.678 | 77% | 0.772 | S | S | * | * | trans | 43.9 | 100.2 | 161.8 | 0 | 0 | 0 | 0 | 0 | 119 | S242 | A240-S242 PolarHBondContact O-N 2.88Š| ||
| 241 | S | 28.5 | Very low | 33.1 | Very low | 125 Ų | 125 | 122.5 Ų | 122.5 | 87% | 0.874 | 77% | 0.767 | S | S | * | * | trans | -59.6 | 126.2 | 151.3 | -175 | 0 | 0 | 0 | 0 | 108.8 | Q243 | S241-Q243 PolarHBondContact O-N 3.38Š| ||
| 242 | S | 28.6 | Very low | 33.1 | Very low | 111 Ų | 111 | 119.5 Ų | 119.5 | 78% | 0.776 | 77% | 0.765 | S | S | * | * | trans | -69.1 | 124.6 | -179.2 | -59.3 | 0 | 0 | 0 | 0 | 110.8 | A240 A244 | A240-S242 PolarHBondContact O-N 2.88Å; S242-A244 VanDerWaalsContact C-N 3.32Å; S242-A244 PolarHBondContact O-N 2.99Å | ||
| 243 | Q | 31 | Very low | 33.8 | Very low | 185 Ų | 185 | 118.4 Ų | 118.4 | 86% | 0.864 | 74% | 0.741 | S | S | * | * | trans | -67 | 88 | 173.8 | -173.4 | -173.8 | 24.3 | 0 | 0 | 110 | S241 K245 | S241-Q243 PolarHBondContact O-N 3.38Å; Q243-K245 PolarHBondContact O-N 2.9Å; Q243-K245 VanDerWaalsContact O-N 3.11Å | ||
| 244 | A | 29.4 | Very low | 34.7 | Very low | 94 Ų | 94 | 118.8 Ų | 118.8 | 78% | 0.777 | 74% | 0.735 | S | S | * | * | trans | -66.3 | 107.3 | 166 | 0 | 0 | 0 | 0 | 0 | 108 | S242 A246 | S242-A244 VanDerWaalsContact C-N 3.32Å; S242-A244 PolarHBondContact O-N 2.99Å; A244-A246 PolarHBondContact O-N 3.47Å | ||
| 245 | K | 29.3 | Very low | 35.5 | Very low | 190 Ų | 190 | 117.7 Ų | 117.7 | 83% | 0.826 | 72% | 0.723 | S | S | * | * | P | Polyproline II helix | trans | -55.1 | 130 | 171.3 | -92.5 | -158.6 | 172 | -162 | 0 | 109.4 | Q243 | Q243-K245 PolarHBondContact O-N 2.9Å; Q243-K245 VanDerWaalsContact O-N 3.11Å |
| 246 | A | 37.2 | Very low | 37.4 | Very low | 67 Ų | 67 | 115.9 Ų | 115.9 | 55% | 0.554 | 70% | 0.699 | S | S | * | * | P | Polyproline II helix | trans | -58.3 | 143.8 | 154.6 | 0 | 0 | 0 | 0 | 0 | 108.9 | A244 | A244-A246 PolarHBondContact O-N 3.47Š|
| 247 | P | 33.1 | Very low | 39 | Very low | 112 Ų | 112 | 108.9 Ų | 108.9 | 73% | 0.727 | 67% | 0.67 | S | S | * | * | P | Polyproline II helix | trans | -64.9 | 157.9 | 171.2 | 30.7 | -34.9 | 0 | 0 | 0 | 110.3 | ||
| 248 | P | 38.3 | Very low | 41.3 | Very low | 96 Ų | 96 | 111.1 Ų | 111.1 | 62% | 0.623 | 66% | 0.656 | S | S | * | * | P | Polyproline II helix | trans | -61.1 | 151.2 | 172.6 | -20.2 | 33.3 | 0 | 0 | 0 | 112.4 | D250 | P248-D250 VanDerWaalsContact C-N 3.26Å; P248-D250 PolarHBondContact O-N 3.3Å |
| 249 | D | 39.7 | Very low | 43.6 | Very low | 150 Ų | 150 | 110 Ų | 110 | 80% | 0.802 | 64% | 0.638 | S | S | * | * | trans | -73 | 81.9 | 169.8 | 179.5 | 14.1 | 0 | 0 | 0 | 110.1 | S251 | D249-S251 PolarHBondContact O-N 3.33Š| ||
| 250 | D | 38.8 | Very low | 46.2 | Very low | 73 Ų | 73 | 103.5 Ų | 103.5 | 39% | 0.39 | 60% | 0.604 | S | S | . | * | trans | -88.8 | 74.9 | -177 | -69 | -37 | 0 | 0 | 0 | 111.3 | P248 C252 N253 | P248-D250 VanDerWaalsContact C-N 3.26Å; P248-D250 PolarHBondContact O-N 3.3Å; D250-C252 PolarHBondContact O-N 3.08Å; D250-C252 VanDerWaalsContact O-N 3.14Å; D250-N253 HydrophobicContact CB-CB 3.49Å; D250-N253 VanDerWaalsContact CB-CB 3.49Å; D250-N253 WeakPolarHBondContact CB-ND2 3.47Å; D250-N253 VanDerWaalsContact O-CB 3.3Å; D250-N253 WeakPolarHBondContact O-CB 3.45Å; D250-N253 PolarHBondContact O-N 3.05Å; D250-N253 PolarHBondContact OD2-ND2 3.16Å | ||
| 251 | S | 39.3 | Very low | 48.9 | Very low | 101 Ų | 101 | 99.8 Ų | 99.8 | 71% | 0.706 | 57% | 0.573 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -56.2 | -25.5 | 164.2 | 58 | 0 | 0 | 0 | 0 | 112.4 | D249 | D249-S251 PolarHBondContact O-N 3.33Š|
| 252 | C | 37 | Very low | 51.7 | Low | 115 Ų | 115 | 97.9 Ų | 97.9 | 78% | 0.777 | 55% | 0.546 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91 | 15.2 | 170.6 | -72.5 | 0 | 0 | 0 | 0 | 115.1 | D250 | D250-C252 PolarHBondContact O-N 3.08Å; D250-C252 VanDerWaalsContact O-N 3.14Å |
| 253 | N | 44 | Very low | 54.5 | Low | 49 Ų | 49 | 95 Ų | 95 | 26% | 0.262 | 52% | 0.522 | S | S | . | . | trans | -65.3 | 131.5 | -179.6 | -151.7 | -71.4 | 0 | 0 | 0 | 111.3 | D250 R255 S256 V257 | D250-N253 HydrophobicContact CB-CB 3.49Å; D250-N253 VanDerWaalsContact CB-CB 3.49Å; D250-N253 WeakPolarHBondContact CB-ND2 3.47Å; D250-N253 VanDerWaalsContact O-CB 3.3Å; D250-N253 WeakPolarHBondContact O-CB 3.45Å; D250-N253 PolarHBondContact O-N 3.05Å; D250-N253 PolarHBondContact OD2-ND2 3.16Å; N253-R255 HydrophobicContact CB-CB 4.35Å; N253-R255 PolarHBondContact O-N 3.38Å; N253-R255 WeakPolarHBondContact OD1-CB 3.46Å; N253-R255 PolarHBondContact OD1-N 3.08Å; N253-S256 PolarHBondContact O-N 3.12Å; N253-S256 PolarHBondContact O-OG 2.76Å; N253-V257 PolarHBondContact O-N 3.2Å | ||
| 254 | P | 47.8 | Very low | 57.5 | Low | 107 Ų | 107 | 86.2 Ų | 86.2 | 70% | 0.695 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -52.7 | -28.4 | 169.4 | -27.6 | 35.8 | 0 | 0 | 0 | 113.3 | Y258 | P254-Y258 WeakPolarHBondContact O-CB 3.47Å; P254-Y258 PolarHBondContact O-N 2.89Å |
| 255 | R | 51.5 | Low | 60.3 | Low | 174 Ų | 174 | 83.8 Ų | 83.8 | 66% | 0.657 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -66.2 | -45.6 | 175.6 | -173.8 | 176.8 | -178.6 | 159.5 | 1.5 | 113.5 | N253 V257 Y258 E259 | N253-R255 HydrophobicContact CB-CB 4.35Å; N253-R255 PolarHBondContact O-N 3.38Å; N253-R255 WeakPolarHBondContact OD1-CB 3.46Å; N253-R255 PolarHBondContact OD1-N 3.08Å; R255-V257 VanDerWaalsContact C-N 3.34Å; R255-Y258 PolarHBondContact O-N 2.75Å; R255-E259 HydrophobicContact CG-CG 4.48Å; R255-E259 VanDerWaalsContact CG-OE1 3.25Å; R255-E259 WeakPolarHBondContact CG-OE1 3.45Å; R255-E259 IonicContact CZ-OE1 3.77Å; R255-E259 IonicContact NE-OE1 2.95Å; R255-E259 PolarHBondContact NE-OE1 3.13Å; R255-E259 IonicContact NH2-OE1 2.93Å; R255-E259 WeakPolarHBondContact O-CB 3.16Å; R255-E259 VanDerWaalsContact O-CG 3.32Å; R255-E259 WeakPolarHBondContact O-CG 3.32Å; R255-E259 PolarHBondContact O-N 2.87Å |
| 256 | S | 70.2 | Confident | 63.2 | Low | 36 Ų | 36 | 81 Ų | 81 | 25% | 0.252 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -69.2 | -36.3 | -178.5 | 66.2 | 0 | 0 | 0 | 0 | 110.8 | N253 E259 N260 | N253-S256 PolarHBondContact O-N 3.12Å; N253-S256 PolarHBondContact O-OG 2.76Å; S256-E259 PolarHBondContact O-N 3.49Å; S256-N260 WeakPolarHBondContact O-CB 3.37Å; S256-N260 PolarHBondContact O-N 2.82Å; S256-N260 PolarHBondContact O-ND2 2.94Å; S256-N260 VanDerWaalsContact O-ND2 3.07Å |
| 257 | V | 74.9 | Confident | 65.6 | Low | 58 Ų | 58 | 79.7 Ų | 79.7 | 35% | 0.352 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -62.7 | -45.1 | 171.6 | -174.8 | 0 | 0 | 0 | 0 | 111.1 | N253 R255 N260 F261 F333 F336 | N253-V257 PolarHBondContact O-N 3.2Å; R255-V257 VanDerWaalsContact C-N 3.34Å; V257-N260 PolarHBondContact O-N 2.87Å; V257-F261 PolarHBondContact O-N 2.84Å; V257-F333 HydrophobicContact CG1-CE1 4.25Å; V257-F336 HydrophobicContact CG1-CE2 3.95Å; V257-F336 HydrophobicContact CG1-CZ 4.37Å |
| 258 | Y | 76.4 | Confident | 68.3 | Low | 119 Ų | 119 | 75 Ų | 75 | 47% | 0.467 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -65.8 | -41.1 | 176.6 | -174.1 | -102.2 | 0 | 0 | 0 | 112.7 | P254 R255 N260 F261 R262 | P254-Y258 WeakPolarHBondContact O-CB 3.47Å; P254-Y258 PolarHBondContact O-N 2.89Å; R255-Y258 PolarHBondContact O-N 2.75Å; Y258-N260 VanDerWaalsContact C-N 3.35Å; Y258-N260 PolarHBondContact O-N 3.45Å; Y258-F261 HydrophobicContact CD2-CD1 4.04Å; Y258-F261 AromaticContact CE2-CD1 3.97Å; Y258-F261 HydrophobicContact CE2-CD1 3.97Å; Y258-F261 HydrophobicContact CE2-CE1 4.25Å; Y258-F261 WeakPolarHBondContact O-CB 3.28Å; Y258-F261 PolarHBondContact O-N 3.34Å; Y258-F261 VanDerWaalsContact O-N 3.17Å; Y258-R262 HydrophobicContact CD1-CG 4.3Å; Y258-R262 HydrophobicContact CE1-CG 3.93Å; Y258-R262 WeakPolarHBondContact O-CG 3.38Å; Y258-R262 PolarHBondContact O-N 3.31Å |
| 259 | E | 82.9 | Confident | 70.7 | Confident | 95 Ų | 95 | 73.8 Ų | 73.8 | 44% | 0.444 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -63.6 | -39.3 | 175.5 | -73 | 170.8 | -169.7 | 0 | 0 | 111.3 | R255 S256 R262 L263 | R255-E259 HydrophobicContact CG-CG 4.48Å; R255-E259 VanDerWaalsContact CG-OE1 3.25Å; R255-E259 WeakPolarHBondContact CG-OE1 3.45Å; R255-E259 IonicContact CZ-OE1 3.77Å; R255-E259 IonicContact NE-OE1 2.95Å; R255-E259 PolarHBondContact NE-OE1 3.13Å; R255-E259 IonicContact NH2-OE1 2.93Å; R255-E259 WeakPolarHBondContact O-CB 3.16Å; R255-E259 VanDerWaalsContact O-CG 3.32Å; R255-E259 WeakPolarHBondContact O-CG 3.32Å; R255-E259 PolarHBondContact O-N 2.87Å; S256-E259 PolarHBondContact O-N 3.49Å; E259-R262 PolarHBondContact O-N 3.05Å; E259-L263 WeakPolarHBondContact O-CG 3.17Å; E259-L263 PolarHBondContact O-N 2.86Å |
| 260 | N | 84.4 | Confident | 73 | Confident | 35 Ų | 35 | 67.8 Ų | 67.8 | 19% | 0.187 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -64.5 | -38.2 | 170.9 | -70.2 | -34.7 | 0 | 0 | 0 | 112.4 | S256 V257 Y258 L263 W264 I289 R293 F333 | S256-N260 WeakPolarHBondContact O-CB 3.37Å; S256-N260 PolarHBondContact O-N 2.82Å; S256-N260 PolarHBondContact O-ND2 2.94Å; S256-N260 VanDerWaalsContact O-ND2 3.07Å; V257-N260 PolarHBondContact O-N 2.87Å; Y258-N260 VanDerWaalsContact C-N 3.35Å; Y258-N260 PolarHBondContact O-N 3.45Å; N260-L263 PolarHBondContact O-N 3.19Å; N260-W264 WeakPolarHBondContact O-CB 3.26Å; N260-W264 PolarHBondContact O-N 2.98Å; N260-I289 HydrophobicContact CB-CD1 4.34Å; N260-I289 WeakPolarHBondContact O-CD1 3.26Å; N260-I289 WeakPolarHBondContact OD1-CG2 3.32Å; N260-R293 PolarHBondContact OD1-NH2 3.47Å; N260-F333 HydrophobicContact CB-CZ 4Å |
| 261 | F | 84.5 | Confident | 75.4 | Confident | 4 Ų | 4 | 64.3 Ų | 64.3 | 2% | 0.018 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -62.2 | -39.8 | 173 | 166.7 | -110.8 | 0 | 0 | 0 | 112.5 | V257 Y258 W264 Q265 F333 F336 E337 E340 | V257-F261 PolarHBondContact O-N 2.84Å; Y258-F261 HydrophobicContact CD2-CD1 4.04Å; Y258-F261 AromaticContact CE2-CD1 3.97Å; Y258-F261 HydrophobicContact CE2-CD1 3.97Å; Y258-F261 HydrophobicContact CE2-CE1 4.25Å; Y258-F261 WeakPolarHBondContact O-CB 3.28Å; Y258-F261 PolarHBondContact O-N 3.34Å; Y258-F261 VanDerWaalsContact O-N 3.17Å; F261-W264 HydrophobicContact CD2-CE3 4.01Å; F261-W264 HydrophobicContact CD2-CZ3 4.28Å; F261-W264 HydrophobicContact CE2-CE3 4.08Å; F261-W264 AromaticContact CE2-CZ3 3.96Å; F261-W264 HydrophobicContact CE2-CZ3 3.96Å; F261-W264 WeakPolarHBondContact O-CB 3.29Å; F261-W264 PolarHBondContact O-N 3.11Å; F261-Q265 HydrophobicContact CE2-CG 4.19Å; F261-Q265 HydrophobicContact CZ-CG 4.25Å; F261-Q265 PolarHBondContact O-N 3.32Å; F261-F333 HydrophobicContact CB-CD1 3.86Å; F261-F333 HydrophobicContact CB-CE1 3.78Å; F261-F333 HydrophobicContact CB-CG 4.49Å; F261-F333 HydrophobicContact CB-CZ 4.35Å; F261-F333 HydrophobicContact CD2-CB 4Å; F261-F333 AromaticContact CD2-CD1 3.96Å; F261-F333 HydrophobicContact CD2-CD1 3.96Å; F261-F333 HydrophobicContact CD2-CG 4.07Å; F261-F333 WeakPolarHBondContact CE2-O 3.32Å; F261-F333 HydrophobicContact CG-CD1 4.36Å; F261-F336 HydrophobicContact CB-CD2 4.34Å; F261-F336 HydrophobicContact CD2-CB 3.88Å; F261-F336 HydrophobicContact CD2-CD2 4.35Å; F261-F336 HydrophobicContact CE1-CB 4.4Å; F261-F336 HydrophobicContact CE2-CB 3.63Å; F261-F336 HydrophobicContact CG-CB 4.36Å; F261-F336 HydrophobicContact CG-CD2 4.19Å; F261-F336 HydrophobicContact CZ-CB 3.91Å; F261-E337 HydrophobicContact CE2-CB 4.2Å; F261-E337 HydrophobicContact CZ-CB 4.38Å; F261-E340 WeakPolarHBondContact CE1-OE2 3.4Å |
| 262 | R | 88.3 | Confident | 77.8 | Confident | 84 Ų | 84 | 66.2 Ų | 66.2 | 32% | 0.317 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -67 | -38.5 | 173.4 | -56.9 | -49.1 | -75.3 | -163.4 | -9.2 | 112.1 | Y258 E259 Q265 H266 E340 | Y258-R262 HydrophobicContact CD1-CG 4.3Å; Y258-R262 HydrophobicContact CE1-CG 3.93Å; Y258-R262 WeakPolarHBondContact O-CG 3.38Å; Y258-R262 PolarHBondContact O-N 3.31Å; E259-R262 PolarHBondContact O-N 3.05Å; R262-Q265 VanDerWaalsContact NE-OE1 3.16Å; R262-Q265 PolarHBondContact O-N 2.91Å; R262-H266 PolarHBondContact O-CD2 3.12Å; R262-H266 PolarHBondContact O-N 3.24Å; R262-E340 IonicContact CZ-OE1 3.85Å; R262-E340 IonicContact NH1-OE1 3.88Å; R262-E340 PolarHBondContact NH1-OE1 3.47Å; R262-E340 IonicContact NH1-OE2 3.76Å; R262-E340 PolarHBondContact NH1-OE2 3.01Å; R262-E340 IonicContact NH2-OE1 2.66Å |
| 263 | L | 86.3 | Confident | 80.2 | Confident | 52 Ų | 52 | 69.3 Ų | 69.3 | 27% | 0.272 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -62 | -42.2 | 172.4 | -70.7 | 170.7 | 0 | 0 | 0 | 111.7 | E259 N260 H266 Y267 I289 | E259-L263 WeakPolarHBondContact O-CG 3.17Å; E259-L263 PolarHBondContact O-N 2.86Å; N260-L263 PolarHBondContact O-N 3.19Å; L263-H266 CarbonylContact O-C 3.5Å; L263-H266 PolarHBondContact O-N 2.97Å; L263-H266 VanDerWaalsContact O-N 3.16Å; L263-Y267 HydrophobicContact CB-CE2 4.24Å; L263-Y267 WeakPolarHBondContact O-CD2 3.33Å; L263-Y267 VanDerWaalsContact O-CG 3.28Å; L263-Y267 PolarHBondContact O-N 3.44Å; L263-I289 HydrophobicContact CB-CD1 4.49Å; L263-I289 HydrophobicContact CB-CG1 4.24Å; L263-I289 HydrophobicContact CD1-CG2 4.24Å |
| 264 | W | 93.3 | Very high | 82.1 | Confident | 0 Ų | 0 | 69.4 Ų | 69.4 | 0% | 0 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -58.4 | -47.7 | 173.8 | -179.7 | 82.4 | 0 | 0 | 0 | 112.3 | N260 F261 H266 Y267 K268 E282 C286 I289 F333 L334 E337 | N260-W264 WeakPolarHBondContact O-CB 3.26Å; N260-W264 PolarHBondContact O-N 2.98Å; F261-W264 HydrophobicContact CD2-CE3 4.01Å; F261-W264 HydrophobicContact CD2-CZ3 4.28Å; F261-W264 HydrophobicContact CE2-CE3 4.08Å; F261-W264 AromaticContact CE2-CZ3 3.96Å; F261-W264 HydrophobicContact CE2-CZ3 3.96Å; F261-W264 WeakPolarHBondContact O-CB 3.29Å; F261-W264 PolarHBondContact O-N 3.11Å; W264-H266 VanDerWaalsContact C-N 3.27Å; W264-H266 PolarHBondContact O-N 3.31Å; W264-Y267 PolarHBondContact O-N 3.32Å; W264-Y267 VanDerWaalsContact O-N 3.07Å; W264-K268 HydrophobicContact CD2-CD 3.63Å; W264-K268 HydrophobicContact CD2-CG 4.3Å; W264-K268 HydrophobicContact CE3-CD 3.58Å; W264-K268 HydrophobicContact CG-CD 4.45Å; W264-K268 HydrophobicContact CH2-CD 3.78Å; W264-K268 HydrophobicContact CZ2-CD 3.76Å; W264-K268 HydrophobicContact CZ3-CD 3.66Å; W264-K268 WeakPolarHBondContact O-CG 3.4Å; W264-K268 PolarHBondContact O-N 2.84Å; W264-E282 HydrophobicContact CZ2-CB 4.01Å; W264-E282 HydrophobicContact CZ2-CG 3.91Å; W264-E282 PolarHBondContact NE1-O 3.3Å; W264-C286 PolarHBondContact NE1-SG 3.3Å; W264-C286 VanDerWaalsContact NE1-SG 3.38Å; W264-I289 HydrophobicContact CB-CD1 4.08Å; W264-F333 HydrophobicContact CB-CD2 3.74Å; W264-F333 HydrophobicContact CB-CE2 4Å; W264-F333 AromaticContact CD1-CD2 3.72Å; W264-F333 HydrophobicContact CD2-CB 3.67Å; W264-F333 AromaticContact CD2-CD2 3.86Å; W264-F333 HydrophobicContact CD2-CD2 3.86Å; W264-F333 HydrophobicContact CD2-CG 4.17Å; W264-F333 HydrophobicContact CE3-CB 3.71Å; W264-F333 HydrophobicContact CE3-CD2 4.5Å; W264-F333 HydrophobicContact CE3-CG 4.41Å; W264-F333 HydrophobicContact CG-CB 4.29Å; W264-F333 AromaticContact CG-CD2 3.53Å; W264-F333 HydrophobicContact CG-CD2 3.53Å; W264-F333 HydrophobicContact CG-CE2 4.23Å; W264-F333 HydrophobicContact CG-CG 4.29Å; W264-F333 VanDerWaalsContact CH2-C 3.42Å; W264-F333 HydrophobicContact CH2-CB 3.71Å; W264-F333 WeakPolarHBondContact CH2-O 3.34Å; W264-F333 HydrophobicContact CZ2-CB 3.72Å; W264-F333 HydrophobicContact CZ3-CB 3.74Å; W264-F333 VanDerWaalsContact CZ3-O 3.3Å; W264-F333 WeakPolarHBondContact CZ3-O 3.29Å; W264-L334 HydrophobicContact CH2-CD2 3.86Å; W264-L334 HydrophobicContact CH2-CG 3.84Å; W264-L334 HydrophobicContact CZ2-CD2 4.33Å; W264-L334 HydrophobicContact CZ2-CG 4.06Å; W264-E337 HydrophobicContact CZ3-CB 4.32Å |
| 265 | Q | 89.8 | Confident | 83.9 | Confident | 42 Ų | 42 | 65.5 Ų | 65.5 | 20% | 0.196 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -57.3 | -39 | 174 | -74.6 | 180 | -32.2 | 0 | 0 | 112.1 | F261 R262 P269 E340 | F261-Q265 HydrophobicContact CE2-CG 4.19Å; F261-Q265 HydrophobicContact CZ-CG 4.25Å; F261-Q265 PolarHBondContact O-N 3.32Å; R262-Q265 VanDerWaalsContact NE-OE1 3.16Å; R262-Q265 PolarHBondContact O-N 2.91Å; Q265-P269 VanDerWaalsContact O-CD 3.25Å; Q265-P269 WeakPolarHBondContact O-CD 3.48Å; Q265-E340 PolarHBondContact NE2-OE2 3.36Å |
| 266 | H | 88.4 | Confident | 85.1 | Confident | 133 Ų | 133 | 61.6 Ų | 61.6 | 62% | 0.616 | 29% | 0.29 | S | S | * | . | H | α-helix | trans | -71.9 | -28.6 | 175 | -71.4 | -52.9 | 0 | 0 | 0 | 114 | R262 L263 W264 | R262-H266 PolarHBondContact O-CD2 3.12Å; R262-H266 PolarHBondContact O-N 3.24Å; L263-H266 CarbonylContact O-C 3.5Å; L263-H266 PolarHBondContact O-N 2.97Å; L263-H266 VanDerWaalsContact O-N 3.16Å; W264-H266 VanDerWaalsContact C-N 3.27Å; W264-H266 PolarHBondContact O-N 3.31Å |
| 267 | Y | 88.3 | Confident | 85.1 | Confident | 38 Ų | 38 | 69.5 Ų | 69.5 | 15% | 0.149 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -88.7 | -22.9 | -179.6 | -63.4 | -23.5 | 0 | 0 | 0 | 114.3 | L263 W264 L270 A271 L288 I289 L292 | L263-Y267 HydrophobicContact CB-CE2 4.24Å; L263-Y267 WeakPolarHBondContact O-CD2 3.33Å; L263-Y267 VanDerWaalsContact O-CG 3.28Å; L263-Y267 PolarHBondContact O-N 3.44Å; W264-Y267 PolarHBondContact O-N 3.32Å; W264-Y267 VanDerWaalsContact O-N 3.07Å; Y267-L270 HydrophobicContact CD1-CD1 3.96Å; Y267-L270 WeakPolarHBondContact O-CA 3.46Å; Y267-L270 WeakPolarHBondContact O-CB 3.45Å; Y267-L270 PolarHBondContact O-N 3.17Å; Y267-A271 PolarHBondContact O-N 3.26Å; Y267-L288 HydrophobicContact CD2-CB 3.73Å; Y267-L288 HydrophobicContact CE2-CB 4.28Å; Y267-L288 HydrophobicContact CG-CB 4.22Å; Y267-I289 HydrophobicContact CD2-CG1 3.97Å; Y267-I289 HydrophobicContact CE2-CG1 4.06Å; Y267-L292 HydrophobicContact CD1-CD1 4.39Å; Y267-L292 HydrophobicContact CE1-CD1 3.9Å; Y267-L292 HydrophobicContact CE2-CD1 4.09Å |
| 268 | K | 90.1 | Very high | 85.4 | Confident | 13 Ų | 13 | 68.5 Ų | 68.5 | 6% | 0.057 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -51 | -47.3 | 173.8 | -80.7 | 165.3 | 74.2 | 170.2 | 0 | 113.9 | W264 L270 A271 R272 S285 E337 | W264-K268 HydrophobicContact CD2-CD 3.63Å; W264-K268 HydrophobicContact CD2-CG 4.3Å; W264-K268 HydrophobicContact CE3-CD 3.58Å; W264-K268 HydrophobicContact CG-CD 4.45Å; W264-K268 HydrophobicContact CH2-CD 3.78Å; W264-K268 HydrophobicContact CZ2-CD 3.76Å; W264-K268 HydrophobicContact CZ3-CD 3.66Å; W264-K268 WeakPolarHBondContact O-CG 3.4Å; W264-K268 PolarHBondContact O-N 2.84Å; K268-L270 PolarHBondContact O-N 2.91Å; K268-A271 PolarHBondContact O-N 2.99Å; K268-R272 WeakPolarHBondContact O-CB 3.34Å; K268-R272 VanDerWaalsContact O-CG 3.27Å; K268-R272 WeakPolarHBondContact O-CG 3.32Å; K268-R272 PolarHBondContact O-N 2.89Å; K268-S285 WeakPolarHBondContact CA-OG 3.25Å; K268-S285 WeakPolarHBondContact CG-OG 3.45Å; K268-E337 IonicContact NZ-OE1 3.93Å; K268-E337 PolarHBondContact NZ-OE1 3.37Å; K268-E337 IonicContact NZ-OE2 3.98Å; K268-E337 PolarHBondContact NZ-OE2 3.21Å |
| 269 | P | 88.1 | Confident | 85.3 | Confident | 71 Ų | 71 | 67.8 Ų | 67.8 | 46% | 0.461 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -65.8 | -16.7 | 174.6 | -22.9 | 34.6 | 0 | 0 | 0 | 115.2 | Q265 R273 | Q265-P269 VanDerWaalsContact O-CD 3.25Å; Q265-P269 WeakPolarHBondContact O-CD 3.48Å; P269-R273 WeakPolarHBondContact O-CG 3.16Å; P269-R273 PolarHBondContact O-NE 2.64Å; P269-R273 VanDerWaalsContact O-NE 3.11Å |
| 270 | L | 88.4 | Confident | 85.6 | Confident | 25 Ų | 25 | 64.4 Ų | 64.4 | 13% | 0.131 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -85.4 | -52.3 | 174 | -55.1 | -177.6 | 0 | 0 | 0 | 109.8 | Y267 K268 R272 R273 H274 L304 L308 | Y267-L270 HydrophobicContact CD1-CD1 3.96Å; Y267-L270 WeakPolarHBondContact O-CA 3.46Å; Y267-L270 WeakPolarHBondContact O-CB 3.45Å; Y267-L270 PolarHBondContact O-N 3.17Å; K268-L270 PolarHBondContact O-N 2.91Å; L270-R272 VanDerWaalsContact C-N 3.27Å; L270-R272 PolarHBondContact O-N 3.44Å; L270-R273 WeakPolarHBondContact O-CB 3.28Å; L270-R273 PolarHBondContact O-N 3Å; L270-H274 PolarHBondContact O-CD2 3.49Å; L270-L304 HydrophobicContact CD1-CD2 4.21Å; L270-L308 HydrophobicContact CB-CD2 3.95Å; L270-L308 HydrophobicContact CD1-CD2 4.44Å |
| 271 | A | 89.6 | Confident | 86 | Confident | 0 Ų | 0 | 63 Ų | 63 | 0% | 0 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -53.4 | -42.8 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | Y267 K268 R273 H274 L275 T281 L284 S285 | Y267-A271 PolarHBondContact O-N 3.26Å; K268-A271 PolarHBondContact O-N 2.99Å; A271-R273 PolarHBondContact O-N 3.38Å; A271-R273 VanDerWaalsContact O-N 3.17Å; A271-H274 PolarHBondContact O-N 3.34Å; A271-L275 PolarHBondContact O-N 3.43Å; A271-T281 HydrophobicContact CB-CG2 4.3Å; A271-T281 WeakPolarHBondContact CB-O 3.48Å; A271-L284 HydrophobicContact CB-CB 4.35Å; A271-L284 HydrophobicContact CB-CD2 3.93Å; A271-L284 HydrophobicContact CB-CG 4.06Å; A271-S285 VanDerWaalsContact CB-OG 3.27Å; A271-S285 WeakPolarHBondContact CB-OG 3.19Å |
| 272 | R | 89 | Confident | 86.5 | Confident | 141 Ų | 141 | 64.1 Ų | 64.1 | 53% | 0.532 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -61.5 | -20.6 | 177.5 | -74.8 | 179.5 | -179.6 | -163.7 | -1.9 | 115 | K268 L270 H274 T281 E282 | K268-R272 WeakPolarHBondContact O-CB 3.34Å; K268-R272 VanDerWaalsContact O-CG 3.27Å; K268-R272 WeakPolarHBondContact O-CG 3.32Å; K268-R272 PolarHBondContact O-N 2.89Å; L270-R272 VanDerWaalsContact C-N 3.27Å; L270-R272 PolarHBondContact O-N 3.44Å; R272-H274 VanDerWaalsContact C-N 3.33Å; R272-T281 HydrophobicContact CB-CG2 4.42Å; R272-T281 HydrophobicContact CG-CG2 3.27Å; R272-E282 IonicContact CZ-OE1 2.94Å; R272-E282 IonicContact NE-OE1 2.76Å; R272-E282 PolarHBondContact NE-OE1 2.92Å; R272-E282 IonicContact NH2-OE1 2.69Å; R272-E282 PolarHBondContact NH2-OE1 2.69Å |
| 273 | R | 87.8 | Confident | 86.8 | Confident | 180 Ų | 180 | 60.2 Ų | 60.2 | 68% | 0.679 | 30% | 0.297 | S | S | * | . | H | α-helix | trans | -75.9 | -25 | 173.7 | -63.2 | 166.7 | -169.3 | -165.9 | -2.1 | 112.3 | P269 L270 A271 | P269-R273 WeakPolarHBondContact O-CG 3.16Å; P269-R273 PolarHBondContact O-NE 2.64Å; P269-R273 VanDerWaalsContact O-NE 3.11Å; L270-R273 WeakPolarHBondContact O-CB 3.28Å; L270-R273 PolarHBondContact O-N 3Å; A271-R273 PolarHBondContact O-N 3.38Å; A271-R273 VanDerWaalsContact O-N 3.17Å |
| 274 | H | 84.1 | Confident | 87.2 | Confident | 50 Ų | 50 | 57.8 Ų | 57.8 | 23% | 0.231 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -107.6 | -29.2 | -170.9 | -63.3 | -65.6 | 0 | 0 | 0 | 113.1 | L270 A271 R272 L308 M312 | L270-H274 PolarHBondContact O-CD2 3.49Å; A271-H274 PolarHBondContact O-N 3.34Å; R272-H274 VanDerWaalsContact C-N 3.33Å; H274-L308 VanDerWaalsContact NE2-CD2 3.28Å; H274-L308 WeakPolarHBondContact NE2-CD2 3.47Å; H274-M312 HydrophobicContact CB-CE 3.69Å; H274-M312 HydrophobicContact CB-CG 4.44Å; H274-M312 HydrophobicContact CB-SD 3.59Å; H274-M312 VanDerWaalsContact CB-SD 3.59Å; H274-M312 PolarHBondContact ND1-SD 2.91Å |
| 275 | L | 85.1 | Confident | 87.2 | Confident | 26 Ų | 26 | 57.8 Ų | 57.8 | 14% | 0.136 | 28% | 0.284 | C | S | . | . | S | Bend | trans | -123.4 | 55.4 | 174.3 | -64.8 | 179.7 | 0 | 0 | 0 | 111.9 | A271 Q277 S278 D280 T281 L284 | A271-L275 PolarHBondContact O-N 3.43Å; L275-Q277 PolarHBondContact O-N 2.9Å; L275-S278 PolarHBondContact O-N 3.07Å; L275-S278 VanDerWaalsContact O-N 3.08Å; L275-D280 HydrophobicContact CD1-CB 3.7Å; L275-T281 PolarHBondContact O-OG1 3.48Å; L275-L284 HydrophobicContact CD1-CB 4.23Å; L275-L284 HydrophobicContact CD1-CD2 3.57Å; L275-L284 HydrophobicContact CG-CD2 4.07Å |
| 276 | P | 78.1 | Confident | 87.3 | Confident | 91 Ų | 91 | 55.8 Ų | 55.8 | 59% | 0.591 | 28% | 0.275 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.2 | 124.7 | -178.8 | 26.2 | -35 | 0 | 0 | 0 | 111.2 | S278 | P276-S278 VanDerWaalsContact C-N 3.3Å; P276-S278 PolarHBondContact O-N 2.9Å |
| 277 | Q | 69.7 | Low | 87.5 | Confident | 203 Ų | 203 | 49.8 Ų | 49.8 | 95% | 0.949 | 25% | 0.247 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 67.2 | 14.5 | -177.7 | -48.8 | -176.6 | 8.3 | 0 | 0 | 116.1 | L275 | L275-Q277 PolarHBondContact O-N 2.9Š|
| 278 | S | 81.1 | Confident | 87.5 | Confident | 36 Ų | 36 | 48 Ų | 48 | 25% | 0.252 | 24% | 0.24 | S | C | . | . | trans | -88.3 | 140.2 | 171.2 | -163.1 | 0 | 0 | 0 | 0 | 112.3 | L275 P276 D280 T281 | L275-S278 PolarHBondContact O-N 3.07Å; L275-S278 VanDerWaalsContact O-N 3.08Å; P276-S278 VanDerWaalsContact C-N 3.3Å; P276-S278 PolarHBondContact O-N 2.9Å; S278-D280 PolarHBondContact O-N 2.98Å; S278-D280 WeakPolarHBondContact OG-CB 3.32Å; S278-D280 PolarHBondContact OG-N 3.33Å; S278-T281 WeakPolarHBondContact O-CB 3.48Å; S278-T281 PolarHBondContact O-N 3.34Å; S278-T281 PolarHBondContact O-OG1 2.96Å | ||
| 279 | P | 74.3 | Confident | 87.4 | Confident | 104 Ų | 104 | 47.6 Ų | 47.6 | 68% | 0.675 | 24% | 0.238 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -63.6 | -21.3 | 168.3 | 29.2 | -36.5 | 0 | 0 | 0 | 112.9 | T281 | P279-T281 PolarHBondContact O-N 2.82Å; P279-T281 VanDerWaalsContact O-N 3.08Å |
| 280 | D | 89.4 | Confident | 87.3 | Confident | 25 Ų | 25 | 45.9 Ų | 45.9 | 13% | 0.134 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -60.9 | -12 | 172.2 | -69.4 | 36.2 | 0 | 0 | 0 | 113.7 | L275 S278 E282 A283 L284 W315 R323 Y327 | L275-D280 HydrophobicContact CD1-CB 3.7Å; S278-D280 PolarHBondContact O-N 2.98Å; S278-D280 WeakPolarHBondContact OG-CB 3.32Å; S278-D280 PolarHBondContact OG-N 3.33Å; D280-E282 PolarHBondContact O-N 2.86Å; D280-A283 PolarHBondContact O-N 2.88Å; D280-L284 VanDerWaalsContact O-CB 3.26Å; D280-L284 WeakPolarHBondContact O-CB 3.35Å; D280-L284 PolarHBondContact O-N 2.89Å; D280-W315 HydrophobicContact CB-CZ2 4Å; D280-W315 PolarHBondContact OD2-NE1 3.19Å; D280-R323 IonicContact OD2-CZ 2.64Å; D280-R323 IonicContact OD2-NH1 2.86Å; D280-R323 PolarHBondContact OD2-NH1 3.19Å; D280-Y327 PolarHBondContact OD1-OH 3.38Å; D280-Y327 VanDerWaalsContact OD1-OH 3.14Å |
| 281 | T | 93.6 | Very high | 87.1 | Confident | 5 Ų | 5 | 44.8 Ų | 44.8 | 3% | 0.031 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -57.2 | -51.9 | -173.2 | -68.7 | 0 | 0 | 0 | 0 | 112.6 | A271 R272 L275 S278 P279 S285 | A271-T281 HydrophobicContact CB-CG2 4.3Å; A271-T281 WeakPolarHBondContact CB-O 3.48Å; R272-T281 HydrophobicContact CB-CG2 4.42Å; R272-T281 HydrophobicContact CG-CG2 3.27Å; L275-T281 PolarHBondContact O-OG1 3.48Å; S278-T281 WeakPolarHBondContact O-CB 3.48Å; S278-T281 PolarHBondContact O-N 3.34Å; S278-T281 PolarHBondContact O-OG1 2.96Å; P279-T281 PolarHBondContact O-N 2.82Å; P279-T281 VanDerWaalsContact O-N 3.08Å; T281-S285 PolarHBondContact O-N 3.17Å; T281-S285 PolarHBondContact O-OG 2.88Å |
| 282 | E | 94.4 | Very high | 86.8 | Confident | 28 Ų | 28 | 45.4 Ų | 45.4 | 13% | 0.131 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -72.8 | -32.3 | -176.7 | -75.9 | 60.8 | -140.7 | 0 | 0 | 111.4 | W264 R272 D280 S285 C286 A330 L334 | W264-E282 HydrophobicContact CZ2-CB 4.01Å; W264-E282 HydrophobicContact CZ2-CG 3.91Å; W264-E282 PolarHBondContact NE1-O 3.3Å; R272-E282 IonicContact CZ-OE1 2.94Å; R272-E282 IonicContact NE-OE1 2.76Å; R272-E282 PolarHBondContact NE-OE1 2.92Å; R272-E282 IonicContact NH2-OE1 2.69Å; R272-E282 PolarHBondContact NH2-OE1 2.69Å; D280-E282 PolarHBondContact O-N 2.86Å; E282-S285 WeakPolarHBondContact O-CB 3.44Å; E282-S285 PolarHBondContact O-N 2.86Å; E282-C286 PolarHBondContact O-N 2.84Å; E282-C286 VanDerWaalsContact O-N 3.1Å; E282-A330 HydrophobicContact CB-CB 3.97Å; E282-L334 HydrophobicContact CG-CD1 4.48Å; E282-L334 HydrophobicContact CG-CD2 4.37Å |
| 283 | A | 95.2 | Very high | 86.6 | Confident | 1 Ų | 1 | 43.4 Ų | 43.4 | 1% | 0.008 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -73.9 | -38 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | D280 S285 C286 F287 W315 F326 Y327 | D280-A283 PolarHBondContact O-N 2.88Å; A283-S285 VanDerWaalsContact C-N 3.26Å; A283-S285 PolarHBondContact O-N 3.43Å; A283-C286 VanDerWaalsContact O-CB 3.29Å; A283-C286 WeakPolarHBondContact O-CB 3.32Å; A283-C286 PolarHBondContact O-N 3.26Å; A283-C286 VanDerWaalsContact O-N 3.16Å; A283-F287 PolarHBondContact O-N 3.03Å; A283-W315 HydrophobicContact CB-CH2 3.73Å; A283-W315 HydrophobicContact CB-CZ2 4.29Å; A283-F326 HydrophobicContact CB-CB 4.21Å; A283-Y327 HydrophobicContact CB-CD1 3.46Å; A283-Y327 VanDerWaalsContact CB-CD1 3.46Å; A283-Y327 HydrophobicContact CB-CD2 4.5Å; A283-Y327 HydrophobicContact CB-CE1 3.63Å; A283-Y327 HydrophobicContact CB-CG 3.92Å |
| 284 | L | 94.4 | Very high | 86.3 | Confident | 2 Ų | 2 | 37 Ų | 37 | 1% | 0.01 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -61.3 | -38.9 | 168.4 | 173.3 | 60.7 | 0 | 0 | 0 | 110.4 | A271 L275 D280 C286 F287 L288 W315 | A271-L284 HydrophobicContact CB-CB 4.35Å; A271-L284 HydrophobicContact CB-CD2 3.93Å; A271-L284 HydrophobicContact CB-CG 4.06Å; L275-L284 HydrophobicContact CD1-CB 4.23Å; L275-L284 HydrophobicContact CD1-CD2 3.57Å; L275-L284 HydrophobicContact CG-CD2 4.07Å; D280-L284 VanDerWaalsContact O-CB 3.26Å; D280-L284 WeakPolarHBondContact O-CB 3.35Å; D280-L284 PolarHBondContact O-N 2.89Å; L284-C286 VanDerWaalsContact C-N 3.25Å; L284-C286 PolarHBondContact O-N 3.33Å; L284-F287 HydrophobicContact CD1-CD1 4.2Å; L284-F287 PolarHBondContact O-N 2.97Å; L284-L288 HydrophobicContact CD1-CG 4.18Å; L284-L288 HydrophobicContact CG-CD1 4.29Å; L284-L288 HydrophobicContact CG-CG 4.43Å; L284-L288 VanDerWaalsContact O-CG 3.27Å; L284-L288 WeakPolarHBondContact O-CG 3.14Å; L284-L288 PolarHBondContact O-N 2.92Å; L284-W315 HydrophobicContact CB-CD2 4.36Å; L284-W315 HydrophobicContact CB-CZ2 4.44Å; L284-W315 HydrophobicContact CD1-CB 3.93Å; L284-W315 HydrophobicContact CD1-CD2 4Å; L284-W315 HydrophobicContact CD1-CE3 4.39Å; L284-W315 HydrophobicContact CD1-CG 3.79Å |
| 285 | S | 93.1 | Very high | 86.1 | Confident | 0 Ų | 0 | 35.6 Ų | 35.6 | 0% | 0 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -62.5 | -34.4 | 176 | -54.2 | 0 | 0 | 0 | 0 | 112 | K268 A271 T281 E282 A283 | K268-S285 WeakPolarHBondContact CA-OG 3.25Å; K268-S285 WeakPolarHBondContact CG-OG 3.45Å; A271-S285 VanDerWaalsContact CB-OG 3.27Å; A271-S285 WeakPolarHBondContact CB-OG 3.19Å; T281-S285 PolarHBondContact O-N 3.17Å; T281-S285 PolarHBondContact O-OG 2.88Å; E282-S285 WeakPolarHBondContact O-CB 3.44Å; E282-S285 PolarHBondContact O-N 2.86Å; A283-S285 VanDerWaalsContact C-N 3.26Å; A283-S285 PolarHBondContact O-N 3.43Å |
| 286 | C | 91.9 | Very high | 85.6 | Confident | 0 Ų | 0 | 37 Ų | 37 | 0% | 0 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -67.4 | -48.2 | 169.9 | -75.9 | 0 | 0 | 0 | 0 | 112.2 | W264 E282 A283 L284 L288 I289 P290 F326 M329 A330 | W264-C286 PolarHBondContact NE1-SG 3.3Å; W264-C286 VanDerWaalsContact NE1-SG 3.38Å; E282-C286 PolarHBondContact O-N 2.84Å; E282-C286 VanDerWaalsContact O-N 3.1Å; A283-C286 VanDerWaalsContact O-CB 3.29Å; A283-C286 WeakPolarHBondContact O-CB 3.32Å; A283-C286 PolarHBondContact O-N 3.26Å; A283-C286 VanDerWaalsContact O-N 3.16Å; L284-C286 VanDerWaalsContact C-N 3.25Å; L284-C286 PolarHBondContact O-N 3.33Å; C286-L288 VanDerWaalsContact C-N 3.27Å; C286-L288 PolarHBondContact O-N 3.48Å; C286-I289 WeakPolarHBondContact O-CB 3.25Å; C286-I289 PolarHBondContact O-N 2.93Å; C286-I289 VanDerWaalsContact O-N 3.15Å; C286-P290 WeakPolarHBondContact O-CD 3.4Å; C286-F326 HydrophobicContact CB-CB 4.14Å; C286-F326 HydrophobicContact CB-CD1 4.09Å; C286-M329 HydrophobicContact CB-CB 4.49Å; C286-M329 HydrophobicContact CB-CE 3.52Å; C286-A330 VanDerWaalsContact SG-CA 3.54Å; C286-A330 PolarHBondContact SG-N 2.89Å; C286-A330 VanDerWaalsContact SG-N 3.41Å |
| 287 | F | 92.8 | Very high | 85.7 | Confident | 6 Ų | 6 | 38.1 Ų | 38.1 | 3% | 0.026 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -59.8 | -34.5 | 179 | 179.6 | -91.9 | 0 | 0 | 0 | 113.3 | A283 L284 I289 P290 V291 A311 E314 W315 T318 F326 | A283-F287 PolarHBondContact O-N 3.03Å; L284-F287 HydrophobicContact CD1-CD1 4.2Å; L284-F287 PolarHBondContact O-N 2.97Å; F287-I289 PolarHBondContact O-N 3.5Å; F287-P290 WeakPolarHBondContact O-CD 3.27Å; F287-V291 HydrophobicContact CD1-CG2 4.02Å; F287-V291 HydrophobicContact CE1-CB 4.31Å; F287-V291 HydrophobicContact CE1-CG1 4.39Å; F287-V291 HydrophobicContact CE1-CG2 3.68Å; F287-V291 HydrophobicContact CE2-CG2 4.22Å; F287-V291 HydrophobicContact CG-CG2 4.43Å; F287-V291 HydrophobicContact CZ-CG2 3.8Å; F287-V291 WeakPolarHBondContact O-CB 3.48Å; F287-V291 WeakPolarHBondContact O-CG2 3.27Å; F287-V291 PolarHBondContact O-N 2.82Å; F287-A311 HydrophobicContact CE1-CB 4.47Å; F287-A311 WeakPolarHBondContact CE1-O 3.39Å; F287-E314 HydrophobicContact CE1-CB 4.36Å; F287-E314 HydrophobicContact CZ-CB 3.98Å; F287-W315 HydrophobicContact CB-CE3 3.68Å; F287-W315 HydrophobicContact CB-CZ3 3.73Å; F287-W315 HydrophobicContact CD1-CB 4.27Å; F287-W315 AromaticContact CD1-CE3 3.98Å; F287-W315 HydrophobicContact CD1-CE3 3.98Å; F287-W315 AromaticContact CD2-CE3 3.66Å; F287-W315 HydrophobicContact CD2-CE3 3.66Å; F287-W315 HydrophobicContact CD2-CZ3 4.01Å; F287-W315 HydrophobicContact CE1-CB 4.03Å; F287-W315 HydrophobicContact CE2-CE3 4.22Å; F287-W315 AromaticContact CG-CE3 3.52Å; F287-W315 HydrophobicContact CG-CE3 3.52Å; F287-W315 AromaticContact CG-CZ3 3.99Å; F287-W315 HydrophobicContact CG-CZ3 3.99Å; F287-W315 HydrophobicContact CZ-CB 4.45Å; F287-T318 HydrophobicContact CE2-CG2 4.36Å; F287-F326 HydrophobicContact CB-CD1 3.92Å; F287-F326 HydrophobicContact CB-CE1 4.15Å; F287-F326 HydrophobicContact CB-CG 4.15Å; F287-F326 HydrophobicContact CD2-CD1 4.47Å; F287-F326 HydrophobicContact CD2-CD2 4.1Å; F287-F326 HydrophobicContact CD2-CE1 4.12Å; F287-F326 AromaticContact CD2-CE2 3.71Å; F287-F326 HydrophobicContact CD2-CE2 3.71Å; F287-F326 HydrophobicContact CD2-CG 4.46Å; F287-F326 AromaticContact CD2-CZ 3.71Å; F287-F326 HydrophobicContact CD2-CZ 3.71Å; F287-F326 HydrophobicContact CE2-CE2 4.4Å; F287-F326 HydrophobicContact CE2-CZ 4.47Å |
| 288 | L | 88.3 | Confident | 85.9 | Confident | 0 Ų | 0 | 37.9 Ų | 37.9 | 0% | 0 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -62.3 | -24.1 | 177.3 | -74.9 | 170.4 | 0 | 0 | 0 | 113.5 | Y267 L284 C286 L292 L308 A311 | Y267-L288 HydrophobicContact CD2-CB 3.73Å; Y267-L288 HydrophobicContact CE2-CB 4.28Å; Y267-L288 HydrophobicContact CG-CB 4.22Å; L284-L288 HydrophobicContact CD1-CG 4.18Å; L284-L288 HydrophobicContact CG-CD1 4.29Å; L284-L288 HydrophobicContact CG-CG 4.43Å; L284-L288 VanDerWaalsContact O-CG 3.27Å; L284-L288 WeakPolarHBondContact O-CG 3.14Å; L284-L288 PolarHBondContact O-N 2.92Å; C286-L288 VanDerWaalsContact C-N 3.27Å; C286-L288 PolarHBondContact O-N 3.48Å; L288-L292 HydrophobicContact CB-CD1 4.1Å; L288-L292 HydrophobicContact CB-CG 4.33Å; L288-L292 HydrophobicContact CD2-CD1 3.97Å; L288-L292 HydrophobicContact CD2-CD2 4.29Å; L288-L292 HydrophobicContact CD2-CG 3.95Å; L288-L292 WeakPolarHBondContact O-CB 3.38Å; L288-L292 VanDerWaalsContact O-CG 3.27Å; L288-L292 WeakPolarHBondContact O-CG 3.27Å; L288-L292 PolarHBondContact O-N 2.69Å; L288-L308 HydrophobicContact CD1-CD1 3.79Å; L288-L308 HydrophobicContact CD2-CD1 3.56Å; L288-L308 HydrophobicContact CG-CD1 4.36Å; L288-A311 HydrophobicContact CD2-CB 3.49Å; L288-A311 VanDerWaalsContact CD2-CB 3.49Å |
| 289 | I | 88.3 | Confident | 85.9 | Confident | 6 Ų | 6 | 39.3 Ų | 39.3 | 3% | 0.031 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -64.9 | -62 | -177.3 | -58.5 | 168.4 | 0 | 0 | 0 | 112.3 | N260 L263 W264 Y267 C286 F287 V291 R293 F333 | N260-I289 HydrophobicContact CB-CD1 4.34Å; N260-I289 WeakPolarHBondContact O-CD1 3.26Å; N260-I289 WeakPolarHBondContact OD1-CG2 3.32Å; L263-I289 HydrophobicContact CB-CD1 4.49Å; L263-I289 HydrophobicContact CB-CG1 4.24Å; L263-I289 HydrophobicContact CD1-CG2 4.24Å; W264-I289 HydrophobicContact CB-CD1 4.08Å; Y267-I289 HydrophobicContact CD2-CG1 3.97Å; Y267-I289 HydrophobicContact CE2-CG1 4.06Å; C286-I289 WeakPolarHBondContact O-CB 3.25Å; C286-I289 PolarHBondContact O-N 2.93Å; C286-I289 VanDerWaalsContact O-N 3.15Å; F287-I289 PolarHBondContact O-N 3.5Å; I289-V291 VanDerWaalsContact C-N 3.34Å; I289-V291 PolarHBondContact O-N 3.3Å; I289-R293 VanDerWaalsContact O-CB 3.27Å; I289-R293 WeakPolarHBondContact O-CB 3.45Å; I289-R293 PolarHBondContact O-N 2.95Å; I289-F333 HydrophobicContact CD1-CE2 4.1Å |
| 290 | P | 85.3 | Confident | 86.3 | Confident | 35 Ų | 35 | 39.3 Ų | 39.3 | 23% | 0.227 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -66 | -37.6 | 177.1 | 26.2 | -34.6 | 0 | 0 | 0 | 111.8 | C286 F287 S294 F326 | C286-P290 WeakPolarHBondContact O-CD 3.4Å; F287-P290 WeakPolarHBondContact O-CD 3.27Å; P290-S294 WeakPolarHBondContact O-CB 3.47Å; P290-S294 PolarHBondContact O-N 3.05Å; P290-S294 PolarHBondContact O-OG 3.49Å; P290-F326 HydrophobicContact CG-CE1 4.24Å |
| 291 | V | 84.1 | Confident | 86.2 | Confident | 2 Ų | 2 | 44 Ų | 44 | 1% | 0.012 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -70.7 | -46.8 | -173.5 | 174.6 | 0 | 0 | 0 | 0 | 112.2 | F8 F287 I289 R293 S294 L295 A311 | F8-V291 HydrophobicContact CD1-CG2 3.97Å; F8-V291 HydrophobicContact CE1-CB 4.37Å; F8-V291 HydrophobicContact CE1-CG1 3.84Å; F8-V291 HydrophobicContact CE1-CG2 4Å; F8-V291 HydrophobicContact CZ-CG1 4.32Å; F287-V291 HydrophobicContact CD1-CG2 4.02Å; F287-V291 HydrophobicContact CE1-CB 4.31Å; F287-V291 HydrophobicContact CE1-CG1 4.39Å; F287-V291 HydrophobicContact CE1-CG2 3.68Å; F287-V291 HydrophobicContact CE2-CG2 4.22Å; F287-V291 HydrophobicContact CG-CG2 4.43Å; F287-V291 HydrophobicContact CZ-CG2 3.8Å; F287-V291 WeakPolarHBondContact O-CB 3.48Å; F287-V291 WeakPolarHBondContact O-CG2 3.27Å; F287-V291 PolarHBondContact O-N 2.82Å; I289-V291 VanDerWaalsContact C-N 3.34Å; I289-V291 PolarHBondContact O-N 3.3Å; V291-R293 VanDerWaalsContact C-N 3.34Å; V291-S294 PolarHBondContact O-N 2.74Å; V291-L295 HydrophobicContact CG1-CD1 3.81Å; V291-L295 HydrophobicContact CG1-CG 4.32Å; V291-L295 VanDerWaalsContact O-CB 3.26Å; V291-L295 WeakPolarHBondContact O-CB 3.34Å; V291-L295 VanDerWaalsContact O-CG 3.22Å; V291-L295 WeakPolarHBondContact O-CG 3.22Å; V291-L295 PolarHBondContact O-N 2.92Å; V291-A311 HydrophobicContact CB-CB 4.38Å; V291-A311 HydrophobicContact CG1-CB 3.53Å |
| 292 | L | 82.6 | Confident | 85.9 | Confident | 12 Ų | 12 | 45.1 Ų | 45.1 | 6% | 0.063 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -68.3 | -34.6 | 177.1 | -65.6 | -179.6 | 0 | 0 | 0 | 111.9 | Y267 L288 L295 A296 L304 G307 A311 | Y267-L292 HydrophobicContact CD1-CD1 4.39Å; Y267-L292 HydrophobicContact CE1-CD1 3.9Å; Y267-L292 HydrophobicContact CE2-CD1 4.09Å; L288-L292 HydrophobicContact CB-CD1 4.1Å; L288-L292 HydrophobicContact CB-CG 4.33Å; L288-L292 HydrophobicContact CD2-CD1 3.97Å; L288-L292 HydrophobicContact CD2-CD2 4.29Å; L288-L292 HydrophobicContact CD2-CG 3.95Å; L288-L292 WeakPolarHBondContact O-CB 3.38Å; L288-L292 VanDerWaalsContact O-CG 3.27Å; L288-L292 WeakPolarHBondContact O-CG 3.27Å; L288-L292 PolarHBondContact O-N 2.69Å; L292-L295 PolarHBondContact O-N 3.38Å; L292-A296 VanDerWaalsContact O-CB 3.27Å; L292-A296 WeakPolarHBondContact O-CB 3.4Å; L292-A296 PolarHBondContact O-N 3.27Å; L292-L304 HydrophobicContact CD1-CD1 3.81Å; L292-G307 VanDerWaalsContact CD2-C 3.41Å; L292-A311 HydrophobicContact CD2-CB 4.42Å |
| 293 | R | 85.3 | Confident | 85.6 | Confident | 100 Ų | 100 | 47.4 Ų | 47.4 | 38% | 0.377 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -60.2 | -53.8 | 173.5 | -169.6 | 179 | -66.9 | 153.3 | 1.3 | 110.7 | N260 I289 V291 L295 A296 R297 | N260-R293 PolarHBondContact OD1-NH2 3.47Å; I289-R293 VanDerWaalsContact O-CB 3.27Å; I289-R293 WeakPolarHBondContact O-CB 3.45Å; I289-R293 PolarHBondContact O-N 2.95Å; V291-R293 VanDerWaalsContact C-N 3.34Å; R293-L295 PolarHBondContact O-N 3.46Å; R293-A296 PolarHBondContact O-N 3.04Å; R293-R297 WeakPolarHBondContact O-CG 3.26Å; R293-R297 PolarHBondContact O-N 3.07Å; R293-R297 VanDerWaalsContact O-N 3.12Å |
| 294 | S | 81.8 | Confident | 85.2 | Confident | 44 Ų | 44 | 52.1 Ų | 52.1 | 31% | 0.308 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -64.3 | -35.8 | 178.3 | -66.3 | 0 | 0 | 0 | 0 | 113.7 | P290 V291 R298 | P290-S294 WeakPolarHBondContact O-CB 3.47Å; P290-S294 PolarHBondContact O-N 3.05Å; P290-S294 PolarHBondContact O-OG 3.49Å; V291-S294 PolarHBondContact O-N 2.74Å; S294-R298 WeakPolarHBondContact O-CB 3.27Å; S294-R298 WeakPolarHBondContact O-CG 3.27Å; S294-R298 PolarHBondContact O-N 3.15Å; S294-R298 VanDerWaalsContact O-N 3.08Å |
| 295 | L | 78.7 | Confident | 84.8 | Confident | 22 Ų | 22 | 58.3 Ų | 58.3 | 12% | 0.115 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -69.1 | -39 | 175.4 | -76.9 | 176.8 | 0 | 0 | 0 | 112.6 | V291 L292 R293 R298 K299 M302 R310 | V291-L295 HydrophobicContact CG1-CD1 3.81Å; V291-L295 HydrophobicContact CG1-CG 4.32Å; V291-L295 VanDerWaalsContact O-CB 3.26Å; V291-L295 WeakPolarHBondContact O-CB 3.34Å; V291-L295 VanDerWaalsContact O-CG 3.22Å; V291-L295 WeakPolarHBondContact O-CG 3.22Å; V291-L295 PolarHBondContact O-N 2.92Å; L292-L295 PolarHBondContact O-N 3.38Å; R293-L295 PolarHBondContact O-N 3.46Å; L295-R298 PolarHBondContact O-N 2.85Å; L295-K299 PolarHBondContact O-N 2.9Å; L295-M302 HydrophobicContact CB-CE 3.7Å; L295-M302 HydrophobicContact CD1-CE 4.27Å; L295-M302 HydrophobicContact CD2-CE 4.18Å; L295-M302 HydrophobicContact CG-CE 4.27Å; L295-R310 HydrophobicContact CD1-CB 3.92Å |
| 296 | A | 75.9 | Confident | 84.4 | Confident | 56 Ų | 56 | 61.3 Ų | 61.3 | 46% | 0.463 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -64.2 | -41.3 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | L292 R293 K299 P300 | L292-A296 VanDerWaalsContact O-CB 3.27Å; L292-A296 WeakPolarHBondContact O-CB 3.4Å; L292-A296 PolarHBondContact O-N 3.27Å; R293-A296 PolarHBondContact O-N 3.04Å; A296-K299 CarbonylContact O-C 3.57Å; A296-P300 WeakPolarHBondContact O-CA 3.17Å; A296-P300 WeakPolarHBondContact O-CD 3.4Å; A296-P300 WeakPolarHBondContact O-CG 3.42Å |
| 297 | R | 79.6 | Confident | 84.1 | Confident | 113 Ų | 113 | 61.5 Ų | 61.5 | 43% | 0.426 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -63.6 | -47.6 | 174.5 | -64.2 | -169.6 | -124.5 | -122.7 | 47.1 | 112.6 | R293 K299 P300 E539 | R293-R297 WeakPolarHBondContact O-CG 3.26Å; R293-R297 PolarHBondContact O-N 3.07Å; R293-R297 VanDerWaalsContact O-N 3.12Å; R297-K299 VanDerWaalsContact C-N 3.31Å; R297-K299 PolarHBondContact O-N 3.04Å; R297-P300 WeakPolarHBondContact O-CD 3.49Å; R297-E539 VanDerWaalsContact CD-CD 3.45Å; R297-E539 WeakPolarHBondContact CD-OE1 3.49Å; R297-E539 IonicContact CZ-OE1 3.65Å; R297-E539 IonicContact CZ-OE2 3.47Å; R297-E539 IonicContact NE-OE1 2.69Å; R297-E539 PolarHBondContact NE-OE1 3.23Å; R297-E539 IonicContact NE-OE2 2.8Å; R297-E539 IonicContact NH1-OE1 3.86Å; R297-E539 PolarHBondContact NH1-OE1 3.12Å; R297-E539 IonicContact NH1-OE2 3.94Å; R297-E539 PolarHBondContact NH1-OE2 2.83Å; R297-E539 IonicContact NH2-OE1 2.69Å; R297-E539 PolarHBondContact NH2-OE1 3.26Å; R297-E539 IonicContact NH2-OE2 3.05Å; R297-E539 PolarHBondContact NH2-OE2 3.13Å |
| 298 | R | 74.9 | Confident | 83.8 | Confident | 199 Ų | 199 | 61.7 Ų | 61.7 | 75% | 0.751 | 32% | 0.315 | S | S | * | . | H | α-helix | trans | -70.4 | -21.2 | -179 | -71 | -179.7 | 176.6 | -160.1 | -3.1 | 114.2 | S294 L295 | S294-R298 WeakPolarHBondContact O-CB 3.27Å; S294-R298 WeakPolarHBondContact O-CG 3.27Å; S294-R298 PolarHBondContact O-N 3.15Å; S294-R298 VanDerWaalsContact O-N 3.08Å; L295-R298 PolarHBondContact O-N 2.85Å |
| 299 | K | 81.3 | Confident | 83.6 | Confident | 66 Ų | 66 | 68.7 Ų | 68.7 | 29% | 0.287 | 34% | 0.342 | S | S | . | . | trans | -148.5 | 85.5 | 171.3 | -172.8 | -170.6 | 151.6 | -168.8 | 0 | 110.1 | L295 A296 R297 T301 M302 E306 | L295-K299 PolarHBondContact O-N 2.9Å; A296-K299 CarbonylContact O-C 3.57Å; R297-K299 VanDerWaalsContact C-N 3.31Å; R297-K299 PolarHBondContact O-N 3.04Å; K299-T301 PolarHBondContact O-N 2.92Å; K299-T301 VanDerWaalsContact O-N 3.12Å; K299-M302 HydrophobicContact CB-CB 4.09Å; K299-M302 HydrophobicContact CD-CB 3.69Å; K299-M302 HydrophobicContact CD-CG 4.06Å; K299-M302 HydrophobicContact CD-SD 3.93Å; K299-M302 HydrophobicContact CG-CB 3.89Å; K299-M302 WeakPolarHBondContact O-CB 3.42Å; K299-M302 PolarHBondContact O-N 3.22Å; K299-E306 IonicContact NZ-OE1 2.69Å; K299-E306 IonicContact NZ-OE2 3.78Å; K299-E306 PolarHBondContact NZ-OE2 3.01Å | ||
| 300 | P | 82.1 | Confident | 83.4 | Confident | 104 Ų | 104 | 74.2 Ų | 74.2 | 68% | 0.675 | 36% | 0.362 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63 | -21.3 | -178.6 | -25.4 | 36 | 0 | 0 | 0 | 114.2 | A296 R297 M302 | A296-P300 WeakPolarHBondContact O-CA 3.17Å; A296-P300 WeakPolarHBondContact O-CD 3.4Å; A296-P300 WeakPolarHBondContact O-CG 3.42Å; R297-P300 WeakPolarHBondContact O-CD 3.49Å; P300-M302 VanDerWaalsContact C-N 3.27Å; P300-M302 PolarHBondContact O-N 2.84Å |
| 301 | T | 86.8 | Confident | 83.4 | Confident | 123 Ų | 123 | 72.5 Ų | 72.5 | 76% | 0.755 | 35% | 0.351 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.1 | 8.2 | 174.8 | 56.9 | 0 | 0 | 0 | 0 | 113.8 | K299 | K299-T301 PolarHBondContact O-N 2.92Å; K299-T301 VanDerWaalsContact O-N 3.12Å |
| 302 | M | 86.5 | Confident | 83.7 | Confident | 29 Ų | 29 | 73.9 Ų | 73.9 | 14% | 0.143 | 36% | 0.358 | C | S | . | . | trans | -84 | 137.3 | -179.9 | -163.3 | 154.1 | 67.1 | 0 | 0 | 112.2 | L295 K299 P300 E306 R310 | L295-M302 HydrophobicContact CB-CE 3.7Å; L295-M302 HydrophobicContact CD1-CE 4.27Å; L295-M302 HydrophobicContact CD2-CE 4.18Å; L295-M302 HydrophobicContact CG-CE 4.27Å; K299-M302 HydrophobicContact CB-CB 4.09Å; K299-M302 HydrophobicContact CD-CB 3.69Å; K299-M302 HydrophobicContact CD-CG 4.06Å; K299-M302 HydrophobicContact CD-SD 3.93Å; K299-M302 HydrophobicContact CG-CB 3.89Å; K299-M302 WeakPolarHBondContact O-CB 3.42Å; K299-M302 PolarHBondContact O-N 3.22Å; P300-M302 VanDerWaalsContact C-N 3.27Å; P300-M302 PolarHBondContact O-N 2.84Å; M302-E306 HydrophobicContact CG-CB 3.42Å; M302-E306 VanDerWaalsContact CG-CB 3.42Å; M302-E306 HydrophobicContact CG-CG 4.24Å; M302-E306 HydrophobicContact SD-CB 3.8Å; M302-R310 PolarHBondContact SD-NE 3.46Å; M302-R310 VanDerWaalsContact SD-NE 3.35Å | ||
| 303 | T | 89.6 | Confident | 83.8 | Confident | 76 Ų | 76 | 78.6 Ų | 78.6 | 47% | 0.466 | 38% | 0.375 | S | S | . | . | trans | -69.6 | 150.8 | 171.6 | 61.2 | 0 | 0 | 0 | 0 | 111.5 | E305 E306 G307 | T303-E305 PolarHBondContact O-N 3.16Å; T303-E306 WeakPolarHBondContact CB-OE1 3.27Å; T303-E306 PolarHBondContact N-OE1 3.11Å; T303-E306 PolarHBondContact O-N 2.96Å; T303-E306 WeakPolarHBondContact OG1-CB 3.39Å; T303-E306 VanDerWaalsContact OG1-CG 3.26Å; T303-E306 WeakPolarHBondContact OG1-CG 3.42Å; T303-E306 PolarHBondContact OG1-N 3.17Å; T303-E306 PolarHBondContact OG1-OE1 2.91Å; T303-G307 PolarHBondContact O-N 3.43Å | ||
| 304 | L | 85.2 | Confident | 83.9 | Confident | 100 Ų | 100 | 75.6 Ų | 75.6 | 52% | 0.524 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -57.5 | -32.8 | 174.3 | 178.7 | 60.9 | 0 | 0 | 0 | 112 | L270 L292 G307 L308 | L270-L304 HydrophobicContact CD1-CD2 4.21Å; L292-L304 HydrophobicContact CD1-CD1 3.81Å; L304-G307 PolarHBondContact O-N 3.08Å; L304-L308 VanDerWaalsContact O-CB 3.29Å; L304-L308 WeakPolarHBondContact O-CB 3.43Å; L304-L308 PolarHBondContact O-N 3.2Å |
| 305 | E | 87 | Confident | 84.4 | Confident | 131 Ų | 131 | 73.5 Ų | 73.5 | 61% | 0.612 | 35% | 0.351 | S | S | * | . | H | α-helix | trans | -68.6 | -45.8 | 176.5 | -179.7 | 164.2 | -168.7 | 0 | 0 | 112.3 | T303 G307 L308 W309 | T303-E305 PolarHBondContact O-N 3.16Å; E305-G307 VanDerWaalsContact C-N 3.26Å; E305-G307 PolarHBondContact O-N 2.91Å; E305-L308 PolarHBondContact O-N 2.8Å; E305-W309 VanDerWaalsContact O-CD1 3.23Å; E305-W309 PolarHBondContact O-N 3.46Å; E305-W309 PolarHBondContact OE1-NE1 3.12Å |
| 306 | E | 85.1 | Confident | 84.8 | Confident | 64 Ų | 64 | 77.5 Ų | 77.5 | 30% | 0.299 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -58.3 | -39.2 | 170.9 | -76.8 | 167.5 | -89.8 | 0 | 0 | 112.3 | K299 M302 T303 R310 | K299-E306 IonicContact NZ-OE1 2.69Å; K299-E306 IonicContact NZ-OE2 3.78Å; K299-E306 PolarHBondContact NZ-OE2 3.01Å; M302-E306 HydrophobicContact CG-CB 3.42Å; M302-E306 VanDerWaalsContact CG-CB 3.42Å; M302-E306 HydrophobicContact CG-CG 4.24Å; M302-E306 HydrophobicContact SD-CB 3.8Å; T303-E306 WeakPolarHBondContact CB-OE1 3.27Å; T303-E306 PolarHBondContact N-OE1 3.11Å; T303-E306 PolarHBondContact O-N 2.96Å; T303-E306 WeakPolarHBondContact OG1-CB 3.39Å; T303-E306 VanDerWaalsContact OG1-CG 3.26Å; T303-E306 WeakPolarHBondContact OG1-CG 3.42Å; T303-E306 PolarHBondContact OG1-N 3.17Å; T303-E306 PolarHBondContact OG1-OE1 2.91Å; E306-R310 VanDerWaalsContact O-CG 3.26Å; E306-R310 WeakPolarHBondContact O-CG 3.48Å; E306-R310 PolarHBondContact O-N 3.33Å; E306-R310 VanDerWaalsContact O-N 3.12Å |
| 307 | G | 85.1 | Confident | 85.1 | Confident | 3 Ų | 3 | 80.1 Ų | 80.1 | 3% | 0.031 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -62.6 | -46.7 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | L292 T303 L304 E305 R310 A311 | L292-G307 VanDerWaalsContact CD2-C 3.41Å; T303-G307 PolarHBondContact O-N 3.43Å; L304-G307 PolarHBondContact O-N 3.08Å; E305-G307 VanDerWaalsContact C-N 3.26Å; E305-G307 PolarHBondContact O-N 2.91Å; G307-R310 PolarHBondContact O-N 2.95Å; G307-A311 WeakPolarHBondContact O-CB 3.45Å; G307-A311 PolarHBondContact O-N 3.1Å |
| 308 | L | 86.6 | Confident | 85.2 | Confident | 11 Ų | 11 | 76 Ų | 76 | 6% | 0.058 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -64.8 | -43.1 | 179.4 | -176.7 | 54.5 | 0 | 0 | 0 | 112 | L270 H274 L288 L304 E305 R310 A311 M312 | L270-L308 HydrophobicContact CB-CD2 3.95Å; L270-L308 HydrophobicContact CD1-CD2 4.44Å; H274-L308 VanDerWaalsContact NE2-CD2 3.28Å; H274-L308 WeakPolarHBondContact NE2-CD2 3.47Å; L288-L308 HydrophobicContact CD1-CD1 3.79Å; L288-L308 HydrophobicContact CD2-CD1 3.56Å; L288-L308 HydrophobicContact CG-CD1 4.36Å; L304-L308 VanDerWaalsContact O-CB 3.29Å; L304-L308 WeakPolarHBondContact O-CB 3.43Å; L304-L308 PolarHBondContact O-N 3.2Å; E305-L308 PolarHBondContact O-N 2.8Å; L308-R310 VanDerWaalsContact C-N 3.34Å; L308-R310 PolarHBondContact O-N 3.48Å; L308-A311 PolarHBondContact O-N 3.14Å; L308-M312 WeakPolarHBondContact O-CB 3.37Å; L308-M312 VanDerWaalsContact O-CG 3.32Å; L308-M312 WeakPolarHBondContact O-CG 3.44Å; L308-M312 PolarHBondContact O-N 2.8Å |
| 309 | W | 83.6 | Confident | 85.7 | Confident | 147 Ų | 147 | 69 Ų | 69 | 56% | 0.557 | 34% | 0.34 | S | S | * | . | H | α-helix | trans | -63.8 | -35 | 174.8 | -83.4 | 109.7 | 0 | 0 | 0 | 113.4 | E305 M312 R313 | E305-W309 VanDerWaalsContact O-CD1 3.23Å; E305-W309 PolarHBondContact O-N 3.46Å; E305-W309 PolarHBondContact OE1-NE1 3.12Å; W309-M312 HydrophobicContact CE3-SD 4.28Å; W309-M312 HydrophobicContact CZ3-CE 4.38Å; W309-R313 PolarHBondContact O-N 2.69Å |
| 310 | R | 84.4 | Confident | 86 | Confident | 121 Ų | 121 | 72 Ų | 72 | 46% | 0.457 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -68.1 | -52.7 | 172.3 | -71.9 | 168.4 | -172.5 | -121.9 | 3.1 | 110.7 | L295 M302 E306 G307 L308 M312 R313 E314 | L295-R310 HydrophobicContact CD1-CB 3.92Å; M302-R310 PolarHBondContact SD-NE 3.46Å; M302-R310 VanDerWaalsContact SD-NE 3.35Å; E306-R310 VanDerWaalsContact O-CG 3.26Å; E306-R310 WeakPolarHBondContact O-CG 3.48Å; E306-R310 PolarHBondContact O-N 3.33Å; E306-R310 VanDerWaalsContact O-N 3.12Å; G307-R310 PolarHBondContact O-N 2.95Å; L308-R310 VanDerWaalsContact C-N 3.34Å; L308-R310 PolarHBondContact O-N 3.48Å; R310-M312 VanDerWaalsContact C-N 3.26Å; R310-M312 PolarHBondContact O-N 3.26Å; R310-R313 WeakPolarHBondContact O-CB 3.28Å; R310-R313 PolarHBondContact O-N 3.08Å; R310-E314 PolarHBondContact O-N 3.36Å; R310-E314 VanDerWaalsContact O-N 3.12Å |
| 311 | A | 85.9 | Confident | 86.3 | Confident | 0 Ų | 0 | 74.2 Ų | 74.2 | 0% | 0 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -57 | -38.7 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | F287 L288 V291 L292 G307 L308 R313 E314 W315 | F287-A311 HydrophobicContact CE1-CB 4.47Å; F287-A311 WeakPolarHBondContact CE1-O 3.39Å; L288-A311 HydrophobicContact CD2-CB 3.49Å; L288-A311 VanDerWaalsContact CD2-CB 3.49Å; V291-A311 HydrophobicContact CB-CB 4.38Å; V291-A311 HydrophobicContact CG1-CB 3.53Å; L292-A311 HydrophobicContact CD2-CB 4.42Å; G307-A311 WeakPolarHBondContact O-CB 3.45Å; G307-A311 PolarHBondContact O-N 3.1Å; L308-A311 PolarHBondContact O-N 3.14Å; A311-R313 PolarHBondContact O-N 3.31Å; A311-E314 PolarHBondContact O-N 3.01Å; A311-W315 WeakPolarHBondContact O-CB 2.92Å; A311-W315 PolarHBondContact O-N 3.46Å |
| 312 | M | 89.2 | Confident | 86.2 | Confident | 30 Ų | 30 | 71.7 Ų | 71.7 | 15% | 0.148 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -59.3 | -42.7 | 171.9 | -82 | -177.4 | 66.3 | 0 | 0 | 113.3 | H274 L308 W309 R310 E314 W315 Q316 | H274-M312 HydrophobicContact CB-CE 3.69Å; H274-M312 HydrophobicContact CB-CG 4.44Å; H274-M312 HydrophobicContact CB-SD 3.59Å; H274-M312 VanDerWaalsContact CB-SD 3.59Å; H274-M312 PolarHBondContact ND1-SD 2.91Å; L308-M312 WeakPolarHBondContact O-CB 3.37Å; L308-M312 VanDerWaalsContact O-CG 3.32Å; L308-M312 WeakPolarHBondContact O-CG 3.44Å; L308-M312 PolarHBondContact O-N 2.8Å; W309-M312 HydrophobicContact CE3-SD 4.28Å; W309-M312 HydrophobicContact CZ3-CE 4.38Å; R310-M312 VanDerWaalsContact C-N 3.26Å; R310-M312 PolarHBondContact O-N 3.26Å; M312-E314 VanDerWaalsContact C-N 3.33Å; M312-W315 PolarHBondContact O-N 2.75Å; M312-Q316 WeakPolarHBondContact O-CG 3.42Å; M312-Q316 PolarHBondContact O-N 3.2Å; M312-Q316 VanDerWaalsContact O-N 3.1Å |
| 313 | R | 84.8 | Confident | 86.4 | Confident | 112 Ų | 112 | 71.2 Ų | 71.2 | 42% | 0.423 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -60.9 | -48.5 | 177.4 | -174.1 | -177.8 | -57 | -162.4 | 7.6 | 109.8 | E4 W309 R310 A311 W315 Q316 H317 | E4-R313 IonicContact OE1-CZ 3.97Å; E4-R313 IonicContact OE1-NH1 2.78Å; E4-R313 PolarHBondContact OE1-NH1 2.88Å; E4-R313 VanDerWaalsContact OE2-CD 3.23Å; E4-R313 WeakPolarHBondContact OE2-CD 3.47Å; E4-R313 IonicContact OE2-CZ 2.98Å; E4-R313 IonicContact OE2-NE 3.38Å; E4-R313 IonicContact OE2-NH1 3.45Å; E4-R313 PolarHBondContact OE2-NH1 3.43Å; W309-R313 PolarHBondContact O-N 2.69Å; R310-R313 WeakPolarHBondContact O-CB 3.28Å; R310-R313 PolarHBondContact O-N 3.08Å; A311-R313 PolarHBondContact O-N 3.31Å; R313-W315 PolarHBondContact O-N 2.69Å; R313-Q316 PolarHBondContact O-N 2.87Å; R313-Q316 VanDerWaalsContact O-N 3.12Å; R313-H317 PolarHBondContact O-N 2.89Å; R313-H317 VanDerWaalsContact O-N 3.17Å; R313-H317 PolarHBondContact O-ND1 2.96Å |
| 314 | E | 87.8 | Confident | 86.3 | Confident | 36 Ų | 36 | 72.1 Ų | 72.1 | 17% | 0.168 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -64.1 | -40.7 | -178.7 | -56.3 | -60.3 | 164.9 | 0 | 0 | 111.4 | F8 F287 R310 A311 M312 Q316 H317 T318 | F8-E314 HydrophobicContact CD2-CG 4.34Å; F8-E314 HydrophobicContact CE2-CB 4.13Å; F8-E314 HydrophobicContact CE2-CG 3.46Å; F8-E314 VanDerWaalsContact CE2-CG 3.46Å; F8-E314 HydrophobicContact CZ-CG 3.84Å; F287-E314 HydrophobicContact CE1-CB 4.36Å; F287-E314 HydrophobicContact CZ-CB 3.98Å; R310-E314 PolarHBondContact O-N 3.36Å; R310-E314 VanDerWaalsContact O-N 3.12Å; A311-E314 PolarHBondContact O-N 3.01Å; M312-E314 VanDerWaalsContact C-N 3.33Å; E314-Q316 VanDerWaalsContact C-N 3.31Å; E314-Q316 PolarHBondContact O-N 3.37Å; E314-H317 CarbonylContact O-C 3.59Å; E314-H317 PolarHBondContact O-N 3.16Å; E314-T318 WeakPolarHBondContact O-CB 3.14Å; E314-T318 PolarHBondContact O-N 3.1Å; E314-T318 PolarHBondContact O-OG1 2.91Å |
| 315 | W | 92 | Very high | 86.4 | Confident | 1 Ų | 1 | 70.6 Ų | 70.6 | 0% | 0.004 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -54.6 | -44.9 | 170.9 | 179.9 | -103 | 0 | 0 | 0 | 112.2 | D280 A283 L284 F287 A311 M312 R313 H317 T318 R323 F326 | D280-W315 HydrophobicContact CB-CZ2 4Å; D280-W315 PolarHBondContact OD2-NE1 3.19Å; A283-W315 HydrophobicContact CB-CH2 3.73Å; A283-W315 HydrophobicContact CB-CZ2 4.29Å; L284-W315 HydrophobicContact CB-CD2 4.36Å; L284-W315 HydrophobicContact CB-CZ2 4.44Å; L284-W315 HydrophobicContact CD1-CB 3.93Å; L284-W315 HydrophobicContact CD1-CD2 4Å; L284-W315 HydrophobicContact CD1-CE3 4.39Å; L284-W315 HydrophobicContact CD1-CG 3.79Å; F287-W315 HydrophobicContact CB-CE3 3.68Å; F287-W315 HydrophobicContact CB-CZ3 3.73Å; F287-W315 HydrophobicContact CD1-CB 4.27Å; F287-W315 AromaticContact CD1-CE3 3.98Å; F287-W315 HydrophobicContact CD1-CE3 3.98Å; F287-W315 AromaticContact CD2-CE3 3.66Å; F287-W315 HydrophobicContact CD2-CE3 3.66Å; F287-W315 HydrophobicContact CD2-CZ3 4.01Å; F287-W315 HydrophobicContact CE1-CB 4.03Å; F287-W315 HydrophobicContact CE2-CE3 4.22Å; F287-W315 AromaticContact CG-CE3 3.52Å; F287-W315 HydrophobicContact CG-CE3 3.52Å; F287-W315 AromaticContact CG-CZ3 3.99Å; F287-W315 HydrophobicContact CG-CZ3 3.99Å; F287-W315 HydrophobicContact CZ-CB 4.45Å; A311-W315 WeakPolarHBondContact O-CB 2.92Å; A311-W315 PolarHBondContact O-N 3.46Å; M312-W315 PolarHBondContact O-N 2.75Å; R313-W315 PolarHBondContact O-N 2.69Å; W315-H317 PolarHBondContact O-N 2.71Å; W315-T318 WeakPolarHBondContact O-CB 3.43Å; W315-T318 PolarHBondContact O-N 3.44Å; W315-R323 HydrophobicContact CE3-CG 4.3Å; W315-R323 HydrophobicContact CH2-CB 4.06Å; W315-R323 HydrophobicContact CH2-CG 3.72Å; W315-R323 HydrophobicContact CZ2-CG 4.12Å; W315-R323 HydrophobicContact CZ3-CB 4.37Å; W315-R323 HydrophobicContact CZ3-CG 3.81Å; W315-R323 PolarHBondContact O-NE 3.33Å; W315-R323 PolarHBondContact O-NH2 3.47Å; W315-F326 HydrophobicContact CH2-CB 4.5Å; W315-F326 HydrophobicContact CZ3-CB 4.27Å; W315-F326 HydrophobicContact CZ3-CD2 4.33Å; W315-F326 HydrophobicContact CZ3-CG 4.42Å |
| 316 | Q | 86.6 | Confident | 86.6 | Confident | 106 Ų | 106 | 65 Ų | 65 | 50% | 0.495 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -68.3 | -20.4 | 178.5 | -63.5 | -59.3 | -16.3 | 0 | 0 | 114 | M312 R313 E314 | M312-Q316 WeakPolarHBondContact O-CG 3.42Å; M312-Q316 PolarHBondContact O-N 3.2Å; M312-Q316 VanDerWaalsContact O-N 3.1Å; R313-Q316 PolarHBondContact O-N 2.87Å; R313-Q316 VanDerWaalsContact O-N 3.12Å; E314-Q316 VanDerWaalsContact C-N 3.31Å; E314-Q316 PolarHBondContact O-N 3.37Å |
| 317 | H | 82 | Confident | 86.9 | Confident | 110 Ų | 110 | 66 Ų | 66 | 51% | 0.509 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -98.8 | -14.4 | 175.1 | -64.1 | 72.1 | 0 | 0 | 0 | 113 | P5 R313 E314 W315 | P5-H317 HydrophobicContact CG-CB 4.15Å; R313-H317 PolarHBondContact O-N 2.89Å; R313-H317 VanDerWaalsContact O-N 3.17Å; R313-H317 PolarHBondContact O-ND1 2.96Å; E314-H317 CarbonylContact O-C 3.59Å; E314-H317 PolarHBondContact O-N 3.16Å; W315-H317 PolarHBondContact O-N 2.71Å |
| 318 | T | 83.4 | Confident | 87.2 | Confident | 28 Ų | 28 | 69.9 Ų | 69.9 | 17% | 0.172 | 32% | 0.321 | C | S | . | . | S | Bend | trans | -68.8 | 125.3 | 174.4 | -59.1 | 0 | 0 | 0 | 0 | 109.3 | F287 E314 W315 D322 R323 | F287-T318 HydrophobicContact CE2-CG2 4.36Å; E314-T318 WeakPolarHBondContact O-CB 3.14Å; E314-T318 PolarHBondContact O-N 3.1Å; E314-T318 PolarHBondContact O-OG1 2.91Å; W315-T318 WeakPolarHBondContact O-CB 3.43Å; W315-T318 PolarHBondContact O-N 3.44Å; T318-D322 HydrophobicContact CG2-CB 3.63Å; T318-R323 HydrophobicContact CG2-CG 3.85Å; T318-R323 PolarHBondContact O-NE 3.26Å; T318-R323 VanDerWaalsContact O-NE 3.1Å |
| 319 | S | 85.1 | Confident | 87.3 | Confident | 51 Ų | 51 | 72 Ų | 72 | 36% | 0.357 | 33% | 0.332 | S | S | . | . | trans | -70.5 | 159.1 | -174.2 | 85.9 | 0 | 0 | 0 | 0 | 112.2 | F321 D322 R323 | S319-F321 PolarHBondContact O-N 3.49Å; S319-F321 VanDerWaalsContact O-N 3.1Å; S319-F321 PolarHBondContact OG-N 3.23Å; S319-D322 WeakPolarHBondContact CB-OD2 3.47Å; S319-D322 PolarHBondContact N-OD2 3.38Å; S319-D322 PolarHBondContact O-N 3.15Å; S319-D322 VanDerWaalsContact O-N 3.09Å; S319-D322 PolarHBondContact OG-N 3.32Å; S319-D322 PolarHBondContact OG-OD2 3.41Å; S319-R323 WeakPolarHBondContact O-CG 3.02Å; S319-R323 PolarHBondContact O-N 3Å | ||
| 320 | N | 87.9 | Confident | 87.8 | Confident | 128 Ų | 128 | 65.3 Ų | 65.3 | 68% | 0.684 | 31% | 0.307 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.5 | -21.7 | 177.4 | -68.2 | -18.9 | 0 | 0 | 0 | 113.6 | ||
| 321 | F | 86.6 | Confident | 88.1 | Confident | 152 Ų | 152 | 65.7 Ų | 65.7 | 67% | 0.667 | 31% | 0.314 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -75.1 | -50.5 | 172.3 | -177.4 | -96.2 | 0 | 0 | 0 | 110.6 | S319 R323 M324 | S319-F321 PolarHBondContact O-N 3.49Å; S319-F321 VanDerWaalsContact O-N 3.1Å; S319-F321 PolarHBondContact OG-N 3.23Å; F321-R323 PolarHBondContact O-N 2.91Å; F321-M324 WeakPolarHBondContact O-CB 3.22Å; F321-M324 PolarHBondContact O-N 3.01Å |
| 322 | D | 85.8 | Confident | 88.3 | Confident | 69 Ų | 69 | 69.1 Ų | 69.1 | 37% | 0.369 | 33% | 0.329 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -65 | -25.3 | 178.9 | -47.1 | -52.6 | 0 | 0 | 0 | 112.3 | T318 S319 M324 | T318-D322 HydrophobicContact CG2-CB 3.63Å; S319-D322 WeakPolarHBondContact CB-OD2 3.47Å; S319-D322 PolarHBondContact N-OD2 3.38Å; S319-D322 PolarHBondContact O-N 3.15Å; S319-D322 VanDerWaalsContact O-N 3.09Å; S319-D322 PolarHBondContact OG-N 3.32Å; S319-D322 PolarHBondContact OG-OD2 3.41Å; D322-M324 VanDerWaalsContact C-N 3.28Å; D322-M324 PolarHBondContact O-N 2.95Å |
| 323 | R | 89.8 | Confident | 88.4 | Confident | 19 Ų | 19 | 68 Ų | 68 | 7% | 0.072 | 32% | 0.324 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -69.5 | -20.8 | 172.4 | -69.9 | -179.3 | -170.5 | -166.1 | 3.7 | 113.5 | D280 W315 T318 S319 F321 I325 F326 Y327 | D280-R323 IonicContact OD2-CZ 2.64Å; D280-R323 IonicContact OD2-NH1 2.86Å; D280-R323 PolarHBondContact OD2-NH1 3.19Å; W315-R323 HydrophobicContact CE3-CG 4.3Å; W315-R323 HydrophobicContact CH2-CB 4.06Å; W315-R323 HydrophobicContact CH2-CG 3.72Å; W315-R323 HydrophobicContact CZ2-CG 4.12Å; W315-R323 HydrophobicContact CZ3-CB 4.37Å; W315-R323 HydrophobicContact CZ3-CG 3.81Å; W315-R323 PolarHBondContact O-NE 3.33Å; W315-R323 PolarHBondContact O-NH2 3.47Å; T318-R323 HydrophobicContact CG2-CG 3.85Å; T318-R323 PolarHBondContact O-NE 3.26Å; T318-R323 VanDerWaalsContact O-NE 3.1Å; S319-R323 WeakPolarHBondContact O-CG 3.02Å; S319-R323 PolarHBondContact O-N 3Å; F321-R323 PolarHBondContact O-N 2.91Å; R323-I325 PolarHBondContact O-N 3.03Å; R323-F326 WeakPolarHBondContact O-CB 3.39Å; R323-F326 PolarHBondContact O-N 2.97Å; R323-Y327 HydrophobicContact CB-CD2 4.27Å; R323-Y327 HydrophobicContact CB-CE2 3.71Å; R323-Y327 VanDerWaalsContact O-CD2 3.22Å; R323-Y327 WeakPolarHBondContact O-CD2 3.28Å; R323-Y327 PolarHBondContact O-N 3.26Å |
| 324 | M | 89.3 | Confident | 88.8 | Confident | 96 Ų | 96 | 66.6 Ų | 66.6 | 47% | 0.473 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -55.6 | -48.5 | -171 | -167.7 | 168.5 | -67 | 0 | 0 | 112.6 | F321 D322 F326 Y327 E328 | F321-M324 WeakPolarHBondContact O-CB 3.22Å; F321-M324 PolarHBondContact O-N 3.01Å; D322-M324 VanDerWaalsContact C-N 3.28Å; D322-M324 PolarHBondContact O-N 2.95Å; M324-F326 PolarHBondContact O-N 2.69Å; M324-F326 VanDerWaalsContact O-N 3.13Å; M324-Y327 WeakPolarHBondContact O-CB 3.49Å; M324-Y327 PolarHBondContact O-N 3.42Å; M324-E328 PolarHBondContact O-N 3.18Å |
| 325 | I | 86.2 | Confident | 89 | Confident | 67 Ų | 67 | 70.7 Ų | 70.7 | 34% | 0.344 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -57.9 | -28.5 | 177.7 | -166.2 | 169.1 | 0 | 0 | 0 | 113.5 | L12 R323 M329 | L12-I325 HydrophobicContact CD1-CD1 3.57Å; R323-I325 PolarHBondContact O-N 3.03Å; I325-M329 WeakPolarHBondContact O-CB 3.45Å; I325-M329 PolarHBondContact O-N 3.33Å |
| 326 | F | 91.5 | Very high | 88.8 | Confident | 13 Ų | 13 | 74.8 Ų | 74.8 | 6% | 0.057 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -82.5 | -26.3 | 178.1 | -58.7 | -76.4 | 0 | 0 | 0 | 112.8 | I10 A283 C286 F287 P290 W315 R323 M324 M329 A330 | I10-F326 HydrophobicContact CD1-CZ 3.93Å; A283-F326 HydrophobicContact CB-CB 4.21Å; C286-F326 HydrophobicContact CB-CB 4.14Å; C286-F326 HydrophobicContact CB-CD1 4.09Å; F287-F326 HydrophobicContact CB-CD1 3.92Å; F287-F326 HydrophobicContact CB-CE1 4.15Å; F287-F326 HydrophobicContact CB-CG 4.15Å; F287-F326 HydrophobicContact CD2-CD1 4.47Å; F287-F326 HydrophobicContact CD2-CD2 4.1Å; F287-F326 HydrophobicContact CD2-CE1 4.12Å; F287-F326 AromaticContact CD2-CE2 3.71Å; F287-F326 HydrophobicContact CD2-CE2 3.71Å; F287-F326 HydrophobicContact CD2-CG 4.46Å; F287-F326 AromaticContact CD2-CZ 3.71Å; F287-F326 HydrophobicContact CD2-CZ 3.71Å; F287-F326 HydrophobicContact CE2-CE2 4.4Å; F287-F326 HydrophobicContact CE2-CZ 4.47Å; P290-F326 HydrophobicContact CG-CE1 4.24Å; W315-F326 HydrophobicContact CH2-CB 4.5Å; W315-F326 HydrophobicContact CZ3-CB 4.27Å; W315-F326 HydrophobicContact CZ3-CD2 4.33Å; W315-F326 HydrophobicContact CZ3-CG 4.42Å; R323-F326 WeakPolarHBondContact O-CB 3.39Å; R323-F326 PolarHBondContact O-N 2.97Å; M324-F326 PolarHBondContact O-N 2.69Å; M324-F326 VanDerWaalsContact O-N 3.13Å; F326-M329 HydrophobicContact CD1-CE 4.29Å; F326-A330 WeakPolarHBondContact O-CB 3.23Å; F326-A330 PolarHBondContact O-N 2.99Å |
| 327 | Y | 92.2 | Very high | 89.1 | Confident | 85 Ų | 85 | 72.2 Ų | 72.2 | 33% | 0.333 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -70.8 | -44.2 | 167 | -64.7 | -74.8 | 0 | 0 | 0 | 110.8 | D280 A283 R323 M324 M329 A330 E331 | D280-Y327 PolarHBondContact OD1-OH 3.38Å; D280-Y327 VanDerWaalsContact OD1-OH 3.14Å; A283-Y327 HydrophobicContact CB-CD1 3.46Å; A283-Y327 VanDerWaalsContact CB-CD1 3.46Å; A283-Y327 HydrophobicContact CB-CD2 4.5Å; A283-Y327 HydrophobicContact CB-CE1 3.63Å; A283-Y327 HydrophobicContact CB-CG 3.92Å; R323-Y327 HydrophobicContact CB-CD2 4.27Å; R323-Y327 HydrophobicContact CB-CE2 3.71Å; R323-Y327 VanDerWaalsContact O-CD2 3.22Å; R323-Y327 WeakPolarHBondContact O-CD2 3.28Å; R323-Y327 PolarHBondContact O-N 3.26Å; M324-Y327 WeakPolarHBondContact O-CB 3.49Å; M324-Y327 PolarHBondContact O-N 3.42Å; Y327-M329 PolarHBondContact O-N 3.11Å; Y327-A330 WeakPolarHBondContact O-CB 3.4Å; Y327-A330 PolarHBondContact O-N 3.26Å; Y327-A330 VanDerWaalsContact O-N 3.09Å; Y327-E331 PolarHBondContact O-N 3.3Å |
| 328 | E | 90.5 | Very high | 89.6 | Confident | 86 Ų | 86 | 69.8 Ų | 69.8 | 40% | 0.402 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -60.3 | -41.4 | 175.9 | -68 | 172.8 | -164.8 | 0 | 0 | 112.5 | M324 K332 | M324-E328 PolarHBondContact O-N 3.18Å; E328-K332 PolarHBondContact O-N 2.89Å |
| 329 | M | 88.8 | Confident | 90 | Very high | 56 Ų | 56 | 72.6 Ų | 72.6 | 28% | 0.276 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -69.4 | -33.8 | 173.6 | -173.6 | 163.3 | 66.4 | 0 | 0 | 112.2 | C286 I325 F326 Y327 F333 | C286-M329 HydrophobicContact CB-CB 4.49Å; C286-M329 HydrophobicContact CB-CE 3.52Å; I325-M329 WeakPolarHBondContact O-CB 3.45Å; I325-M329 PolarHBondContact O-N 3.33Å; F326-M329 HydrophobicContact CD1-CE 4.29Å; Y327-M329 PolarHBondContact O-N 3.11Å; M329-F333 HydrophobicContact CE-CE2 4.46Å; M329-F333 HydrophobicContact CG-CD2 4.01Å; M329-F333 HydrophobicContact CG-CE2 3.59Å; M329-F333 HydrophobicContact CG-CZ 3.89Å; M329-F333 WeakPolarHBondContact O-CG 3.47Å; M329-F333 PolarHBondContact O-N 3.17Å; M329-F333 VanDerWaalsContact O-N 3.08Å; M329-F333 HydrophobicContact SD-CE2 3.94Å; M329-F333 HydrophobicContact SD-CZ 4.05Å |
| 330 | A | 93.9 | Very high | 90.1 | Very high | 5 Ų | 5 | 72.9 Ų | 72.9 | 4% | 0.041 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -69.1 | -35.6 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | E282 C286 F326 Y327 F333 L334 | E282-A330 HydrophobicContact CB-CB 3.97Å; C286-A330 VanDerWaalsContact SG-CA 3.54Å; C286-A330 PolarHBondContact SG-N 2.89Å; C286-A330 VanDerWaalsContact SG-N 3.41Å; F326-A330 WeakPolarHBondContact O-CB 3.23Å; F326-A330 PolarHBondContact O-N 2.99Å; Y327-A330 WeakPolarHBondContact O-CB 3.4Å; Y327-A330 PolarHBondContact O-N 3.26Å; Y327-A330 VanDerWaalsContact O-N 3.09Å; A330-F333 PolarHBondContact O-N 3.19Å; A330-L334 VanDerWaalsContact O-CG 3.31Å; A330-L334 WeakPolarHBondContact O-CG 3.37Å; A330-L334 PolarHBondContact O-N 3.14Å |
| 331 | E | 91.3 | Very high | 90.2 | Very high | 129 Ų | 129 | 73.2 Ų | 73.2 | 60% | 0.603 | 35% | 0.352 | S | S | * | . | H | α-helix | trans | -60.3 | -51.5 | 174.1 | -175 | 166.2 | -139.8 | 0 | 0 | 110.7 | Y327 F333 L334 E335 | Y327-E331 PolarHBondContact O-N 3.3Å; E331-F333 VanDerWaalsContact C-N 3.31Å; E331-F333 PolarHBondContact O-N 3.32Å; E331-L334 WeakPolarHBondContact O-CA 3.36Å; E331-L334 WeakPolarHBondContact O-CB 3.45Å; E331-L334 PolarHBondContact O-N 2.88Å; E331-E335 PolarHBondContact O-N 2.98Å |
| 332 | K | 89.3 | Confident | 90.4 | Very high | 73 Ų | 73 | 70.4 Ų | 70.4 | 32% | 0.317 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -61.6 | -36.3 | 176.8 | -67.1 | 176.9 | -177.9 | 176.8 | 0 | 113.1 | E328 E335 F336 | E328-K332 PolarHBondContact O-N 2.89Å; K332-E335 WeakPolarHBondContact O-CB 3.5Å; K332-E335 PolarHBondContact O-N 2.93Å; K332-F336 WeakPolarHBondContact O-CD1 3.48Å; K332-F336 WeakPolarHBondContact O-CG 3.39Å; K332-F336 PolarHBondContact O-N 3.07Å |
| 333 | F | 91.6 | Very high | 90.4 | Very high | 7 Ų | 7 | 70.9 Ų | 70.9 | 3% | 0.031 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -73.4 | -24.7 | 173.7 | -69.3 | -20 | 0 | 0 | 0 | 113.4 | V257 N260 F261 W264 I289 M329 A330 E331 F336 E337 | V257-F333 HydrophobicContact CG1-CE1 4.25Å; N260-F333 HydrophobicContact CB-CZ 4Å; F261-F333 HydrophobicContact CB-CD1 3.86Å; F261-F333 HydrophobicContact CB-CE1 3.78Å; F261-F333 HydrophobicContact CB-CG 4.49Å; F261-F333 HydrophobicContact CB-CZ 4.35Å; F261-F333 HydrophobicContact CD2-CB 4Å; F261-F333 AromaticContact CD2-CD1 3.96Å; F261-F333 HydrophobicContact CD2-CD1 3.96Å; F261-F333 HydrophobicContact CD2-CG 4.07Å; F261-F333 WeakPolarHBondContact CE2-O 3.32Å; F261-F333 HydrophobicContact CG-CD1 4.36Å; W264-F333 HydrophobicContact CB-CD2 3.74Å; W264-F333 HydrophobicContact CB-CE2 4Å; W264-F333 AromaticContact CD1-CD2 3.72Å; W264-F333 HydrophobicContact CD2-CB 3.67Å; W264-F333 AromaticContact CD2-CD2 3.86Å; W264-F333 HydrophobicContact CD2-CD2 3.86Å; W264-F333 HydrophobicContact CD2-CG 4.17Å; W264-F333 HydrophobicContact CE3-CB 3.71Å; W264-F333 HydrophobicContact CE3-CD2 4.5Å; W264-F333 HydrophobicContact CE3-CG 4.41Å; W264-F333 HydrophobicContact CG-CB 4.29Å; W264-F333 AromaticContact CG-CD2 3.53Å; W264-F333 HydrophobicContact CG-CD2 3.53Å; W264-F333 HydrophobicContact CG-CE2 4.23Å; W264-F333 HydrophobicContact CG-CG 4.29Å; W264-F333 VanDerWaalsContact CH2-C 3.42Å; W264-F333 HydrophobicContact CH2-CB 3.71Å; W264-F333 WeakPolarHBondContact CH2-O 3.34Å; W264-F333 HydrophobicContact CZ2-CB 3.72Å; W264-F333 HydrophobicContact CZ3-CB 3.74Å; W264-F333 VanDerWaalsContact CZ3-O 3.3Å; W264-F333 WeakPolarHBondContact CZ3-O 3.29Å; I289-F333 HydrophobicContact CD1-CE2 4.1Å; M329-F333 HydrophobicContact CE-CE2 4.46Å; M329-F333 HydrophobicContact CG-CD2 4.01Å; M329-F333 HydrophobicContact CG-CE2 3.59Å; M329-F333 HydrophobicContact CG-CZ 3.89Å; M329-F333 WeakPolarHBondContact O-CG 3.47Å; M329-F333 PolarHBondContact O-N 3.17Å; M329-F333 VanDerWaalsContact O-N 3.08Å; M329-F333 HydrophobicContact SD-CE2 3.94Å; M329-F333 HydrophobicContact SD-CZ 4.05Å; A330-F333 PolarHBondContact O-N 3.19Å; E331-F333 VanDerWaalsContact C-N 3.31Å; E331-F333 PolarHBondContact O-N 3.32Å; F333-F336 HydrophobicContact CD1-CD2 4.32Å; F333-E337 WeakPolarHBondContact O-CB 3.38Å; F333-E337 PolarHBondContact O-N 3.22Å |
| 334 | L | 93.9 | Very high | 90.3 | Very high | 82 Ų | 82 | 73.5 Ų | 73.5 | 43% | 0.429 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -72.3 | -37.6 | 168.4 | -74.1 | 163.2 | 0 | 0 | 0 | 111.8 | W264 E282 A330 E331 F336 E337 A338 | W264-L334 HydrophobicContact CH2-CD2 3.86Å; W264-L334 HydrophobicContact CH2-CG 3.84Å; W264-L334 HydrophobicContact CZ2-CD2 4.33Å; W264-L334 HydrophobicContact CZ2-CG 4.06Å; E282-L334 HydrophobicContact CG-CD1 4.48Å; E282-L334 HydrophobicContact CG-CD2 4.37Å; A330-L334 VanDerWaalsContact O-CG 3.31Å; A330-L334 WeakPolarHBondContact O-CG 3.37Å; A330-L334 PolarHBondContact O-N 3.14Å; E331-L334 WeakPolarHBondContact O-CA 3.36Å; E331-L334 WeakPolarHBondContact O-CB 3.45Å; E331-L334 PolarHBondContact O-N 2.88Å; L334-F336 VanDerWaalsContact C-N 3.34Å; L334-E337 PolarHBondContact O-N 3.07Å; L334-A338 PolarHBondContact O-N 2.83Å |
| 335 | E | 90.9 | Very high | 90.4 | Very high | 121 Ų | 121 | 75.6 Ų | 75.6 | 57% | 0.565 | 37% | 0.366 | S | S | * | . | H | α-helix | trans | -59.9 | -44.5 | 170.3 | -64.6 | 179.8 | 142 | 0 | 0 | 111.3 | E331 K332 E337 A338 E339 | E331-E335 PolarHBondContact O-N 2.98Å; K332-E335 WeakPolarHBondContact O-CB 3.5Å; K332-E335 PolarHBondContact O-N 2.93Å; E335-E337 VanDerWaalsContact C-N 3.35Å; E335-E337 PolarHBondContact O-N 2.82Å; E335-A338 PolarHBondContact O-N 3.02Å; E335-E339 PolarHBondContact O-N 3.27Å |
| 336 | F | 88.4 | Confident | 90.4 | Very high | 88 Ų | 88 | 77.5 Ų | 77.5 | 39% | 0.386 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -65.3 | -36.5 | 177.6 | -75.1 | 20.6 | 0 | 0 | 0 | 112.2 | V257 F261 K332 F333 L334 E340 | V257-F336 HydrophobicContact CG1-CE2 3.95Å; V257-F336 HydrophobicContact CG1-CZ 4.37Å; F261-F336 HydrophobicContact CB-CD2 4.34Å; F261-F336 HydrophobicContact CD2-CB 3.88Å; F261-F336 HydrophobicContact CD2-CD2 4.35Å; F261-F336 HydrophobicContact CE1-CB 4.4Å; F261-F336 HydrophobicContact CE2-CB 3.63Å; F261-F336 HydrophobicContact CG-CB 4.36Å; F261-F336 HydrophobicContact CG-CD2 4.19Å; F261-F336 HydrophobicContact CZ-CB 3.91Å; K332-F336 WeakPolarHBondContact O-CD1 3.48Å; K332-F336 WeakPolarHBondContact O-CG 3.39Å; K332-F336 PolarHBondContact O-N 3.07Å; F333-F336 HydrophobicContact CD1-CD2 4.32Å; L334-F336 VanDerWaalsContact C-N 3.34Å; F336-E340 WeakPolarHBondContact O-CB 3.35Å; F336-E340 PolarHBondContact O-N 3.35Å |
| 337 | E | 92.1 | Very high | 89.9 | Confident | 51 Ų | 51 | 79.4 Ų | 79.4 | 24% | 0.238 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -66.5 | -40 | 174.2 | -170.3 | 165.4 | -92.2 | 0 | 0 | 111.6 | F261 W264 K268 F333 L334 E335 E340 E341 | F261-E337 HydrophobicContact CE2-CB 4.2Å; F261-E337 HydrophobicContact CZ-CB 4.38Å; W264-E337 HydrophobicContact CZ3-CB 4.32Å; K268-E337 IonicContact NZ-OE1 3.93Å; K268-E337 PolarHBondContact NZ-OE1 3.37Å; K268-E337 IonicContact NZ-OE2 3.98Å; K268-E337 PolarHBondContact NZ-OE2 3.21Å; F333-E337 WeakPolarHBondContact O-CB 3.38Å; F333-E337 PolarHBondContact O-N 3.22Å; L334-E337 PolarHBondContact O-N 3.07Å; E335-E337 VanDerWaalsContact C-N 3.35Å; E335-E337 PolarHBondContact O-N 2.82Å; E337-E340 PolarHBondContact O-N 3.5Å; E337-E341 PolarHBondContact O-N 3.28Å |
| 338 | A | 93.3 | Very high | 89.6 | Confident | 59 Ų | 59 | 81.5 Ų | 81.5 | 49% | 0.488 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -67.2 | -37.9 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113 | L334 E335 E341 M342 | L334-A338 PolarHBondContact O-N 2.83Å; E335-A338 PolarHBondContact O-N 3.02Å; A338-E341 PolarHBondContact O-N 2.93Å; A338-M342 WeakPolarHBondContact O-CB 3.31Å; A338-M342 PolarHBondContact O-N 3.09Å |
| 339 | E | 90.6 | Very high | 89.1 | Confident | 88 Ų | 88 | 87.9 Ų | 87.9 | 41% | 0.411 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -68.1 | -40.9 | 172.8 | -178.3 | 61.7 | -144.4 | 0 | 0 | 111.4 | E335 E341 M342 Q343 | E335-E339 PolarHBondContact O-N 3.27Å; E339-E341 PolarHBondContact O-N 3.16Å; E339-M342 PolarHBondContact O-N 3.27Å; E339-M342 WeakPolarHBondContact OE2-CE 3.39Å; E339-Q343 HydrophobicContact CG-CG 4.45Å; E339-Q343 WeakPolarHBondContact O-CB 3.46Å; E339-Q343 VanDerWaalsContact O-CG 3.28Å; E339-Q343 WeakPolarHBondContact O-CG 3.3Å; E339-Q343 PolarHBondContact O-N 3.4Å; E339-Q343 VanDerWaalsContact OE1-CG 3.22Å; E339-Q343 WeakPolarHBondContact OE1-CG 3.39Å; E339-Q343 PolarHBondContact OE1-NE2 3.27Å |
| 340 | E | 88.4 | Confident | 88.6 | Confident | 57 Ų | 57 | 92.8 Ų | 92.8 | 27% | 0.266 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -60.7 | -44.5 | 173.1 | -170.6 | 173.7 | -165.9 | 0 | 0 | 110.7 | F261 R262 Q265 F336 E337 Q343 I344 | F261-E340 WeakPolarHBondContact CE1-OE2 3.4Å; R262-E340 IonicContact CZ-OE1 3.85Å; R262-E340 IonicContact NH1-OE1 3.88Å; R262-E340 PolarHBondContact NH1-OE1 3.47Å; R262-E340 IonicContact NH1-OE2 3.76Å; R262-E340 PolarHBondContact NH1-OE2 3.01Å; R262-E340 IonicContact NH2-OE1 2.66Å; Q265-E340 PolarHBondContact NE2-OE2 3.36Å; F336-E340 WeakPolarHBondContact O-CB 3.35Å; F336-E340 PolarHBondContact O-N 3.35Å; E337-E340 PolarHBondContact O-N 3.5Å; E340-Q343 PolarHBondContact O-N 2.78Å; E340-I344 HydrophobicContact CG-CD1 3.95Å; E340-I344 WeakPolarHBondContact O-CB 3.17Å; E340-I344 WeakPolarHBondContact O-CD1 3.02Å; E340-I344 WeakPolarHBondContact O-CG1 3.43Å; E340-I344 PolarHBondContact O-N 2.77Å |
| 341 | E | 90.1 | Very high | 87.6 | Confident | 135 Ų | 135 | 99.6 Ų | 99.6 | 63% | 0.631 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -62.3 | -43.2 | 173.8 | -76.2 | -162.5 | 169.5 | 0 | 0 | 112.9 | E337 A338 E339 I344 Q345 | E337-E341 PolarHBondContact O-N 3.28Å; A338-E341 PolarHBondContact O-N 2.93Å; E339-E341 PolarHBondContact O-N 3.16Å; E341-I344 PolarHBondContact O-N 2.95Å; E341-Q345 WeakPolarHBondContact O-CB 3.44Å; E341-Q345 PolarHBondContact O-N 3.25Å |
| 342 | M | 90.4 | Very high | 86.3 | Confident | 93 Ų | 93 | 95.3 Ų | 95.3 | 46% | 0.458 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -63.7 | -44 | 176.8 | -178.1 | 176.6 | 58.6 | 0 | 0 | 111.5 | A338 E339 I344 Q345 K346 | A338-M342 WeakPolarHBondContact O-CB 3.31Å; A338-M342 PolarHBondContact O-N 3.09Å; E339-M342 PolarHBondContact O-N 3.27Å; E339-M342 WeakPolarHBondContact OE2-CE 3.39Å; M342-I344 VanDerWaalsContact C-N 3.34Å; M342-Q345 PolarHBondContact O-N 3.04Å; M342-K346 WeakPolarHBondContact O-CB 3.47Å; M342-K346 PolarHBondContact O-N 3.48Å |
| 343 | Q | 86.4 | Confident | 85.2 | Confident | 78 Ų | 78 | 98.2 Ų | 98.2 | 36% | 0.364 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -68.5 | -34.5 | 177.7 | -64.2 | -73.8 | -9 | 0 | 0 | 111.3 | E339 E340 S347 | E339-Q343 HydrophobicContact CG-CG 4.45Å; E339-Q343 WeakPolarHBondContact O-CB 3.46Å; E339-Q343 VanDerWaalsContact O-CG 3.28Å; E339-Q343 WeakPolarHBondContact O-CG 3.3Å; E339-Q343 PolarHBondContact O-N 3.4Å; E339-Q343 VanDerWaalsContact OE1-CG 3.22Å; E339-Q343 WeakPolarHBondContact OE1-CG 3.39Å; E339-Q343 PolarHBondContact OE1-NE2 3.27Å; E340-Q343 PolarHBondContact O-N 2.78Å; Q343-S347 VanDerWaalsContact O-CB 3.28Å; Q343-S347 WeakPolarHBondContact O-CB 3.49Å; Q343-S347 PolarHBondContact O-N 3.12Å |
| 344 | I | 87.3 | Confident | 83.5 | Confident | 74 Ų | 74 | 106 Ų | 106 | 38% | 0.379 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -61.4 | -51.2 | 169.4 | -73.9 | 166.6 | 0 | 0 | 0 | 110.3 | E340 E341 M342 K346 S347 Q348 | E340-I344 HydrophobicContact CG-CD1 3.95Å; E340-I344 WeakPolarHBondContact O-CB 3.17Å; E340-I344 WeakPolarHBondContact O-CD1 3.02Å; E340-I344 WeakPolarHBondContact O-CG1 3.43Å; E340-I344 PolarHBondContact O-N 2.77Å; E341-I344 PolarHBondContact O-N 2.95Å; M342-I344 VanDerWaalsContact C-N 3.34Å; I344-K346 PolarHBondContact O-N 3.17Å; I344-S347 PolarHBondContact O-N 2.77Å; I344-S347 VanDerWaalsContact O-N 3.13Å; I344-S347 PolarHBondContact O-OG 3.33Å; I344-Q348 VanDerWaalsContact CG2-NE2 3.32Å; I344-Q348 WeakPolarHBondContact O-CG 3.36Å; I344-Q348 PolarHBondContact O-N 2.78Å |
| 345 | Q | 90.5 | Very high | 80.9 | Confident | 141 Ų | 141 | 107.8 Ų | 107.8 | 66% | 0.659 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -60.4 | -44.8 | 179.5 | -170.6 | -174.1 | 29.8 | 0 | 0 | 111.7 | E341 M342 S347 Q348 W349 | E341-Q345 WeakPolarHBondContact O-CB 3.44Å; E341-Q345 PolarHBondContact O-N 3.25Å; M342-Q345 PolarHBondContact O-N 3.04Å; Q345-S347 VanDerWaalsContact C-N 3.35Å; Q345-S347 PolarHBondContact O-N 3.4Å; Q345-Q348 PolarHBondContact O-N 3.41Å; Q345-W349 PolarHBondContact O-N 3.31Å |
| 346 | K | 86.4 | Confident | 79 | Confident | 107 Ų | 107 | 109.2 Ų | 109.2 | 47% | 0.465 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -60.3 | -41.1 | 173.4 | 178.1 | 177.5 | 164.8 | -160.8 | 0 | 111.6 | M342 I344 W349 M350 | M342-K346 WeakPolarHBondContact O-CB 3.47Å; M342-K346 PolarHBondContact O-N 3.48Å; I344-K346 PolarHBondContact O-N 3.17Å; K346-W349 PolarHBondContact O-N 3.14Å; K346-M350 WeakPolarHBondContact O-CB 3.46Å; K346-M350 WeakPolarHBondContact O-CG 3.5Å; K346-M350 PolarHBondContact O-N 3.38Å |
| 347 | S | 80.7 | Confident | 77.4 | Confident | 53 Ų | 53 | 110 Ų | 110 | 37% | 0.371 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -67.3 | -34.8 | 174.9 | 84 | 0 | 0 | 0 | 0 | 112.6 | Q343 I344 Q345 K351 | Q343-S347 VanDerWaalsContact O-CB 3.28Å; Q343-S347 WeakPolarHBondContact O-CB 3.49Å; Q343-S347 PolarHBondContact O-N 3.12Å; I344-S347 PolarHBondContact O-N 2.77Å; I344-S347 VanDerWaalsContact O-N 3.13Å; I344-S347 PolarHBondContact O-OG 3.33Å; Q345-S347 VanDerWaalsContact C-N 3.35Å; Q345-S347 PolarHBondContact O-N 3.4Å; S347-K351 WeakPolarHBondContact O-CB 3.48Å; S347-K351 WeakPolarHBondContact O-CG 3.3Å; S347-K351 PolarHBondContact O-N 3.1Å |
| 348 | Q | 85.6 | Confident | 75.7 | Confident | 129 Ų | 129 | 112.8 Ų | 112.8 | 60% | 0.603 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -70.2 | -36.4 | 174.1 | -69.6 | -179.3 | 35.6 | 0 | 0 | 111.6 | I344 Q345 K351 | I344-Q348 VanDerWaalsContact CG2-NE2 3.32Å; I344-Q348 WeakPolarHBondContact O-CG 3.36Å; I344-Q348 PolarHBondContact O-N 2.78Å; Q345-Q348 PolarHBondContact O-N 3.41Å; Q348-K351 CarbonylContact O-C 3.59Å; Q348-K351 VanDerWaalsContact O-C 3.27Å; Q348-K351 VanDerWaalsContact O-O 3.1Å |
| 349 | W | 80.8 | Confident | 73.6 | Confident | 219 Ų | 219 | 115.9 Ų | 115.9 | 83% | 0.83 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -70.8 | -41 | 174.4 | -174.1 | -92.6 | 0 | 0 | 0 | 112.5 | Q345 K346 K351 G352 | Q345-W349 PolarHBondContact O-N 3.31Å; K346-W349 PolarHBondContact O-N 3.14Å; W349-K351 VanDerWaalsContact C-N 3.32Å; W349-G352 WeakPolarHBondContact O-CA 3.2Å; W349-G352 PolarHBondContact O-N 3.46Å; W349-G352 VanDerWaalsContact O-N 3.1Å |
| 350 | M | 79.1 | Confident | 71.5 | Confident | 159 Ų | 159 | 116.2 Ų | 116.2 | 78% | 0.783 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -68.2 | -31 | 174.1 | -69 | -73 | -81.9 | 0 | 0 | 111.8 | K346 G352 | K346-M350 WeakPolarHBondContact O-CB 3.46Å; K346-M350 WeakPolarHBondContact O-CG 3.5Å; K346-M350 PolarHBondContact O-N 3.38Å; M350-G352 PolarHBondContact O-N 2.77Å |
| 351 | K | 71.5 | Confident | 69.6 | Low | 149 Ų | 149 | 119.5 Ų | 119.5 | 65% | 0.648 | 65% | 0.648 | S | S | * | * | S | Bend | trans | -74.8 | 54 | 158.6 | -70.4 | 177.3 | -179.8 | 175.1 | 0 | 110.7 | S347 Q348 W349 | S347-K351 WeakPolarHBondContact O-CB 3.48Å; S347-K351 WeakPolarHBondContact O-CG 3.3Å; S347-K351 PolarHBondContact O-N 3.1Å; Q348-K351 CarbonylContact O-C 3.59Å; Q348-K351 VanDerWaalsContact O-C 3.27Å; Q348-K351 VanDerWaalsContact O-O 3.1Å; W349-K351 VanDerWaalsContact C-N 3.32Å |
| 352 | G | 65.7 | Low | 67.3 | Low | 39 Ų | 39 | 118.8 Ų | 118.8 | 40% | 0.402 | 66% | 0.655 | S | S | . | * | trans | -48.2 | 147.8 | 174.2 | 0 | 0 | 0 | 0 | 0 | 110.8 | W349 M350 Q354 | W349-G352 WeakPolarHBondContact O-CA 3.2Å; W349-G352 PolarHBondContact O-N 3.46Å; W349-G352 VanDerWaalsContact O-N 3.1Å; M350-G352 PolarHBondContact O-N 2.77Å; G352-Q354 PolarHBondContact O-N 2.67Å | ||
| 353 | P | 65.3 | Low | 64.7 | Low | 133 Ų | 133 | 124.5 Ų | 124.5 | 86% | 0.864 | 67% | 0.671 | S | S | * | * | trans | -48.1 | 105.8 | -153.1 | 18.3 | -33.4 | 0 | 0 | 0 | 111.7 | C355 | P353-C355 PolarHBondContact O-N 3.45Š| ||
| 354 | Q | 55.5 | Low | 62.6 | Low | 172 Ų | 172 | 128.6 Ų | 128.6 | 80% | 0.804 | 70% | 0.695 | S | S | * | * | trans | -55.6 | 114.2 | 178.7 | -78.8 | -164.5 | 79.9 | 0 | 0 | 107.7 | G352 L356 | G352-Q354 PolarHBondContact O-N 2.67Å; Q354-L356 VanDerWaalsContact C-N 3.3Å; Q354-L356 PolarHBondContact O-N 2.97Å | ||
| 355 | C | 40.3 | Very low | 60.2 | Low | 119 Ų | 119 | 131.5 Ų | 131.5 | 80% | 0.804 | 71% | 0.707 | S | S | * | * | trans | -68.3 | 93.6 | -174.6 | -169.1 | 0 | 0 | 0 | 0 | 107.9 | P353 P357 | P353-C355 PolarHBondContact O-N 3.45Å; C355-P357 WeakPolarHBondContact O-CD 3.38Å | ||
| 356 | L | 50.1 | Low | 57.9 | Low | 150 Ų | 150 | 130 Ų | 130 | 79% | 0.785 | 71% | 0.709 | S | S | * | * | P | Polyproline II helix | trans | -46.9 | 117.8 | 165.7 | -96.8 | 163.2 | 0 | 0 | 0 | 106.5 | Q354 P358 | Q354-L356 VanDerWaalsContact C-N 3.3Å; Q354-L356 PolarHBondContact O-N 2.97Å; L356-P358 VanDerWaalsContact O-N 3.17Å |
| 357 | P | 55.6 | Low | 55.6 | Low | 104 Ų | 104 | 136.2 Ų | 136.2 | 68% | 0.675 | 73% | 0.73 | S | S | * | * | P | Polyproline II helix | trans | -55 | 129.5 | 176.2 | 22.8 | -32.3 | 0 | 0 | 0 | 106.8 | C355 | C355-P357 WeakPolarHBondContact O-CD 3.38Š|
| 358 | P | 55.7 | Low | 53.7 | Low | 110 Ų | 110 | 136.3 Ų | 136.3 | 71% | 0.714 | 74% | 0.739 | S | S | * | * | P | Polyproline II helix | trans | -54.6 | 130.4 | -170.1 | 20.6 | -32.6 | 0 | 0 | 0 | 108.7 | L356 A360 | L356-P358 VanDerWaalsContact O-N 3.17Å; P358-A360 PolarHBondContact O-N 3.13Å |
| 359 | P | 49.6 | Very low | 51.7 | Low | 125 Ų | 125 | 136.2 Ų | 136.2 | 81% | 0.812 | 75% | 0.749 | S | S | * | * | P | Polyproline II helix | trans | -54.4 | 121.4 | -171.3 | 21.1 | -33 | 0 | 0 | 0 | 108.7 | T361 | P359-T361 PolarHBondContact O-N 3.02Å; P359-T361 VanDerWaalsContact O-N 3.16Å |
| 360 | A | 46.2 | Very low | 49.8 | Very low | 94 Ų | 94 | 131.9 Ų | 131.9 | 78% | 0.777 | 75% | 0.749 | S | S | * | * | P | Polyproline II helix | trans | -51.4 | 125 | -167.4 | 0 | 0 | 0 | 0 | 0 | 110 | P358 | P358-A360 PolarHBondContact O-N 3.13Š|
| 361 | T | 48.2 | Very low | 47.8 | Very low | 127 Ų | 127 | 128.9 Ų | 128.9 | 78% | 0.779 | 75% | 0.75 | S | S | * | * | P | Polyproline II helix | trans | -53.6 | 129.1 | 178.4 | 34.2 | 0 | 0 | 0 | 0 | 108.7 | P359 R363 | P359-T361 PolarHBondContact O-N 3.02Å; P359-T361 VanDerWaalsContact O-N 3.16Å; T361-R363 PolarHBondContact O-N 3.09Å |
| 362 | P | 42.3 | Very low | 46.5 | Very low | 119 Ų | 119 | 127.7 Ų | 127.7 | 77% | 0.773 | 76% | 0.757 | S | S | * | * | P | Polyproline II helix | trans | -50.8 | 119.4 | 178.8 | -29.2 | 35.6 | 0 | 0 | 0 | 109.3 | L364 | P362-L364 PolarHBondContact O-N 3.08Š|
| 363 | R | 35.7 | Very low | 45 | Very low | 214 Ų | 214 | 134.6 Ų | 134.6 | 81% | 0.808 | 78% | 0.779 | S | S | * | * | trans | -65.1 | 99.7 | -166.4 | -159.2 | -174 | -160.4 | -125.2 | 11.2 | 108.9 | T361 E365 | T361-R363 PolarHBondContact O-N 3.09Å; R363-E365 VanDerWaalsContact C-N 3.29Å; R363-E365 IonicContact NH1-OE1 2.74Å; R363-E365 PolarHBondContact O-N 3.05Å | ||
| 364 | L | 43 | Very low | 43.3 | Very low | 164 Ų | 164 | 133.7 Ų | 133.7 | 86% | 0.859 | 77% | 0.771 | S | S | * | * | trans | -66.5 | 96 | 169.1 | -74.2 | 175.6 | 0 | 0 | 0 | 107.4 | P362 P366 | P362-L364 PolarHBondContact O-N 3.08Å; L364-P366 VanDerWaalsContact O-CD 3.31Å; L364-P366 WeakPolarHBondContact O-CD 3.22Å | ||
| 365 | E | 37.6 | Very low | 42.4 | Very low | 135 Ų | 135 | 131.8 Ų | 131.8 | 63% | 0.631 | 77% | 0.771 | S | S | * | * | trans | -42.9 | 118.8 | 167.9 | -104.2 | -67.4 | 109.1 | 0 | 0 | 109.6 | R363 R367 | R363-E365 VanDerWaalsContact C-N 3.29Å; R363-E365 IonicContact NH1-OE1 2.74Å; R363-E365 PolarHBondContact O-N 3.05Å; E365-R367 PolarHBondContact O-N 3.43Å | ||
| 366 | P | 40.3 | Very low | 42.2 | Very low | 108 Ų | 108 | 135.2 Ų | 135.2 | 70% | 0.701 | 77% | 0.772 | S | S | * | * | trans | -71.1 | 73.9 | 175.8 | -17.6 | 32.8 | 0 | 0 | 0 | 110.3 | L364 G368 | L364-P366 VanDerWaalsContact O-CD 3.31Å; L364-P366 WeakPolarHBondContact O-CD 3.22Å; P366-G368 PolarHBondContact O-N 3.36Å | ||
| 367 | R | 39.7 | Very low | 41.4 | Very low | 239 Ų | 239 | 135.4 Ų | 135.4 | 90% | 0.902 | 77% | 0.769 | S | S | * | * | trans | -62.3 | 102.5 | -179.7 | -167.2 | 178.9 | -169.9 | -165.8 | 2.7 | 109.2 | E365 | E365-R367 PolarHBondContact O-N 3.43Š| ||
| 368 | G | 40.9 | Very low | 40.6 | Very low | 54 Ų | 54 | 136.8 Ų | 136.8 | 56% | 0.557 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -58.1 | 150.4 | -171.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | P366 P370 | P366-G368 PolarHBondContact O-N 3.36Å; G368-P370 WeakPolarHBondContact O-CD 3.26Å |
| 369 | P | 42 | Very low | 39.4 | Very low | 128 Ų | 128 | 136.1 Ų | 136.1 | 83% | 0.831 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -77.3 | 132.2 | -172.5 | 30.6 | -34.9 | 0 | 0 | 0 | 112.8 | ||
| 370 | P | 41.8 | Very low | 38.4 | Very low | 127 Ų | 127 | 141.3 Ų | 141.3 | 83% | 0.825 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -74.9 | 152.6 | 154.5 | -11.3 | 29.2 | 0 | 0 | 0 | 110.8 | G368 | G368-P370 WeakPolarHBondContact O-CD 3.26Š|
| 371 | A | 36.7 | Very low | 37.9 | Very low | 96 Ų | 96 | 143.5 Ų | 143.5 | 79% | 0.793 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -82.6 | 172.5 | -175.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||
| 372 | P | 45 | Very low | 37.8 | Very low | 124 Ų | 124 | 143.1 Ų | 143.1 | 81% | 0.805 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -93.3 | 152.8 | -160.3 | 36.4 | -35 | 0 | 0 | 0 | 114.3 | ||
| 373 | E | 33.3 | Very low | 37.2 | Very low | 184 Ų | 184 | 142.3 Ų | 142.3 | 86% | 0.86 | 77% | 0.772 | S | S | * | * | trans | -149.2 | 130.3 | 159.8 | -150.9 | 149.8 | -141.8 | 0 | 0 | 115.8 | ||||
| 374 | V | 31 | Very low | 37 | Very low | 114 Ų | 114 | 141.6 Ų | 141.6 | 69% | 0.691 | 77% | 0.774 | S | S | * | * | trans | 46.5 | 110 | 153.9 | 177.3 | 0 | 0 | 0 | 0 | 120.6 | K376 | V374-K376 HydrophobicContact CG1-CG 4.33Š| ||
| 375 | V | 34.8 | Very low | 36.4 | Very low | 133 Ų | 133 | 138.9 Ų | 138.9 | 81% | 0.806 | 78% | 0.775 | S | S | * | * | trans | -62.1 | 132.2 | 155.6 | 171.8 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 376 | K | 36.5 | Very low | 36 | Very low | 190 Ų | 190 | 135.6 Ų | 135.6 | 83% | 0.826 | 78% | 0.778 | S | S | * | * | trans | -140.5 | 127.1 | 144.6 | -72.6 | -161.6 | 177 | -178.9 | 0 | 112.3 | V374 | V374-K376 HydrophobicContact CG1-CG 4.33Š| ||
| 377 | Q | 34.3 | Very low | 36.3 | Very low | 155 Ų | 155 | 136 Ų | 136 | 72% | 0.724 | 78% | 0.78 | S | S | * | * | trans | -72.4 | 166.7 | 160.9 | -68.5 | 178.3 | -20.5 | 0 | 0 | 110.5 | ||||
| 378 | P | 38.1 | Very low | 35.8 | Very low | 132 Ų | 132 | 134.1 Ų | 134.1 | 86% | 0.857 | 78% | 0.779 | S | S | * | * | -121.8 | 130.6 | 129.3 | 25.4 | -12.2 | 0 | 0 | 0 | 111.6 | |||||
| 379 | V | 30.7 | Very low | 35.3 | Very low | 97 Ų | 97 | 136 Ų | 136 | 59% | 0.588 | 79% | 0.789 | S | S | * | * | trans | -105.6 | 131.9 | 166.9 | 170.1 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 380 | Y | 27.9 | Very low | 35.3 | Very low | 233 Ų | 233 | 135.3 Ų | 135.3 | 91% | 0.914 | 78% | 0.784 | S | S | * | * | trans | -149 | 127.6 | 152.7 | -130.5 | -92.6 | 0 | 0 | 0 | 111.5 | ||||
| 381 | L | 35.7 | Very low | 34.7 | Very low | 141 Ų | 141 | 135.6 Ų | 135.6 | 74% | 0.738 | 78% | 0.784 | S | S | * | * | trans | -119.8 | -177.8 | 168.5 | -67 | 171 | 0 | 0 | 0 | 106.2 | ||||
| 382 | P | 46.1 | Very low | 34.3 | Very low | 118 Ų | 118 | 135.1 Ų | 135.1 | 77% | 0.766 | 78% | 0.78 | S | S | * | * | cis | -129.8 | -174.2 | -6.9 | 42.5 | -27.5 | 0 | 0 | 0 | 112.8 | ||||
| 383 | S | 29.9 | Very low | 33.4 | Very low | 103 Ų | 103 | 135.3 Ų | 135.3 | 72% | 0.72 | 78% | 0.783 | S | S | * | * | 176.6 | 120 | 108.6 | -162.7 | 0 | 0 | 0 | 0 | 115 | |||||
| 384 | K | 32.4 | Very low | 33.2 | Very low | 199 Ų | 199 | 134.2 Ų | 134.2 | 87% | 0.865 | 78% | 0.782 | S | S | * | * | trans | 15.1 | 119.5 | 145.5 | -55.2 | -81 | -174.3 | 168.2 | 0 | 119.6 | ||||
| 385 | A | 30.4 | Very low | 34.3 | Very low | 106 Ų | 106 | 134.3 Ų | 134.3 | 88% | 0.876 | 79% | 0.785 | S | S | * | * | -179.8 | 157.7 | 104.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | |||||
| 386 | G | 27.8 | Very low | 35.3 | Very low | 67 Ų | 67 | 133 Ų | 133 | 69% | 0.691 | 78% | 0.779 | S | S | * | * | trans | -143.7 | -157.8 | 161.4 | 0 | 0 | 0 | 0 | 0 | 108 | ||||
| 387 | P | 47.3 | Very low | 35.6 | Very low | 116 Ų | 116 | 129.9 Ų | 129.9 | 75% | 0.753 | 78% | 0.779 | S | S | * | * | cis | -139.1 | -163.3 | -2.3 | 39.1 | -18.4 | 0 | 0 | 0 | 113.9 | ||||
| 388 | K | 29.8 | Very low | 35.7 | Very low | 200 Ų | 200 | 133.7 Ų | 133.7 | 87% | 0.87 | 79% | 0.786 | S | S | * | * | trans | 79.1 | 144.4 | 160 | -68.4 | 175 | 179.2 | -178.4 | 0 | 120 | ||||
| 389 | A | 29.2 | Very low | 35.9 | Very low | 92 Ų | 92 | 133.1 Ų | 133.1 | 76% | 0.76 | 78% | 0.782 | S | S | * | * | trans | -93.7 | -177.4 | 163.2 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 390 | P | 42 | Very low | 35.8 | Very low | 114 Ų | 114 | 137.2 Ų | 137.2 | 74% | 0.74 | 80% | 0.795 | S | S | * | * | -152.8 | 165.9 | 50.3 | 43.4 | -22 | 0 | 0 | 0 | 119.7 | |||||
| 391 | T | 29.1 | Very low | 36.3 | Very low | 133 Ų | 133 | 136.7 Ų | 136.7 | 82% | 0.816 | 79% | 0.792 | S | S | * | * | trans | 50.8 | 136.8 | 133.8 | -57.4 | 0 | 0 | 0 | 0 | 124.3 | ||||
| 392 | A | 29.1 | Very low | 36.9 | Very low | 87 Ų | 87 | 135.7 Ų | 135.7 | 72% | 0.719 | 79% | 0.794 | S | S | * | * | trans | 74.2 | 150.3 | 157.2 | 0 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 393 | C | 25.2 | Very low | 36.2 | Very low | 127 Ų | 127 | 136.1 Ų | 136.1 | 86% | 0.858 | 79% | 0.794 | S | S | * | * | cis | -155.4 | -178.7 | -11.1 | -117.5 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 394 | L | 29.4 | Very low | 36.2 | Very low | 162 Ų | 162 | 136 Ų | 136 | 85% | 0.848 | 79% | 0.789 | S | S | * | * | trans | -101.7 | -167.7 | -176 | -57.9 | 167.8 | 0 | 0 | 0 | 112 | ||||
| 395 | P | 53.5 | Low | 36.3 | Very low | 116 Ų | 116 | 135.7 Ų | 135.7 | 75% | 0.753 | 79% | 0.787 | S | S | * | * | cis | -127.4 | -113.1 | -29.3 | 21 | 5.4 | 0 | 0 | 0 | 115.9 | ||||
| 396 | P | 57.2 | Low | 36.2 | Very low | 104 Ų | 104 | 134.7 Ų | 134.7 | 68% | 0.675 | 78% | 0.779 | S | S | * | * | -127.4 | -166.2 | -111.6 | 43.2 | -24.3 | 0 | 0 | 0 | 115.9 | |||||
| 397 | P | 41.5 | Very low | 36.3 | Very low | 126 Ų | 126 | 143 Ų | 143 | 82% | 0.818 | 79% | 0.79 | S | S | * | * | -144.8 | -178.9 | 92.3 | 37.7 | -20.3 | 0 | 0 | 0 | 116.2 | |||||
| 398 | R | 37.3 | Very low | 35.7 | Very low | 235 Ų | 235 | 148.8 Ų | 148.8 | 89% | 0.887 | 80% | 0.797 | S | S | * | * | trans | -123.9 | 158 | 175.7 | -77.9 | -176.2 | 177 | 164.6 | -0.9 | 111.7 | ||||
| 399 | P | 41.5 | Very low | 36.7 | Very low | 119 Ų | 119 | 144.9 Ų | 144.9 | 77% | 0.773 | 79% | 0.791 | S | S | * | * | -132.7 | 172.3 | 115.7 | 14.8 | 6.3 | 0 | 0 | 0 | 112.3 | |||||
| 400 | Q | 30.5 | Very low | 38.1 | Very low | 183 Ų | 183 | 145.7 Ų | 145.7 | 86% | 0.855 | 79% | 0.789 | S | S | * | * | cis | -159.2 | -173.6 | -33.7 | -110.8 | -154.6 | 101.7 | 0 | 0 | 109.1 | ||||
| 401 | R | 37.6 | Very low | 37.6 | Very low | 223 Ų | 223 | 146.3 Ų | 146.3 | 84% | 0.842 | 79% | 0.793 | S | S | * | * | trans | -143.3 | 162 | 162 | -73.2 | -174.5 | 177 | 178.8 | -3.1 | 108.2 | ||||
| 402 | P | 48.3 | Very low | 37.9 | Very low | 120 Ų | 120 | 151.4 Ų | 151.4 | 78% | 0.779 | 80% | 0.797 | S | S | * | * | -132.8 | 174.6 | 103 | 16.6 | 5.6 | 0 | 0 | 0 | 110.8 | |||||
| 403 | V | 30.6 | Very low | 39 | Very low | 127 Ų | 127 | 152 Ų | 152 | 77% | 0.77 | 79% | 0.794 | S | S | * | * | cis | -123.1 | -127.5 | 34.5 | -176.1 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 404 | T | 30.3 | Very low | 39.2 | Very low | 101 Ų | 101 | 154.1 Ų | 154.1 | 62% | 0.62 | 79% | 0.791 | S | S | * | * | trans | -157.3 | 167.8 | -152.8 | 56 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 405 | K | 34.8 | Very low | 39.4 | Very low | 191 Ų | 191 | 157.5 Ų | 157.5 | 83% | 0.83 | 79% | 0.792 | S | S | * | * | cis | -160.6 | 165.5 | 5.1 | -112.2 | 144.2 | -164 | 168.3 | 0 | 104.5 | ||||
| 406 | A | 28.7 | Very low | 38.5 | Very low | 85 Ų | 85 | 163 Ų | 163 | 70% | 0.702 | 80% | 0.798 | S | S | * | * | cis | -162.5 | -172.6 | -9.1 | 0 | 0 | 0 | 0 | 0 | 106.1 | ||||
| 407 | R | 30.1 | Very low | 37.6 | Very low | 243 Ų | 243 | 161.8 Ų | 161.8 | 92% | 0.917 | 80% | 0.797 | S | S | * | * | cis | -152.2 | 166.5 | -9.7 | -137.4 | 171 | -169.1 | -159.4 | 3.6 | 107.6 | ||||
| 408 | R | 34.9 | Very low | 37.3 | Very low | 237 Ų | 237 | 164.2 Ų | 164.2 | 89% | 0.894 | 80% | 0.797 | S | S | * | * | trans | -161.2 | 172.6 | -179.7 | -106.6 | -169.7 | -177.7 | -160 | 3.5 | 107.9 | ||||
| 409 | P | 48.9 | Very low | 37 | Very low | 117 Ų | 117 | 159.1 Ų | 159.1 | 76% | 0.76 | 79% | 0.792 | S | S | * | * | cis | -127.9 | -113.3 | -17.4 | 28.5 | -1.8 | 0 | 0 | 0 | 113.6 | ||||
| 410 | P | 58.7 | Low | 37.1 | Very low | 109 Ų | 109 | 163.3 Ų | 163.3 | 71% | 0.708 | 80% | 0.798 | S | S | * | * | trans | -122.5 | -177.7 | -141.7 | 41.8 | -21.3 | 0 | 0 | 0 | 116.7 | ||||
| 411 | P | 31.9 | Very low | 37.3 | Very low | 127 Ų | 127 | 159.4 Ų | 159.4 | 83% | 0.825 | 80% | 0.797 | S | S | * | * | -141.6 | 177.4 | 116.2 | 38.9 | -26.1 | 0 | 0 | 0 | 116 | |||||
| 412 | R | 36.6 | Very low | 37.4 | Very low | 241 Ų | 241 | 160.3 Ų | 160.3 | 91% | 0.909 | 80% | 0.8 | S | S | * | * | trans | -121.8 | 171.2 | 167.7 | -71.4 | -180 | 175.8 | 176.1 | -2.2 | 108 | ||||
| 413 | P | 50.6 | Low | 37.3 | Very low | 100 Ų | 100 | 162.6 Ų | 162.6 | 65% | 0.649 | 81% | 0.805 | S | S | * | * | cis | -119.9 | -172.6 | 2 | 42.2 | -25.3 | 0 | 0 | 0 | 112.3 | ||||
| 414 | H | 29.6 | Very low | 37.8 | Very low | 170 Ų | 170 | 161.7 Ų | 161.7 | 79% | 0.787 | 80% | 0.802 | S | S | * | * | -162.2 | 168.3 | 79.2 | -79.2 | -82.5 | 0 | 0 | 0 | 112 | |||||
| 415 | R | 34.9 | Very low | 38.5 | Very low | 233 Ų | 233 | 162 Ų | 162 | 88% | 0.879 | 81% | 0.806 | S | S | * | * | trans | 13 | 136.1 | 162.3 | -71.7 | 175.7 | 169.1 | 171.2 | -4 | 118.7 | ||||
| 416 | R | 33.1 | Very low | 38.6 | Very low | 233 Ų | 233 | 159 Ų | 159 | 88% | 0.879 | 81% | 0.806 | S | S | * | * | cis | -156 | 164.5 | 16.5 | -142.2 | 177.2 | -167.7 | -113.3 | 9.2 | 109 | ||||
| 417 | A | 38.5 | Very low | 39.3 | Very low | 78 Ų | 78 | 166.1 Ų | 166.1 | 65% | 0.645 | 81% | 0.814 | S | S | * | * | trans | -77.2 | 170.6 | 166.8 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 418 | E | 36 | Very low | 39.7 | Very low | 176 Ų | 176 | 160.4 Ų | 160.4 | 82% | 0.822 | 81% | 0.809 | S | S | * | * | cis | -168.2 | 160.3 | 38.7 | -139.5 | 159.6 | -161.3 | 0 | 0 | 112.9 | ||||
| 419 | T | 31.7 | Very low | 40 | Very low | 128 Ų | 128 | 158.1 Ų | 158.1 | 79% | 0.785 | 81% | 0.808 | S | S | * | * | trans | 57.2 | 137.7 | 149.5 | -60.9 | 0 | 0 | 0 | 0 | 123 | ||||
| 420 | K | 43.5 | Very low | 39.3 | Very low | 208 Ų | 208 | 163.7 Ų | 163.7 | 90% | 0.904 | 81% | 0.814 | S | S | * | * | trans | -67.7 | 139.6 | 168.2 | -73.1 | -179.3 | 173.7 | -178.4 | 0 | 112.1 | ||||
| 421 | A | 34.1 | Very low | 38.3 | Very low | 100 Ų | 100 | 164.6 Ų | 164.6 | 83% | 0.826 | 82% | 0.82 | S | S | * | * | trans | -128.5 | 153.7 | 158.6 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 422 | R | 40.1 | Very low | 38.5 | Very low | 242 Ų | 242 | 163 Ų | 163 | 91% | 0.913 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -81.2 | 151.4 | 172.4 | -62.6 | 177.4 | 179.1 | -140.4 | 1.4 | 109.4 | ||
| 423 | L | 45.9 | Very low | 38.4 | Very low | 169 Ų | 169 | 160.6 Ų | 160.6 | 89% | 0.885 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -61.3 | 135.7 | 166.5 | -68.7 | 171.4 | 0 | 0 | 0 | 109.4 | ||
| 424 | P | 40.9 | Very low | 37.7 | Very low | 108 Ų | 108 | 162.6 Ų | 162.6 | 70% | 0.701 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -77.3 | 152.2 | 175.9 | 32.5 | -34.6 | 0 | 0 | 0 | 111.1 | ||
| 425 | P | 44.9 | Very low | 38.4 | Very low | 108 Ų | 108 | 164 Ų | 164 | 70% | 0.701 | 83% | 0.831 | S | S | * | * | P | Polyproline II helix | trans | -68.8 | 160.9 | 165.8 | 31.9 | -35.2 | 0 | 0 | 0 | 110.9 | ||
| 426 | P | 36.3 | Very low | 38.9 | Very low | 127 Ų | 127 | 159 Ų | 159 | 83% | 0.825 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -56 | 140.3 | 171.4 | -22.9 | 34 | 0 | 0 | 0 | 111.6 | ||
| 427 | R | 43.9 | Very low | 39.4 | Very low | 234 Ų | 234 | 153.4 Ų | 153.4 | 88% | 0.883 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -83.1 | 137.6 | 171.4 | -73.4 | -178.5 | 175 | 167.8 | -1.7 | 109.9 | ||
| 428 | P | 39.2 | Very low | 40.2 | Very low | 124 Ų | 124 | 158.8 Ų | 158.8 | 81% | 0.805 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -57.1 | 139 | 160.5 | -20.2 | 32.5 | 0 | 0 | 0 | 110 | ||
| 429 | Q | 40.1 | Very low | 41.3 | Very low | 189 Ų | 189 | 159 Ų | 159 | 88% | 0.883 | 83% | 0.833 | S | S | * | * | P | Polyproline II helix | trans | -72.7 | 150.6 | 168.6 | -58.8 | -167.2 | 21.5 | 0 | 0 | 109.4 | ||
| 430 | R | 35 | Very low | 42.6 | Very low | 234 Ų | 234 | 158.4 Ų | 158.4 | 88% | 0.883 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -76.6 | 152.6 | 171.6 | -80 | -178.5 | 171.5 | 171.2 | -4.4 | 109.7 | A432 | R430-A432 PolarHBondContact O-N 2.87Š|
| 431 | P | 38.2 | Very low | 43.9 | Very low | 127 Ų | 127 | 151.6 Ų | 151.6 | 83% | 0.825 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -57.2 | 135.3 | 173.1 | -21.7 | 33.1 | 0 | 0 | 0 | 111 | ||
| 432 | A | 35.2 | Very low | 45.2 | Very low | 94 Ų | 94 | 151.2 Ų | 151.2 | 78% | 0.777 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -70.5 | 157 | 155.6 | 0 | 0 | 0 | 0 | 0 | 109 | R430 | R430-A432 PolarHBondContact O-N 2.87Š|
| 433 | E | 35.6 | Very low | 46.6 | Very low | 191 Ų | 191 | 145.9 Ų | 145.9 | 89% | 0.893 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -65.7 | 137.2 | -173.8 | -64 | 170.3 | 146 | 0 | 0 | 111.3 | K435 | E433-K435 PolarHBondContact O-N 3Š|
| 434 | T | 35.7 | Very low | 47.7 | Very low | 142 Ų | 142 | 141.4 Ų | 141.4 | 87% | 0.871 | 76% | 0.755 | S | S | * | * | trans | -66.5 | 99.5 | 176.4 | 44.5 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 435 | K | 43.7 | Very low | 49.3 | Very low | 198 Ų | 198 | 140 Ų | 140 | 86% | 0.861 | 74% | 0.744 | S | S | * | * | P | Polyproline II helix | trans | -66.8 | 134.2 | 155.2 | -71.5 | -164.2 | 172.1 | -167.6 | 0 | 108.6 | E433 | E433-K435 PolarHBondContact O-N 3Š|
| 436 | V | 44.7 | Very low | 50.7 | Low | 129 Ų | 129 | 139.8 Ų | 139.8 | 78% | 0.782 | 73% | 0.734 | S | S | * | * | P | Polyproline II helix | trans | -59.4 | 143.3 | 169.3 | -178.3 | 0 | 0 | 0 | 0 | 108 | E438 | V436-E438 PolarHBondContact O-N 3.33Š|
| 437 | P | 44.5 | Very low | 52.8 | Low | 115 Ų | 115 | 139.5 Ų | 139.5 | 75% | 0.747 | 72% | 0.721 | S | S | * | * | P | Polyproline II helix | trans | -52.5 | 135.8 | 171.6 | -25.7 | 35.3 | 0 | 0 | 0 | 110.8 | E439 | P437-E439 PolarHBondContact O-N 2.96Å; P437-E439 VanDerWaalsContact O-N 3.08Å |
| 438 | E | 54.4 | Low | 54.2 | Low | 192 Ų | 192 | 135.5 Ų | 135.5 | 90% | 0.897 | 71% | 0.707 | S | S | * | * | trans | -74.1 | 100.5 | 177.7 | -162.7 | 153.9 | -150.8 | 0 | 0 | 107.7 | V436 I440 | V436-E438 PolarHBondContact O-N 3.33Å; E438-I440 PolarHBondContact O-N 3.41Å | ||
| 439 | E | 59.5 | Low | 55.9 | Low | 180 Ų | 180 | 132.8 Ų | 132.8 | 84% | 0.841 | 69% | 0.688 | S | S | * | * | P | Polyproline II helix | trans | -63.2 | 127.7 | 178.2 | -171.9 | 168.3 | -166.8 | 0 | 0 | 108.8 | P437 P441 | P437-E439 PolarHBondContact O-N 2.96Å; P437-E439 VanDerWaalsContact O-N 3.08Å; E439-P441 WeakPolarHBondContact O-CD 3.39Å |
| 440 | I | 59.4 | Low | 57.5 | Low | 116 Ų | 116 | 127.6 Ų | 127.6 | 60% | 0.595 | 67% | 0.667 | S | S | * | * | P | Polyproline II helix | trans | -61.4 | 123.4 | -174.4 | -61.9 | 173.7 | 0 | 0 | 0 | 108.1 | E438 V444 V445 | E438-I440 PolarHBondContact O-N 3.41Å; I440-V444 HydrophobicContact CG2-CB 4.01Å; I440-V444 HydrophobicContact CG2-CG1 4.23Å; I440-V445 HydrophobicContact CG2-CG2 4.12Å |
| 441 | P | 71 | Confident | 59.6 | Low | 65 Ų | 65 | 120.3 Ų | 120.3 | 42% | 0.422 | 64% | 0.644 | S | S | . | * | P | Polyproline II helix | trans | -57.8 | 135.7 | -178.8 | -23.9 | 33.2 | 0 | 0 | 0 | 110.8 | E439 E443 V444 | E439-P441 WeakPolarHBondContact O-CD 3.39Å; P441-E443 WeakPolarHBondContact CB-OE2 3.46Å; P441-E443 PolarHBondContact O-N 3.39Å; P441-V444 HydrophobicContact CB-CG2 4.33Å; P441-V444 HydrophobicContact CG-CG2 4.48Å; P441-V444 WeakPolarHBondContact O-CB 3.36Å; P441-V444 PolarHBondContact O-N 3.5Å |
| 442 | P | 61.9 | Low | 61.3 | Low | 92 Ų | 92 | 117.9 Ų | 117.9 | 60% | 0.597 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -60 | -23.1 | -176.1 | 25.1 | -34.9 | 0 | 0 | 0 | 112.8 | V444 V445 Q446 | P442-V444 VanDerWaalsContact C-N 3.31Å; P442-V444 PolarHBondContact O-N 3.18Å; P442-V445 PolarHBondContact O-N 3.39Å; P442-Q446 PolarHBondContact O-N 3.41Å |
| 443 | E | 67.8 | Low | 63.1 | Low | 129 Ų | 129 | 119.9 Ų | 119.9 | 60% | 0.603 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -60.5 | -37.9 | 173 | -59 | 76.8 | -168.4 | 0 | 0 | 112.2 | P441 Q446 E447 | P441-E443 WeakPolarHBondContact CB-OE2 3.46Å; P441-E443 PolarHBondContact O-N 3.39Å; E443-Q446 PolarHBondContact O-N 3Å; E443-E447 WeakPolarHBondContact O-CB 3.26Å; E443-E447 PolarHBondContact O-N 3.44Å |
| 444 | V | 69.6 | Low | 64.9 | Low | 75 Ų | 75 | 118.7 Ų | 118.7 | 46% | 0.455 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -73.9 | -31.3 | 178 | -176.6 | 0 | 0 | 0 | 0 | 111.1 | I440 P441 P442 Y448 | I440-V444 HydrophobicContact CG2-CB 4.01Å; I440-V444 HydrophobicContact CG2-CG1 4.23Å; P441-V444 HydrophobicContact CB-CG2 4.33Å; P441-V444 HydrophobicContact CG-CG2 4.48Å; P441-V444 WeakPolarHBondContact O-CB 3.36Å; P441-V444 PolarHBondContact O-N 3.5Å; P442-V444 VanDerWaalsContact C-N 3.31Å; P442-V444 PolarHBondContact O-N 3.18Å; V444-Y448 PolarHBondContact O-N 3.48Å; V444-Y448 VanDerWaalsContact O-N 3.11Å |
| 445 | V | 74.3 | Confident | 66.2 | Low | 78 Ų | 78 | 118.3 Ų | 118.3 | 47% | 0.473 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -70.3 | -39.5 | 173 | -175.8 | 0 | 0 | 0 | 0 | 110.4 | I440 P442 Y448 V449 | I440-V445 HydrophobicContact CG2-CG2 4.12Å; P442-V445 PolarHBondContact O-N 3.39Å; V445-Y448 PolarHBondContact O-N 2.98Å; V445-V449 WeakPolarHBondContact O-CG2 3.48Å; V445-V449 PolarHBondContact O-N 3.1Å |
| 446 | Q | 75.4 | Confident | 67.3 | Low | 105 Ų | 105 | 115.7 Ų | 115.7 | 49% | 0.491 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -65.8 | -47 | 174.6 | -168.1 | 63.9 | 58.4 | 0 | 0 | 111.3 | P442 E443 Y448 V449 D450 | P442-Q446 PolarHBondContact O-N 3.41Å; E443-Q446 PolarHBondContact O-N 3Å; Q446-Y448 VanDerWaalsContact C-N 3.26Å; Q446-Y448 PolarHBondContact O-N 3.08Å; Q446-V449 PolarHBondContact O-N 3.4Å; Q446-D450 PolarHBondContact NE2-OD1 2.56Å; Q446-D450 WeakPolarHBondContact O-CB 3.48Å; Q446-D450 PolarHBondContact O-N 3.14Å |
| 447 | E | 78.7 | Confident | 67.8 | Low | 120 Ų | 120 | 111.2 Ų | 111.2 | 56% | 0.561 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -56.3 | -39.7 | 175.6 | -175.4 | 175.9 | -168.2 | 0 | 0 | 111.8 | E443 I451 | E443-E447 WeakPolarHBondContact O-CB 3.26Å; E443-E447 PolarHBondContact O-N 3.44Å; E447-I451 HydrophobicContact CG-CD1 3.95Å; E447-I451 WeakPolarHBondContact O-CB 3.42Å; E447-I451 WeakPolarHBondContact O-CD1 3.44Å; E447-I451 WeakPolarHBondContact O-CG1 3.43Å; E447-I451 PolarHBondContact O-N 2.96Å |
| 448 | Y | 73.6 | Confident | 68.1 | Low | 151 Ų | 151 | 112.1 Ų | 112.1 | 59% | 0.592 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -65.2 | -41.3 | 173.2 | 176.8 | -98.6 | 0 | 0 | 0 | 113.2 | V444 V445 Q446 M452 | V444-Y448 PolarHBondContact O-N 3.48Å; V444-Y448 VanDerWaalsContact O-N 3.11Å; V445-Y448 PolarHBondContact O-N 2.98Å; Q446-Y448 VanDerWaalsContact C-N 3.26Å; Q446-Y448 PolarHBondContact O-N 3.08Å; Y448-M452 HydrophobicContact CD1-CG 4.43Å; Y448-M452 HydrophobicContact CE1-CG 3.99Å; Y448-M452 HydrophobicContact CE2-CG 4.08Å; Y448-M452 HydrophobicContact CE2-SD 4.39Å; Y448-M452 WeakPolarHBondContact O-CB 3.19Å; Y448-M452 VanDerWaalsContact O-CG 3.25Å; Y448-M452 WeakPolarHBondContact O-CG 3.39Å; Y448-M452 PolarHBondContact O-N 3.27Å |
| 449 | V | 76.6 | Confident | 67.5 | Low | 67 Ų | 67 | 108.6 Ų | 108.6 | 41% | 0.406 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -65.2 | -45.6 | 176.1 | 169.4 | 0 | 0 | 0 | 0 | 110.9 | V445 Q446 I451 M452 E453 | V445-V449 WeakPolarHBondContact O-CG2 3.48Å; V445-V449 PolarHBondContact O-N 3.1Å; Q446-V449 PolarHBondContact O-N 3.4Å; V449-I451 PolarHBondContact O-N 3.08Å; V449-M452 PolarHBondContact O-N 2.89Å; V449-M452 VanDerWaalsContact O-N 3.16Å; V449-E453 PolarHBondContact O-N 3.29Å |
| 450 | D | 73.2 | Confident | 66.6 | Low | 80 Ų | 80 | 109 Ų | 109 | 43% | 0.428 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -61.6 | -43.6 | 179.9 | -62.5 | -8.3 | 0 | 0 | 0 | 110.9 | Q446 M452 E453 E454 | Q446-D450 PolarHBondContact NE2-OD1 2.56Å; Q446-D450 WeakPolarHBondContact O-CB 3.48Å; Q446-D450 PolarHBondContact O-N 3.14Å; D450-M452 PolarHBondContact O-N 3.23Å; D450-E453 PolarHBondContact O-N 3.1Å; D450-E454 WeakPolarHBondContact O-CB 3.37Å; D450-E454 PolarHBondContact O-N 2.97Å |
| 451 | I | 77.6 | Confident | 65.4 | Low | 81 Ų | 81 | 106.8 Ų | 106.8 | 42% | 0.415 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -63.3 | -40.2 | 174.7 | -72.1 | 166.7 | 0 | 0 | 0 | 111.6 | E447 V449 L455 | E447-I451 HydrophobicContact CG-CD1 3.95Å; E447-I451 WeakPolarHBondContact O-CB 3.42Å; E447-I451 WeakPolarHBondContact O-CD1 3.44Å; E447-I451 WeakPolarHBondContact O-CG1 3.43Å; E447-I451 PolarHBondContact O-N 2.96Å; V449-I451 PolarHBondContact O-N 3.08Å; I451-L455 HydrophobicContact CG2-CD1 3.97Å; I451-L455 WeakPolarHBondContact O-CB 3.36Å; I451-L455 VanDerWaalsContact O-CG 3.3Å; I451-L455 WeakPolarHBondContact O-CG 3.5Å; I451-L455 PolarHBondContact O-N 3.35Å |
| 452 | M | 74.2 | Confident | 63.7 | Low | 76 Ų | 76 | 108.6 Ų | 108.6 | 37% | 0.374 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -68.9 | -33.5 | 177 | -73.9 | -62.9 | -55.3 | 0 | 0 | 112.3 | Y448 V449 D450 L455 L456 | Y448-M452 HydrophobicContact CD1-CG 4.43Å; Y448-M452 HydrophobicContact CE1-CG 3.99Å; Y448-M452 HydrophobicContact CE2-CG 4.08Å; Y448-M452 HydrophobicContact CE2-SD 4.39Å; Y448-M452 WeakPolarHBondContact O-CB 3.19Å; Y448-M452 VanDerWaalsContact O-CG 3.25Å; Y448-M452 WeakPolarHBondContact O-CG 3.39Å; Y448-M452 PolarHBondContact O-N 3.27Å; V449-M452 PolarHBondContact O-N 2.89Å; V449-M452 VanDerWaalsContact O-N 3.16Å; D450-M452 PolarHBondContact O-N 3.23Å; M452-L455 HydrophobicContact SD-CD1 4.43Å; M452-L456 WeakPolarHBondContact O-CD1 3.39Å; M452-L456 VanDerWaalsContact O-CG 3.28Å; M452-L456 WeakPolarHBondContact O-CG 3.4Å; M452-L456 PolarHBondContact O-N 3.09Å |
| 453 | E | 72.8 | Confident | 62.3 | Low | 136 Ų | 136 | 111.1 Ų | 111.1 | 64% | 0.636 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -73.5 | -38.9 | 174.5 | -168.7 | 165.3 | -154.5 | 0 | 0 | 111.7 | V449 D450 L455 L456 G457 | V449-E453 PolarHBondContact O-N 3.29Å; D450-E453 PolarHBondContact O-N 3.1Å; E453-L455 PolarHBondContact O-N 3.01Å; E453-L456 PolarHBondContact O-N 3.29Å; E453-G457 PolarHBondContact O-N 3.02Å |
| 454 | E | 74.5 | Confident | 60.7 | Low | 165 Ų | 165 | 108.2 Ų | 108.2 | 77% | 0.771 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -61.7 | -42 | 172.1 | -171.8 | 176.2 | 173.3 | 0 | 0 | 111.7 | D450 L456 G457 | D450-E454 WeakPolarHBondContact O-CB 3.37Å; D450-E454 PolarHBondContact O-N 2.97Å; E454-L456 VanDerWaalsContact C-N 3.31Å; E454-L456 PolarHBondContact O-N 3.46Å; E454-G457 PolarHBondContact O-N 3.47Å |
| 455 | L | 62.1 | Low | 59 | Low | 134 Ų | 134 | 113.5 Ų | 113.5 | 70% | 0.702 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -66.2 | -27.4 | 176.4 | -80.3 | 167.8 | 0 | 0 | 0 | 114.1 | I451 M452 E453 | I451-L455 HydrophobicContact CG2-CD1 3.97Å; I451-L455 WeakPolarHBondContact O-CB 3.36Å; I451-L455 VanDerWaalsContact O-CG 3.3Å; I451-L455 WeakPolarHBondContact O-CG 3.5Å; I451-L455 PolarHBondContact O-N 3.35Å; M452-L455 HydrophobicContact SD-CD1 4.43Å; E453-L455 PolarHBondContact O-N 3.01Å |
| 456 | L | 66.6 | Low | 57.5 | Low | 144 Ų | 144 | 114.7 Ų | 114.7 | 75% | 0.754 | 66% | 0.66 | S | S | * | * | H | α-helix | trans | -79.3 | -22.1 | 175.9 | -75.2 | 166.2 | 0 | 0 | 0 | 112.7 | M452 E453 E454 | M452-L456 WeakPolarHBondContact O-CD1 3.39Å; M452-L456 VanDerWaalsContact O-CG 3.28Å; M452-L456 WeakPolarHBondContact O-CG 3.4Å; M452-L456 PolarHBondContact O-N 3.09Å; E453-L456 PolarHBondContact O-N 3.29Å; E454-L456 VanDerWaalsContact C-N 3.31Å; E454-L456 PolarHBondContact O-N 3.46Å |
| 457 | G | 56.9 | Low | 55.9 | Low | 34 Ų | 34 | 118.5 Ų | 118.5 | 35% | 0.351 | 68% | 0.678 | S | S | . | * | trans | 74.6 | 167.6 | 173.4 | 0 | 0 | 0 | 0 | 0 | 115 | E453 E454 S459 | E453-G457 PolarHBondContact O-N 3.02Å; E454-G457 PolarHBondContact O-N 3.47Å; G457-S459 PolarHBondContact O-N 2.66Å; G457-S459 VanDerWaalsContact O-N 3.12Å | ||
| 458 | P | 50.8 | Low | 53.7 | Low | 135 Ų | 135 | 122.8 Ų | 122.8 | 88% | 0.877 | 70% | 0.695 | S | S | * | * | trans | -67.2 | 114.1 | -173.7 | -21.7 | 34.3 | 0 | 0 | 0 | 112.7 | L460 | P458-L460 PolarHBondContact O-N 3.2Š| ||
| 459 | S | 41.2 | Very low | 52 | Low | 118 Ų | 118 | 124.2 Ų | 124.2 | 83% | 0.825 | 71% | 0.707 | S | S | * | * | trans | -58.8 | 121.5 | 172 | -77.2 | 0 | 0 | 0 | 0 | 111 | G457 G461 | G457-S459 PolarHBondContact O-N 2.66Å; G457-S459 VanDerWaalsContact O-N 3.12Å; S459-G461 VanDerWaalsContact C-N 3.27Å; S459-G461 PolarHBondContact O-N 3.49Å | ||
| 460 | L | 40 | Very low | 50 | Low | 188 Ų | 188 | 131.6 Ų | 131.6 | 98% | 0.984 | 73% | 0.727 | S | S | * | * | S | Bend | trans | -75.2 | 71.8 | -174.6 | -162.5 | 89.2 | 0 | 0 | 0 | 111.7 | P458 | P458-L460 PolarHBondContact O-N 3.2Š|
| 461 | G | 34.3 | Very low | 48 | Very low | 70 Ų | 70 | 135 Ų | 135 | 72% | 0.722 | 74% | 0.74 | S | S | * | * | trans | -145.6 | 23.1 | -166.4 | 0 | 0 | 0 | 0 | 0 | 116.8 | S459 | S459-G461 VanDerWaalsContact C-N 3.27Å; S459-G461 PolarHBondContact O-N 3.49Å | ||
| 462 | A | 35.8 | Very low | 46.3 | Very low | 102 Ų | 102 | 140.2 Ų | 140.2 | 84% | 0.843 | 76% | 0.763 | S | S | * | * | trans | -109.4 | 71.4 | -176.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 463 | T | 33 | Very low | 44.8 | Very low | 146 Ų | 146 | 140.1 Ų | 140.1 | 90% | 0.896 | 78% | 0.782 | S | S | * | * | trans | -148 | 124.7 | 158 | -66.1 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 464 | G | 34.3 | Very low | 42.8 | Very low | 67 Ų | 67 | 141.8 Ų | 141.8 | 69% | 0.691 | 79% | 0.789 | S | S | * | * | trans | -100 | -155.6 | -154.3 | 0 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 465 | E | 32.8 | Very low | 41.4 | Very low | 186 Ų | 186 | 140.7 Ų | 140.7 | 87% | 0.869 | 79% | 0.794 | S | S | * | * | trans | 88.2 | 147.4 | -175.5 | -60.4 | -58.6 | 100.4 | 0 | 0 | 117.1 | ||||
| 466 | P | 43.3 | Very low | 40.1 | Very low | 103 Ų | 103 | 142.7 Ų | 142.7 | 67% | 0.669 | 80% | 0.797 | S | S | * | * | trans | -126.2 | 173.3 | -140.3 | 42.1 | -28.6 | 0 | 0 | 0 | 116.5 | ||||
| 467 | E | 40.8 | Very low | 38.7 | Very low | 185 Ų | 185 | 144 Ų | 144 | 86% | 0.864 | 80% | 0.799 | S | S | * | * | trans | 30.6 | 114.5 | 157.4 | -66.2 | -166.2 | 123.5 | 0 | 0 | 119.8 | ||||
| 468 | K | 34.2 | Very low | 38 | Very low | 211 Ų | 211 | 148.5 Ų | 148.5 | 92% | 0.917 | 82% | 0.822 | S | S | * | * | trans | -152.4 | 163.3 | 135 | -115.2 | 150.2 | -165.4 | 165.4 | 0 | 114.2 | ||||
| 469 | Q | 36.8 | Very low | 37.5 | Very low | 181 Ų | 181 | 150.6 Ų | 150.6 | 85% | 0.846 | 82% | 0.82 | S | S | * | * | trans | -88.6 | 161.4 | -166.7 | -59.7 | 159.9 | -17.6 | 0 | 0 | 112.4 | ||||
| 470 | R | 35 | Very low | 37.8 | Very low | 222 Ų | 222 | 154 Ų | 154 | 84% | 0.838 | 82% | 0.823 | S | S | * | * | trans | 66.6 | 159.7 | 174.2 | -83.8 | 175.6 | 167.4 | -133.2 | 0.3 | 114.1 | ||||
| 471 | E | 31.9 | Very low | 37.9 | Very low | 150 Ų | 150 | 152 Ų | 152 | 70% | 0.701 | 81% | 0.808 | S | S | * | * | cis | -136.8 | 164.2 | 13.1 | -158.3 | 130 | -123 | 0 | 0 | 112.6 | ||||
| 472 | E | 41.8 | Very low | 38.8 | Very low | 191 Ų | 191 | 156 Ų | 156 | 89% | 0.893 | 81% | 0.813 | S | S | * | * | trans | -87.8 | 124.3 | 176.1 | -178.9 | -178.5 | 174.3 | 0 | 0 | 110.5 | ||||
| 473 | G | 41.5 | Very low | 39 | Very low | 75 Ų | 75 | 161 Ų | 161 | 77% | 0.773 | 81% | 0.811 | S | S | * | * | trans | 100.4 | 99.6 | 158.5 | 0 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 474 | E | 31.9 | Very low | 40.7 | Very low | 170 Ų | 170 | 159.7 Ų | 159.7 | 79% | 0.794 | 80% | 0.802 | S | S | * | * | trans | -147.1 | 127.4 | 133.2 | -152.2 | -175.5 | 127.1 | 0 | 0 | 109.4 | K476 | E474-K476 PolarHBondContact O-N 3.43Š| ||
| 475 | V | 43.5 | Very low | 42 | Very low | 142 Ų | 142 | 161.6 Ų | 161.6 | 86% | 0.861 | 80% | 0.803 | S | S | * | * | trans | -84.4 | 100.8 | 175.3 | 177.4 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 476 | K | 36.5 | Very low | 43.8 | Very low | 177 Ų | 177 | 156.3 Ų | 156.3 | 77% | 0.77 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -79.7 | 132.9 | 161.7 | -73.5 | -171.8 | 175 | -179 | 0 | 109.4 | E474 | E474-K476 PolarHBondContact O-N 3.43Š|
| 477 | Q | 36.9 | Very low | 45.6 | Very low | 171 Ų | 171 | 156 Ų | 156 | 80% | 0.799 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -57.6 | 152.8 | 170.6 | -69 | 168.9 | -26.3 | 0 | 0 | 109.8 | Q479 | Q477-Q479 PolarHBondContact O-N 2.94Š|
| 478 | P | 41.4 | Very low | 47.6 | Very low | 128 Ų | 128 | 152.1 Ų | 152.1 | 83% | 0.831 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -54.2 | 128 | 165.2 | 25.7 | -33.4 | 0 | 0 | 0 | 108.4 | E480 | P478-E480 PolarHBondContact O-N 3.06Š|
| 479 | Q | 41.2 | Very low | 49.9 | Very low | 180 Ų | 180 | 144 Ų | 144 | 84% | 0.841 | 75% | 0.745 | S | S | * | * | P | Polyproline II helix | trans | -63 | 133 | 178.9 | -177.1 | 171.9 | -19.6 | 0 | 0 | 108.5 | Q477 E481 | Q477-Q479 PolarHBondContact O-N 2.94Å; Q479-E481 PolarHBondContact O-N 3.26Å; Q479-E481 VanDerWaalsContact O-N 3.15Å |
| 480 | E | 46.6 | Very low | 52.1 | Low | 189 Ų | 189 | 140.1 Ų | 140.1 | 88% | 0.883 | 73% | 0.729 | S | S | * | * | P | Polyproline II helix | trans | -53.2 | 123.5 | 174 | -71 | 178.2 | 117.5 | 0 | 0 | 108.9 | P478 D482 | P478-E480 PolarHBondContact O-N 3.06Å; E480-D482 PolarHBondContact O-N 3Å |
| 481 | E | 42.4 | Very low | 54.2 | Low | 145 Ų | 145 | 133.5 Ų | 133.5 | 68% | 0.678 | 71% | 0.71 | S | S | * | * | P | Polyproline II helix | trans | -64.3 | 132.9 | 179.2 | -64.7 | -176.9 | 138.3 | 0 | 0 | 108.9 | Q479 W483 | Q479-E481 PolarHBondContact O-N 3.26Å; Q479-E481 VanDerWaalsContact O-N 3.15Å; E481-W483 PolarHBondContact O-N 3.04Å |
| 482 | D | 52.3 | Low | 56.6 | Low | 154 Ų | 154 | 130.2 Ų | 130.2 | 82% | 0.824 | 70% | 0.703 | S | S | * | * | trans | -72.4 | 82.8 | -178.3 | -172.6 | 32.6 | 0 | 0 | 0 | 109.2 | E480 T484 | E480-D482 PolarHBondContact O-N 3Å; D482-T484 VanDerWaalsContact C-N 3.28Å; D482-T484 PolarHBondContact O-N 3.33Å | ||
| 483 | W | 41 | Very low | 58.7 | Low | 209 Ų | 209 | 127.9 Ų | 127.9 | 79% | 0.792 | 69% | 0.687 | S | S | * | * | trans | -60.6 | 88.6 | -177.1 | -77.6 | 100.6 | 0 | 0 | 0 | 110.7 | E481 P485 | E481-W483 PolarHBondContact O-N 3.04Å; W483-P485 WeakPolarHBondContact O-CD 3.21Å; W483-P485 VanDerWaalsContact O-N 3.13Å | ||
| 484 | T | 67.9 | Low | 60.7 | Low | 117 Ų | 117 | 127.2 Ų | 127.2 | 72% | 0.718 | 67% | 0.669 | S | S | * | * | P | Polyproline II helix | trans | -56.6 | 117.5 | 172.1 | -59.8 | 0 | 0 | 0 | 0 | 107.5 | D482 | D482-T484 VanDerWaalsContact C-N 3.28Å; D482-T484 PolarHBondContact O-N 3.33Å |
| 485 | P | 63.3 | Low | 63.2 | Low | 108 Ų | 108 | 124.3 Ų | 124.3 | 70% | 0.701 | 66% | 0.659 | S | S | * | * | P | Polyproline II helix | trans | -62.4 | 137.2 | -173.4 | 23.6 | -33.2 | 0 | 0 | 0 | 109.9 | W483 | W483-P485 WeakPolarHBondContact O-CD 3.21Å; W483-P485 VanDerWaalsContact O-N 3.13Å |
| 486 | P | 69.8 | Low | 65.4 | Low | 74 Ų | 74 | 124.1 Ų | 124.1 | 48% | 0.481 | 65% | 0.646 | S | S | . | * | P | Polyproline II helix | trans | -60.4 | 149 | -175.3 | 23.7 | -33.9 | 0 | 0 | 0 | 111.7 | L491 | P486-L491 HydrophobicContact CB-CG 4.42Å; P486-L491 HydrophobicContact CG-CD1 4.19Å; P486-L491 HydrophobicContact CG-CD2 3.9Å; P486-L491 HydrophobicContact CG-CG 4.07Å; P486-L491 WeakPolarHBondContact O-CD1 3.19Å |
| 487 | D | 81.4 | Confident | 67.6 | Low | 98 Ų | 98 | 117.3 Ų | 117.3 | 52% | 0.524 | 62% | 0.618 | S | S | . | * | P | Polyproline II helix | trans | -50.1 | 129.8 | -175.9 | 165.6 | 51.2 | 0 | 0 | 0 | 112.2 | G489 L490 L491 | D487-G489 VanDerWaalsContact CG-N 3.25Å; D487-G489 PolarHBondContact O-N 3.2Å; D487-G489 VanDerWaalsContact O-N 3.13Å; D487-G489 PolarHBondContact OD1-N 3.42Å; D487-G489 WeakPolarHBondContact OD2-CA 3.33Å; D487-G489 PolarHBondContact OD2-N 2.79Å; D487-L490 HydrophobicContact CB-CB 4.11Å; D487-L490 WeakPolarHBondContact O-CB 3.47Å; D487-L490 PolarHBondContact O-N 3.26Å; D487-L490 PolarHBondContact OD2-N 3.08Å; D487-L491 PolarHBondContact O-N 3.43Å |
| 488 | P | 82.1 | Confident | 69.8 | Low | 102 Ų | 102 | 112.8 Ų | 112.8 | 66% | 0.662 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -54.7 | -27.4 | 173.9 | -29.3 | 36.7 | 0 | 0 | 0 | 114.7 | S492 | P488-S492 WeakPolarHBondContact O-CB 3.32Å; P488-S492 PolarHBondContact O-N 3.08Å |
| 489 | G | 83.9 | Confident | 72 | Confident | 42 Ų | 42 | 111.2 Ų | 111.2 | 43% | 0.433 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -67.6 | -49.7 | 171.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | D487 S492 Y493 | D487-G489 VanDerWaalsContact CG-N 3.25Å; D487-G489 PolarHBondContact O-N 3.2Å; D487-G489 VanDerWaalsContact O-N 3.13Å; D487-G489 PolarHBondContact OD1-N 3.42Å; D487-G489 WeakPolarHBondContact OD2-CA 3.33Å; D487-G489 PolarHBondContact OD2-N 2.79Å; G489-S492 PolarHBondContact O-N 3.5Å; G489-Y493 WeakPolarHBondContact O-CB 3.22Å; G489-Y493 PolarHBondContact O-N 3.21Å |
| 490 | L | 82.3 | Confident | 74.3 | Confident | 98 Ų | 98 | 107.1 Ų | 107.1 | 51% | 0.513 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -60.2 | -43.8 | 174.4 | -179.1 | 62.8 | 0 | 0 | 0 | 112.1 | D487 Y493 T494 | D487-L490 HydrophobicContact CB-CB 4.11Å; D487-L490 WeakPolarHBondContact O-CB 3.47Å; D487-L490 PolarHBondContact O-N 3.26Å; D487-L490 PolarHBondContact OD2-N 3.08Å; L490-Y493 PolarHBondContact O-N 3.31Å; L490-T494 WeakPolarHBondContact O-CB 3.49Å; L490-T494 PolarHBondContact O-N 3.19Å; L490-T494 PolarHBondContact O-OG1 2.96Å |
| 491 | L | 78.9 | Confident | 76 | Confident | 84 Ų | 84 | 104.5 Ų | 104.5 | 44% | 0.44 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -59.2 | -50.5 | 174.3 | -75.6 | 173.7 | 0 | 0 | 0 | 111.3 | P486 D487 Y493 T494 D495 | P486-L491 HydrophobicContact CB-CG 4.42Å; P486-L491 HydrophobicContact CG-CD1 4.19Å; P486-L491 HydrophobicContact CG-CD2 3.9Å; P486-L491 HydrophobicContact CG-CG 4.07Å; P486-L491 WeakPolarHBondContact O-CD1 3.19Å; D487-L491 PolarHBondContact O-N 3.43Å; L491-Y493 VanDerWaalsContact C-N 3.29Å; L491-Y493 PolarHBondContact O-N 3.35Å; L491-T494 WeakPolarHBondContact O-CB 3.45Å; L491-T494 PolarHBondContact O-N 3.3Å; L491-D495 PolarHBondContact O-N 3.03Å |
| 492 | S | 83.1 | Confident | 77.8 | Confident | 80 Ų | 80 | 103.4 Ų | 103.4 | 56% | 0.559 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -59.1 | -37.5 | 176.5 | -178.4 | 0 | 0 | 0 | 0 | 112.8 | P488 G489 K496 | P488-S492 WeakPolarHBondContact O-CB 3.32Å; P488-S492 PolarHBondContact O-N 3.08Å; G489-S492 PolarHBondContact O-N 3.5Å; S492-K496 VanDerWaalsContact O-CB 3.23Å; S492-K496 WeakPolarHBondContact O-CB 3.16Å; S492-K496 PolarHBondContact O-N 2.89Å |
| 493 | Y | 84.3 | Confident | 79 | Confident | 142 Ų | 142 | 99.8 Ų | 99.8 | 56% | 0.557 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -68.2 | -39 | 173.4 | 178.6 | -111.4 | 0 | 0 | 0 | 112.4 | G489 L490 L491 K496 L497 | G489-Y493 WeakPolarHBondContact O-CB 3.22Å; G489-Y493 PolarHBondContact O-N 3.21Å; L490-Y493 PolarHBondContact O-N 3.31Å; L491-Y493 VanDerWaalsContact C-N 3.29Å; L491-Y493 PolarHBondContact O-N 3.35Å; Y493-K496 CarbonylContact O-C 3.58Å; Y493-K496 WeakPolarHBondContact O-CB 3.5Å; Y493-K496 PolarHBondContact O-N 2.92Å; Y493-L497 HydrophobicContact CD1-CD1 4.15Å; Y493-L497 HydrophobicContact CE1-CD1 3.57Å; Y493-L497 HydrophobicContact CE1-CG 4.21Å; Y493-L497 HydrophobicContact CE2-CD2 4.43Å; Y493-L497 HydrophobicContact CE2-CG 4.35Å; Y493-L497 WeakPolarHBondContact O-CG 3.07Å; Y493-L497 PolarHBondContact O-N 2.91Å |
| 494 | T | 84.3 | Confident | 80.6 | Confident | 62 Ų | 62 | 91.5 Ų | 91.5 | 38% | 0.38 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -67.1 | -46.6 | 177.8 | -54 | 0 | 0 | 0 | 0 | 110.6 | L490 L491 K496 L497 C498 | L490-T494 WeakPolarHBondContact O-CB 3.49Å; L490-T494 PolarHBondContact O-N 3.19Å; L490-T494 PolarHBondContact O-OG1 2.96Å; L491-T494 WeakPolarHBondContact O-CB 3.45Å; L491-T494 PolarHBondContact O-N 3.3Å; T494-K496 PolarHBondContact O-N 3.23Å; T494-L497 PolarHBondContact O-N 3.04Å; T494-L497 VanDerWaalsContact O-N 3.1Å; T494-C498 WeakPolarHBondContact O-CB 3.37Å; T494-C498 PolarHBondContact O-N 3.41Å; T494-C498 PolarHBondContact O-SG 2.85Å; T494-C498 VanDerWaalsContact O-SG 3.41Å |
| 495 | D | 84.4 | Confident | 80.8 | Confident | 109 Ų | 109 | 89 Ų | 89 | 58% | 0.583 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -56.6 | -38.3 | 169.9 | -78.5 | -22.3 | 0 | 0 | 0 | 111.6 | L491 C498 S499 | L491-D495 PolarHBondContact O-N 3.03Å; D495-C498 PolarHBondContact O-N 3.47Å; D495-S499 VanDerWaalsContact O-CB 3.24Å; D495-S499 WeakPolarHBondContact O-CB 3.42Å; D495-S499 PolarHBondContact O-N 2.83Å; D495-S499 PolarHBondContact O-OG 3.08Å |
| 496 | K | 89.3 | Confident | 81.3 | Confident | 137 Ų | 137 | 90.7 Ų | 90.7 | 60% | 0.596 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -68.9 | -31.6 | 177.5 | -172.7 | 61.6 | 175.2 | -176.5 | 0 | 113 | S492 Y493 T494 Q500 | S492-K496 VanDerWaalsContact O-CB 3.23Å; S492-K496 WeakPolarHBondContact O-CB 3.16Å; S492-K496 PolarHBondContact O-N 2.89Å; Y493-K496 CarbonylContact O-C 3.58Å; Y493-K496 WeakPolarHBondContact O-CB 3.5Å; Y493-K496 PolarHBondContact O-N 2.92Å; T494-K496 PolarHBondContact O-N 3.23Å; K496-Q500 PolarHBondContact O-NE2 2.83Å |
| 497 | L | 82.7 | Confident | 81.5 | Confident | 35 Ų | 35 | 89.9 Ų | 89.9 | 18% | 0.183 | 49% | 0.486 | C | S | . | . | H | α-helix | trans | -74 | -48.5 | 170.9 | -70.2 | 177.7 | 0 | 0 | 0 | 111.2 | Y493 T494 S499 Q500 F503 | Y493-L497 HydrophobicContact CD1-CD1 4.15Å; Y493-L497 HydrophobicContact CE1-CD1 3.57Å; Y493-L497 HydrophobicContact CE1-CG 4.21Å; Y493-L497 HydrophobicContact CE2-CD2 4.43Å; Y493-L497 HydrophobicContact CE2-CG 4.35Å; Y493-L497 WeakPolarHBondContact O-CG 3.07Å; Y493-L497 PolarHBondContact O-N 2.91Å; T494-L497 PolarHBondContact O-N 3.04Å; T494-L497 VanDerWaalsContact O-N 3.1Å; L497-S499 PolarHBondContact O-N 3.02Å; L497-Q500 WeakPolarHBondContact O-CB 3.17Å; L497-Q500 PolarHBondContact O-N 3Å; L497-F503 HydrophobicContact CB-CD1 3.9Å; L497-F503 HydrophobicContact CB-CE1 3.74Å; L497-F503 HydrophobicContact CB-CG 4.37Å; L497-F503 HydrophobicContact CB-CZ 4.07Å; L497-F503 HydrophobicContact CD1-CE2 4.31Å; L497-F503 HydrophobicContact CD1-CZ 4.02Å; L497-F503 HydrophobicContact CD2-CD2 4.21Å; L497-F503 HydrophobicContact CD2-CE2 4.21Å; L497-F503 HydrophobicContact CG-CZ 4.45Å; L497-F503 WeakPolarHBondContact O-CD1 3.09Å |
| 498 | C | 83.8 | Confident | 80.8 | Confident | 75 Ų | 75 | 90 Ų | 90 | 51% | 0.507 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -63.2 | -24.3 | 176.8 | -66.5 | 0 | 0 | 0 | 0 | 113.1 | T494 D495 Q500 V504 | T494-C498 WeakPolarHBondContact O-CB 3.37Å; T494-C498 PolarHBondContact O-N 3.41Å; T494-C498 PolarHBondContact O-SG 2.85Å; T494-C498 VanDerWaalsContact O-SG 3.41Å; D495-C498 PolarHBondContact O-N 3.47Å; C498-Q500 VanDerWaalsContact C-N 3.26Å; C498-Q500 PolarHBondContact O-N 3Å; C498-V504 WeakPolarHBondContact O-CG2 3.16Å |
| 499 | S | 87.9 | Confident | 80.1 | Confident | 96 Ų | 96 | 89.1 Ų | 89.1 | 67% | 0.671 | 49% | 0.485 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.2 | -15.3 | 170.7 | -64.6 | 0 | 0 | 0 | 0 | 114.1 | D495 L497 | D495-S499 VanDerWaalsContact O-CB 3.24Å; D495-S499 WeakPolarHBondContact O-CB 3.42Å; D495-S499 PolarHBondContact O-N 2.83Å; D495-S499 PolarHBondContact O-OG 3.08Å; L497-S499 PolarHBondContact O-N 3.02Å |
| 500 | Q | 88.3 | Confident | 79.3 | Confident | 93 Ų | 93 | 90.8 Ų | 90.8 | 44% | 0.435 | 49% | 0.486 | S | S | . | . | trans | -92 | 106.9 | -179.3 | -70.1 | 168.1 | 72.4 | 0 | 0 | 109.8 | K496 L497 C498 D502 F503 V504 | K496-Q500 PolarHBondContact O-NE2 2.83Å; L497-Q500 WeakPolarHBondContact O-CB 3.17Å; L497-Q500 PolarHBondContact O-N 3Å; C498-Q500 VanDerWaalsContact C-N 3.26Å; C498-Q500 PolarHBondContact O-N 3Å; Q500-D502 PolarHBondContact O-N 3.45Å; Q500-F503 HydrophobicContact CB-CB 3.85Å; Q500-F503 WeakPolarHBondContact O-CA 3.47Å; Q500-F503 WeakPolarHBondContact O-CB 3.49Å; Q500-F503 PolarHBondContact O-N 3.24Å; Q500-V504 PolarHBondContact O-N 3.45Å | ||
| 501 | K | 83.4 | Confident | 78.8 | Confident | 134 Ų | 134 | 88.9 Ų | 88.9 | 58% | 0.583 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -58.1 | -36.2 | -176.4 | -168.8 | 57.5 | -177.3 | 152.9 | 0 | 112.8 | F503 T505 E508 | K501-F503 VanDerWaalsContact C-N 3.3Å; K501-F503 PolarHBondContact O-N 3Å; K501-T505 PolarHBondContact NZ-OG1 3.15Å; K501-T505 WeakPolarHBondContact O-CB 3.48Å; K501-T505 PolarHBondContact O-N 3.27Å; K501-T505 PolarHBondContact O-OG1 3.07Å; K501-E508 IonicContact NZ-OE2 3.79Å |
| 502 | D | 78.9 | Confident | 78.1 | Confident | 123 Ų | 123 | 88.8 Ų | 88.8 | 66% | 0.658 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -70.6 | -19.9 | 175.6 | -62.7 | -17.6 | 0 | 0 | 0 | 114.2 | Q500 K506 | Q500-D502 PolarHBondContact O-N 3.45Å; D502-K506 WeakPolarHBondContact O-CD 3.29Å; D502-K506 WeakPolarHBondContact O-CE 3.16Å; D502-K506 WeakPolarHBondContact O-CG 3.38Å; D502-K506 PolarHBondContact O-NZ 3.05Å |
| 503 | F | 79.1 | Confident | 77.1 | Confident | 77 Ų | 77 | 88.9 Ų | 88.9 | 34% | 0.338 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -82.1 | -54.5 | 172.1 | 174.6 | -93.5 | 0 | 0 | 0 | 109.2 | L497 Q500 K501 T505 K506 V507 | L497-F503 HydrophobicContact CB-CD1 3.9Å; L497-F503 HydrophobicContact CB-CE1 3.74Å; L497-F503 HydrophobicContact CB-CG 4.37Å; L497-F503 HydrophobicContact CB-CZ 4.07Å; L497-F503 HydrophobicContact CD1-CE2 4.31Å; L497-F503 HydrophobicContact CD1-CZ 4.02Å; L497-F503 HydrophobicContact CD2-CD2 4.21Å; L497-F503 HydrophobicContact CD2-CE2 4.21Å; L497-F503 HydrophobicContact CG-CZ 4.45Å; L497-F503 WeakPolarHBondContact O-CD1 3.09Å; Q500-F503 HydrophobicContact CB-CB 3.85Å; Q500-F503 WeakPolarHBondContact O-CA 3.47Å; Q500-F503 WeakPolarHBondContact O-CB 3.49Å; Q500-F503 PolarHBondContact O-N 3.24Å; K501-F503 VanDerWaalsContact C-N 3.3Å; K501-F503 PolarHBondContact O-N 3Å; F503-T505 VanDerWaalsContact C-N 3.35Å; F503-T505 PolarHBondContact O-N 2.93Å; F503-K506 PolarHBondContact O-N 3.44Å; F503-V507 HydrophobicContact CD1-CG2 4.31Å; F503-V507 HydrophobicContact CE1-CG2 3.92Å; F503-V507 HydrophobicContact CE2-CG2 4.29Å; F503-V507 HydrophobicContact CZ-CG2 3.92Å; F503-V507 WeakPolarHBondContact O-CG2 3.42Å; F503-V507 PolarHBondContact O-N 2.96Å |
| 504 | V | 73.1 | Confident | 75.8 | Confident | 35 Ų | 35 | 87.2 Ų | 87.2 | 21% | 0.212 | 47% | 0.469 | C | S | . | . | H | α-helix | trans | -53.2 | -50.6 | 179.1 | 173.8 | 0 | 0 | 0 | 0 | 111 | C498 Q500 K506 V507 E508 | C498-V504 WeakPolarHBondContact O-CG2 3.16Å; Q500-V504 PolarHBondContact O-N 3.45Å; V504-K506 VanDerWaalsContact C-N 3.27Å; V504-K506 PolarHBondContact O-N 3.39Å; V504-V507 CarbonylContact O-C 3.17Å; V504-V507 PolarHBondContact O-N 2.86Å; V504-E508 HydrophobicContact CG1-CG 4.01Å; V504-E508 WeakPolarHBondContact CG1-OE1 3.49Å; V504-E508 WeakPolarHBondContact O-CB 3.37Å; V504-E508 VanDerWaalsContact O-CG 3.29Å; V504-E508 WeakPolarHBondContact O-CG 3.39Å; V504-E508 PolarHBondContact O-N 2.9Å |
| 505 | T | 71.9 | Confident | 74.9 | Confident | 64 Ų | 64 | 87.9 Ų | 87.9 | 39% | 0.393 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -74 | -12.2 | -177.9 | -63.9 | 0 | 0 | 0 | 0 | 114.7 | K501 F503 E508 A509 | K501-T505 PolarHBondContact NZ-OG1 3.15Å; K501-T505 WeakPolarHBondContact O-CB 3.48Å; K501-T505 PolarHBondContact O-N 3.27Å; K501-T505 PolarHBondContact O-OG1 3.07Å; F503-T505 VanDerWaalsContact C-N 3.35Å; F503-T505 PolarHBondContact O-N 2.93Å; T505-E508 WeakPolarHBondContact CA-OE2 3.5Å; T505-E508 WeakPolarHBondContact CB-OE2 3.46Å; T505-E508 PolarHBondContact OG1-OE2 3.42Å; T505-A509 WeakPolarHBondContact O-CB 3.44Å; T505-A509 PolarHBondContact O-N 3.11Å |
| 506 | K | 75.6 | Confident | 73.9 | Confident | 144 Ų | 144 | 85.7 Ų | 85.7 | 63% | 0.626 | 46% | 0.455 | S | S | * | . | H | α-helix | trans | -80.7 | -38.1 | 164.7 | -73 | 169.9 | -162.5 | 156.3 | 0 | 111.9 | D502 F503 V504 A509 V510 | D502-K506 WeakPolarHBondContact O-CD 3.29Å; D502-K506 WeakPolarHBondContact O-CE 3.16Å; D502-K506 WeakPolarHBondContact O-CG 3.38Å; D502-K506 PolarHBondContact O-NZ 3.05Å; F503-K506 PolarHBondContact O-N 3.44Å; V504-K506 VanDerWaalsContact C-N 3.27Å; V504-K506 PolarHBondContact O-N 3.39Å; K506-A509 PolarHBondContact O-N 3.02Å; K506-V510 WeakPolarHBondContact O-CG2 3.39Å; K506-V510 PolarHBondContact O-N 2.82Å |
| 507 | V | 73.6 | Confident | 72.8 | Confident | 58 Ų | 58 | 86 Ų | 86 | 35% | 0.352 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -68.7 | -46.9 | 176 | 173.7 | 0 | 0 | 0 | 0 | 110.7 | F503 V504 A509 V510 I511 | F503-V507 HydrophobicContact CD1-CG2 4.31Å; F503-V507 HydrophobicContact CE1-CG2 3.92Å; F503-V507 HydrophobicContact CE2-CG2 4.29Å; F503-V507 HydrophobicContact CZ-CG2 3.92Å; F503-V507 WeakPolarHBondContact O-CG2 3.42Å; F503-V507 PolarHBondContact O-N 2.96Å; V504-V507 CarbonylContact O-C 3.17Å; V504-V507 PolarHBondContact O-N 2.86Å; V507-A509 PolarHBondContact O-N 2.69Å; V507-V510 PolarHBondContact O-N 3.1Å; V507-I511 HydrophobicContact CG1-CD1 3.58Å; V507-I511 HydrophobicContact CG1-CG1 4.16Å; V507-I511 WeakPolarHBondContact O-CG1 3.15Å; V507-I511 PolarHBondContact O-N 2.92Å |
| 508 | E | 66.8 | Low | 71.9 | Confident | 99 Ų | 99 | 87.7 Ų | 87.7 | 46% | 0.463 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -52.4 | -35.7 | 172 | -70.6 | 168.6 | 155.6 | 0 | 0 | 112.1 | K501 V504 T505 V510 | K501-E508 IonicContact NZ-OE2 3.79Å; V504-E508 HydrophobicContact CG1-CG 4.01Å; V504-E508 WeakPolarHBondContact CG1-OE1 3.49Å; V504-E508 WeakPolarHBondContact O-CB 3.37Å; V504-E508 VanDerWaalsContact O-CG 3.29Å; V504-E508 WeakPolarHBondContact O-CG 3.39Å; V504-E508 PolarHBondContact O-N 2.9Å; T505-E508 WeakPolarHBondContact CA-OE2 3.5Å; T505-E508 WeakPolarHBondContact CB-OE2 3.46Å; T505-E508 PolarHBondContact OG1-OE2 3.42Å; E508-V510 VanDerWaalsContact C-N 3.35Å |
| 509 | A | 66.8 | Low | 70.8 | Confident | 85 Ų | 85 | 88 Ų | 88 | 70% | 0.702 | 46% | 0.462 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.7 | -2.6 | -179.9 | 0 | 0 | 0 | 0 | 0 | 114.7 | T505 K506 V507 | T505-A509 WeakPolarHBondContact O-CB 3.44Å; T505-A509 PolarHBondContact O-N 3.11Å; K506-A509 PolarHBondContact O-N 3.02Å; V507-A509 PolarHBondContact O-N 2.69Å |
| 510 | V | 67.8 | Low | 69.7 | Low | 76 Ų | 76 | 89.7 Ų | 89.7 | 46% | 0.461 | 46% | 0.462 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -110.3 | -32.8 | 177.7 | 167.4 | 0 | 0 | 0 | 0 | 111.6 | Q9 K506 V507 E508 | Q9-V510 HydrophobicContact CG-CG1 4.12Å; K506-V510 WeakPolarHBondContact O-CG2 3.39Å; K506-V510 PolarHBondContact O-N 2.82Å; V507-V510 PolarHBondContact O-N 3.1Å; E508-V510 VanDerWaalsContact C-N 3.35Å |
| 511 | I | 70.6 | Confident | 68.5 | Low | 59 Ų | 59 | 87.8 Ų | 87.8 | 30% | 0.303 | 46% | 0.459 | S | S | . | . | S | Bend | trans | -68.3 | 136 | 173.8 | -63.8 | 174.4 | 0 | 0 | 0 | 109.5 | V507 F515 L516 | V507-I511 HydrophobicContact CG1-CD1 3.58Å; V507-I511 HydrophobicContact CG1-CG1 4.16Å; V507-I511 WeakPolarHBondContact O-CG1 3.15Å; V507-I511 PolarHBondContact O-N 2.92Å; I511-F515 HydrophobicContact CG2-CD1 3.93Å; I511-L516 HydrophobicContact CG2-CB 3.89Å; I511-L516 HydrophobicContact CG2-CD1 4.46Å |
| 512 | H | 65.4 | Low | 67 | Low | 81 Ų | 81 | 87.7 Ų | 87.7 | 38% | 0.375 | 47% | 0.472 | S | S | . | . | trans | -71.4 | 132 | 177.9 | -164.1 | -128.1 | 0 | 0 | 0 | 110.5 | Q514 F515 L516 | H512-Q514 PolarHBondContact CE1-OE1 2.96Å; H512-Q514 PolarHBondContact O-N 3.3Å; H512-F515 HydrophobicContact CB-CB 4.04Å; H512-F515 WeakPolarHBondContact O-CB 3.24Å; H512-F515 PolarHBondContact O-N 3.18Å; H512-L516 PolarHBondContact O-N 2.86Å | ||
| 513 | P | 60.6 | Low | 65.9 | Low | 83 Ų | 83 | 86.5 Ų | 86.5 | 54% | 0.539 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -58.3 | -42.9 | -173.1 | -28.9 | 36.7 | 0 | 0 | 0 | 114.3 | L516 E517 | P513-L516 WeakPolarHBondContact O-CB 3.48Å; P513-L516 PolarHBondContact O-N 3.06Å; P513-E517 WeakPolarHBondContact O-CG 3.44Å; P513-E517 PolarHBondContact O-N 2.76Å |
| 514 | Q | 58.6 | Low | 64.6 | Low | 107 Ų | 107 | 89 Ų | 89 | 50% | 0.5 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -63.5 | -44.7 | 177.5 | -70.6 | 166.2 | -63.9 | 0 | 0 | 111.6 | H512 L516 E517 E518 | H512-Q514 PolarHBondContact CE1-OE1 2.96Å; H512-Q514 PolarHBondContact O-N 3.3Å; Q514-L516 PolarHBondContact O-N 2.84Å; Q514-E517 PolarHBondContact O-N 3.23Å; Q514-E517 VanDerWaalsContact O-N 3.11Å; Q514-E518 WeakPolarHBondContact O-CB 3.48Å; Q514-E518 WeakPolarHBondContact O-CG 3.44Å; Q514-E518 PolarHBondContact O-N 2.75Å |
| 515 | F | 64.4 | Low | 63.7 | Low | 76 Ų | 76 | 95.7 Ų | 95.7 | 33% | 0.333 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -60.5 | -31.9 | 174.4 | 175.5 | -100.8 | 0 | 0 | 0 | 112.6 | I511 H512 L519 L531 | I511-F515 HydrophobicContact CG2-CD1 3.93Å; H512-F515 HydrophobicContact CB-CB 4.04Å; H512-F515 WeakPolarHBondContact O-CB 3.24Å; H512-F515 PolarHBondContact O-N 3.18Å; F515-L519 HydrophobicContact CD1-CD1 3.76Å; F515-L519 HydrophobicContact CE1-CD1 3.34Å; F515-L519 HydrophobicContact CE1-CG 4.26Å; F515-L519 HydrophobicContact CE2-CD1 4.34Å; F515-L519 HydrophobicContact CE2-CG 4.47Å; F515-L519 HydrophobicContact CG-CD1 4.44Å; F515-L519 HydrophobicContact CZ-CD1 3.67Å; F515-L519 HydrophobicContact CZ-CG 4.24Å; F515-L519 WeakPolarHBondContact O-CB 3.37Å; F515-L519 VanDerWaalsContact O-CG 3.26Å; F515-L519 WeakPolarHBondContact O-CG 3.47Å; F515-L519 PolarHBondContact O-N 3.21Å; F515-L531 HydrophobicContact CD2-CD2 4.33Å |
| 516 | L | 64.1 | Low | 62.7 | Low | 62 Ų | 62 | 95 Ų | 95 | 33% | 0.325 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -75.1 | -40.1 | 172.9 | -173.8 | 60.3 | 0 | 0 | 0 | 112.5 | I511 H512 P513 Q514 E518 L520 | I511-L516 HydrophobicContact CG2-CB 3.89Å; I511-L516 HydrophobicContact CG2-CD1 4.46Å; H512-L516 PolarHBondContact O-N 2.86Å; P513-L516 WeakPolarHBondContact O-CB 3.48Å; P513-L516 PolarHBondContact O-N 3.06Å; Q514-L516 PolarHBondContact O-N 2.84Å; L516-E518 VanDerWaalsContact C-N 3.3Å; L516-E518 PolarHBondContact O-N 2.8Å; L516-L520 HydrophobicContact CD1-CD1 3.87Å; L516-L520 HydrophobicContact CD1-CG 4.22Å; L516-L520 HydrophobicContact CG-CD1 4Å; L516-L520 WeakPolarHBondContact O-CB 3.45Å; L516-L520 WeakPolarHBondContact O-CG 3.5Å; L516-L520 PolarHBondContact O-N 3.16Å; L516-L520 VanDerWaalsContact O-N 3.08Å |
| 517 | E | 65.1 | Low | 61.8 | Low | 144 Ų | 144 | 92.8 Ų | 92.8 | 67% | 0.673 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -64.1 | -35.7 | 174.7 | -73.1 | 177.5 | -177.6 | 0 | 0 | 111.7 | P513 Q514 L520 S521 | P513-E517 WeakPolarHBondContact O-CG 3.44Å; P513-E517 PolarHBondContact O-N 2.76Å; Q514-E517 PolarHBondContact O-N 3.23Å; Q514-E517 VanDerWaalsContact O-N 3.11Å; E517-L520 CarbonylContact O-C 3.27Å; E517-S521 PolarHBondContact O-N 3.25Å |
| 518 | E | 64.1 | Low | 60.6 | Low | 71 Ų | 71 | 95.9 Ų | 95.9 | 33% | 0.332 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -78.7 | -40.2 | 177.6 | -70.5 | 166.1 | -132 | 0 | 0 | 112.3 | Q514 L516 L520 S521 M526 L531 | Q514-E518 WeakPolarHBondContact O-CB 3.48Å; Q514-E518 WeakPolarHBondContact O-CG 3.44Å; Q514-E518 PolarHBondContact O-N 2.75Å; L516-E518 VanDerWaalsContact C-N 3.3Å; L516-E518 PolarHBondContact O-N 2.8Å; E518-L520 PolarHBondContact O-N 3.3Å; E518-S521 WeakPolarHBondContact O-CB 3.28Å; E518-S521 PolarHBondContact O-N 2.88Å; E518-M526 HydrophobicContact CB-SD 4.32Å; E518-M526 WeakPolarHBondContact O-CE 3.25Å; E518-L531 HydrophobicContact CB-CD1 4.25Å; E518-L531 WeakPolarHBondContact OE2-CD1 3.45Å; E518-L531 WeakPolarHBondContact OE2-CD2 3.38Å |
| 519 | L | 61.4 | Low | 59.9 | Low | 81 Ų | 81 | 97.5 Ų | 97.5 | 42% | 0.424 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -59.2 | -30.1 | 169.3 | -87.8 | 173.4 | 0 | 0 | 0 | 113.5 | F515 F528 | F515-L519 HydrophobicContact CD1-CD1 3.76Å; F515-L519 HydrophobicContact CE1-CD1 3.34Å; F515-L519 HydrophobicContact CE1-CG 4.26Å; F515-L519 HydrophobicContact CE2-CD1 4.34Å; F515-L519 HydrophobicContact CE2-CG 4.47Å; F515-L519 HydrophobicContact CG-CD1 4.44Å; F515-L519 HydrophobicContact CZ-CD1 3.67Å; F515-L519 HydrophobicContact CZ-CG 4.24Å; F515-L519 WeakPolarHBondContact O-CB 3.37Å; F515-L519 VanDerWaalsContact O-CG 3.26Å; F515-L519 WeakPolarHBondContact O-CG 3.47Å; F515-L519 PolarHBondContact O-N 3.21Å; L519-F528 HydrophobicContact CD2-CE1 3.88Å |
| 520 | L | 63.8 | Low | 59.4 | Low | 131 Ų | 131 | 95.7 Ų | 95.7 | 69% | 0.686 | 51% | 0.512 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -97.2 | 3.1 | 178.2 | -62.2 | 175.2 | 0 | 0 | 0 | 112.7 | L516 E517 E518 | L516-L520 HydrophobicContact CD1-CD1 3.87Å; L516-L520 HydrophobicContact CD1-CG 4.22Å; L516-L520 HydrophobicContact CG-CD1 4Å; L516-L520 WeakPolarHBondContact O-CB 3.45Å; L516-L520 WeakPolarHBondContact O-CG 3.5Å; L516-L520 PolarHBondContact O-N 3.16Å; L516-L520 VanDerWaalsContact O-N 3.08Å; E517-L520 CarbonylContact O-C 3.27Å; E518-L520 PolarHBondContact O-N 3.3Å |
| 521 | S | 62.9 | Low | 58.6 | Low | 53 Ų | 53 | 93.1 Ų | 93.1 | 37% | 0.371 | 50% | 0.496 | S | S | . | . | trans | -72.1 | 135.8 | 175.7 | -175 | 0 | 0 | 0 | 0 | 110.3 | E517 E518 D523 | E517-S521 PolarHBondContact O-N 3.25Å; E518-S521 WeakPolarHBondContact O-CB 3.28Å; E518-S521 PolarHBondContact O-N 2.88Å; S521-D523 PolarHBondContact O-N 3.05Å; S521-D523 VanDerWaalsContact O-N 3.14Å | ||
| 522 | P | 51.7 | Low | 57.6 | Low | 132 Ų | 132 | 93.5 Ų | 93.5 | 86% | 0.857 | 50% | 0.504 | S | S | * | . | trans | -78.6 | 13.1 | -179.2 | 34.3 | -37.7 | 0 | 0 | 0 | 113.9 | P524 | P522-P524 WeakPolarHBondContact O-CD 3.23Š| ||
| 523 | D | 57.1 | Low | 57 | Low | 99 Ų | 99 | 94.5 Ų | 94.5 | 53% | 0.529 | 51% | 0.508 | S | S | . | . | trans | -86 | 114.5 | -177.7 | -157.9 | -28.9 | 0 | 0 | 0 | 110.8 | S521 Q525 M526 | S521-D523 PolarHBondContact O-N 3.05Å; S521-D523 VanDerWaalsContact O-N 3.14Å; D523-Q525 PolarHBondContact O-N 3.5Å; D523-Q525 VanDerWaalsContact O-N 3.09Å; D523-M526 HydrophobicContact CB-CE 4.2Å | ||
| 524 | P | 51.7 | Low | 56.7 | Low | 129 Ų | 129 | 97.8 Ų | 97.8 | 84% | 0.838 | 52% | 0.516 | S | S | * | . | S | Bend | trans | -75.8 | 6.1 | -170.5 | 32 | -37.9 | 0 | 0 | 0 | 114.8 | P522 | P522-P524 WeakPolarHBondContact O-CD 3.23Š|
| 525 | Q | 53.9 | Low | 56.3 | Low | 176 Ų | 176 | 96.1 Ų | 96.1 | 82% | 0.822 | 51% | 0.511 | S | S | * | . | trans | -112.2 | 43.3 | 179.4 | -157.8 | 175.6 | -13.7 | 0 | 0 | 113 | D523 D527 | D523-Q525 PolarHBondContact O-N 3.5Å; D523-Q525 VanDerWaalsContact O-N 3.09Å; Q525-D527 PolarHBondContact O-N 2.82Å | ||
| 526 | M | 50.8 | Low | 55.7 | Low | 50 Ų | 50 | 98.5 Ų | 98.5 | 25% | 0.246 | 52% | 0.523 | C | S | . | . | trans | -75.9 | 104.9 | 175.6 | -145.4 | 62.6 | 57.8 | 0 | 0 | 111.1 | E518 D523 F528 L531 | E518-M526 HydrophobicContact CB-SD 4.32Å; E518-M526 WeakPolarHBondContact O-CE 3.25Å; D523-M526 HydrophobicContact CB-CE 4.2Å; M526-F528 HydrophobicContact CB-CZ 4.4Å; M526-F528 WeakPolarHBondContact O-CD2 3.46Å; M526-F528 PolarHBondContact O-N 3.46Å; M526-L531 HydrophobicContact CG-CD1 4.19Å; M526-L531 HydrophobicContact SD-CD1 4.38Å | ||
| 527 | D | 57.2 | Low | 55 | Low | 96 Ų | 96 | 102.7 Ų | 102.7 | 51% | 0.513 | 54% | 0.541 | S | S | . | . | trans | -83.8 | 94 | 173.5 | -174.5 | -16 | 0 | 0 | 0 | 110 | Q525 L529 A530 L531 | Q525-D527 PolarHBondContact O-N 2.82Å; D527-L529 PolarHBondContact O-N 3Å; D527-L529 VanDerWaalsContact O-N 3.16Å; D527-L529 WeakPolarHBondContact OD1-CB 3.18Å; D527-L529 PolarHBondContact OD1-N 3.27Å; D527-A530 HydrophobicContact CB-CB 3.87Å; D527-A530 PolarHBondContact O-N 3.11Å; D527-A530 VanDerWaalsContact O-N 3.17Å; D527-A530 PolarHBondContact OD1-N 3Å; D527-A530 VanDerWaalsContact OD1-N 3.11Å; D527-L531 PolarHBondContact O-N 2.9Å | ||
| 528 | F | 46.9 | Very low | 54 | Low | 124 Ų | 124 | 103.3 Ų | 103.3 | 54% | 0.544 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -56.8 | -27 | 178.7 | -61.8 | -78.6 | 0 | 0 | 0 | 114 | L519 M526 S532 | L519-F528 HydrophobicContact CD2-CE1 3.88Å; M526-F528 HydrophobicContact CB-CZ 4.4Å; M526-F528 WeakPolarHBondContact O-CD2 3.46Å; M526-F528 PolarHBondContact O-N 3.46Å; F528-S532 PolarHBondContact O-N 2.75Å; F528-S532 PolarHBondContact O-OG 3.31Å |
| 529 | L | 52.8 | Low | 53.2 | Low | 132 Ų | 132 | 103.9 Ų | 103.9 | 69% | 0.691 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -77.6 | -43 | 178.2 | -64.2 | 172.4 | 0 | 0 | 0 | 110.7 | D527 L531 S532 Q533 | D527-L529 PolarHBondContact O-N 3Å; D527-L529 VanDerWaalsContact O-N 3.16Å; D527-L529 WeakPolarHBondContact OD1-CB 3.18Å; D527-L529 PolarHBondContact OD1-N 3.27Å; L529-L531 VanDerWaalsContact C-N 3.29Å; L529-L531 PolarHBondContact O-N 3.39Å; L529-S532 WeakPolarHBondContact CA-OG 3.1Å; L529-S532 PolarHBondContact O-N 2.89Å; L529-S532 PolarHBondContact O-OG 3.33Å; L529-Q533 VanDerWaalsContact O-CB 3.28Å; L529-Q533 WeakPolarHBondContact O-CB 3.48Å; L529-Q533 PolarHBondContact O-N 3.34Å |
| 530 | A | 56.5 | Low | 52.1 | Low | 47 Ų | 47 | 102.5 Ų | 102.5 | 39% | 0.388 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -59.2 | -43.3 | 171.5 | 0 | 0 | 0 | 0 | 0 | 111 | D527 Q533 E534 | D527-A530 HydrophobicContact CB-CB 3.87Å; D527-A530 PolarHBondContact O-N 3.11Å; D527-A530 VanDerWaalsContact O-N 3.17Å; D527-A530 PolarHBondContact OD1-N 3Å; D527-A530 VanDerWaalsContact OD1-N 3.11Å; A530-Q533 PolarHBondContact O-N 3.02Å; A530-Q533 VanDerWaalsContact O-N 3.16Å; A530-E534 PolarHBondContact O-N 3.04Å |
| 531 | L | 51.3 | Low | 50.7 | Low | 23 Ų | 23 | 104 Ų | 104 | 12% | 0.12 | 56% | 0.56 | C | S | . | * | H | α-helix | trans | -61.5 | -45.2 | 177.2 | -128.6 | 173.3 | 0 | 0 | 0 | 112.1 | F515 E518 M526 D527 L529 Q533 L535 | F515-L531 HydrophobicContact CD2-CD2 4.33Å; E518-L531 HydrophobicContact CB-CD1 4.25Å; E518-L531 WeakPolarHBondContact OE2-CD1 3.45Å; E518-L531 WeakPolarHBondContact OE2-CD2 3.38Å; M526-L531 HydrophobicContact CG-CD1 4.19Å; M526-L531 HydrophobicContact SD-CD1 4.38Å; D527-L531 PolarHBondContact O-N 2.9Å; L529-L531 VanDerWaalsContact C-N 3.29Å; L529-L531 PolarHBondContact O-N 3.39Å; L531-Q533 VanDerWaalsContact C-N 3.31Å; L531-Q533 PolarHBondContact O-N 2.88Å; L531-L535 WeakPolarHBondContact O-CB 3.47Å; L531-L535 PolarHBondContact O-N 2.83Å |
| 532 | S | 48.9 | Very low | 49.1 | Very low | 67 Ų | 67 | 108.2 Ų | 108.2 | 47% | 0.469 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -65.1 | -34.8 | 173.8 | 60.7 | 0 | 0 | 0 | 0 | 112.9 | F528 L529 E536 | F528-S532 PolarHBondContact O-N 2.75Å; F528-S532 PolarHBondContact O-OG 3.31Å; L529-S532 WeakPolarHBondContact CA-OG 3.1Å; L529-S532 PolarHBondContact O-N 2.89Å; L529-S532 PolarHBondContact O-OG 3.33Å; S532-E536 WeakPolarHBondContact O-CB 3.42Å; S532-E536 PolarHBondContact O-N 3.01Å |
| 533 | Q | 53.4 | Low | 48.4 | Very low | 102 Ų | 102 | 110.3 Ų | 110.3 | 48% | 0.477 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -75.5 | -33.5 | -179.2 | 177.3 | 159.5 | 91.8 | 0 | 0 | 112.6 | L529 A530 L531 Q537 | L529-Q533 VanDerWaalsContact O-CB 3.28Å; L529-Q533 WeakPolarHBondContact O-CB 3.48Å; L529-Q533 PolarHBondContact O-N 3.34Å; A530-Q533 PolarHBondContact O-N 3.02Å; A530-Q533 VanDerWaalsContact O-N 3.16Å; L531-Q533 VanDerWaalsContact C-N 3.31Å; L531-Q533 PolarHBondContact O-N 2.88Å; Q533-Q537 WeakPolarHBondContact O-CB 3.3Å; Q533-Q537 PolarHBondContact O-N 3.31Å |
| 534 | E | 53.2 | Low | 47.1 | Very low | 151 Ų | 151 | 109.7 Ų | 109.7 | 71% | 0.706 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -66.6 | -41.9 | 172.2 | -173.9 | 159.3 | -170.2 | 0 | 0 | 110.6 | A530 Q537 E538 | A530-E534 PolarHBondContact O-N 3.04Å; E534-Q537 PolarHBondContact O-N 3.27Å; E534-E538 PolarHBondContact O-N 2.98Å |
| 535 | L | 51.5 | Low | 46.3 | Very low | 73 Ų | 73 | 113.1 Ų | 113.1 | 38% | 0.382 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -69.4 | -33.9 | 177.5 | -147.2 | 147.1 | 0 | 0 | 0 | 112.5 | L531 | L531-L535 WeakPolarHBondContact O-CB 3.47Å; L531-L535 PolarHBondContact O-N 2.83Å |
| 536 | E | 52.2 | Low | 45 | Very low | 125 Ų | 125 | 108.5 Ų | 108.5 | 58% | 0.584 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -69.2 | -38.4 | 168.5 | -172.5 | -172.6 | -158.2 | 0 | 0 | 111.9 | S532 E538 E539 | S532-E536 WeakPolarHBondContact O-CB 3.42Å; S532-E536 PolarHBondContact O-N 3.01Å; E536-E538 VanDerWaalsContact C-N 3.32Å; E536-E538 PolarHBondContact O-N 3.49Å; E536-E539 WeakPolarHBondContact O-CA 3.19Å; E536-E539 WeakPolarHBondContact O-CB 3.36Å; E536-E539 PolarHBondContact O-N 2.88Å |
| 537 | Q | 48.3 | Very low | 43.9 | Very low | 150 Ų | 150 | 110.6 Ų | 110.6 | 70% | 0.701 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -70.4 | -28.8 | 179.6 | -167.1 | 162.6 | 121 | 0 | 0 | 112.2 | Q533 E534 E539 G540 | Q533-Q537 WeakPolarHBondContact O-CB 3.3Å; Q533-Q537 PolarHBondContact O-N 3.31Å; E534-Q537 PolarHBondContact O-N 3.27Å; Q537-E539 VanDerWaalsContact C-N 3.29Å; Q537-G540 WeakPolarHBondContact O-CA 3.4Å; Q537-G540 PolarHBondContact O-N 3.42Å |
| 538 | E | 44.9 | Very low | 43 | Very low | 158 Ų | 158 | 112.1 Ų | 112.1 | 74% | 0.738 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -68 | -25.1 | 168.5 | -162.2 | 177.2 | -154.9 | 0 | 0 | 112.5 | E534 E536 G540 | E534-E538 PolarHBondContact O-N 2.98Å; E536-E538 VanDerWaalsContact C-N 3.32Å; E536-E538 PolarHBondContact O-N 3.49Å; E538-G540 PolarHBondContact O-N 3.24Å |
| 539 | E | 47.1 | Very low | 42.3 | Very low | 82 Ų | 82 | 111.7 Ų | 111.7 | 38% | 0.383 | 65% | 0.653 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -73.8 | -3.6 | 167.3 | -58 | -166.5 | 139 | 0 | 0 | 113.6 | R297 E536 Q537 L541 | R297-E539 VanDerWaalsContact CD-CD 3.45Å; R297-E539 WeakPolarHBondContact CD-OE1 3.49Å; R297-E539 IonicContact CZ-OE1 3.65Å; R297-E539 IonicContact CZ-OE2 3.47Å; R297-E539 IonicContact NE-OE1 2.69Å; R297-E539 PolarHBondContact NE-OE1 3.23Å; R297-E539 IonicContact NE-OE2 2.8Å; R297-E539 IonicContact NH1-OE1 3.86Å; R297-E539 PolarHBondContact NH1-OE1 3.12Å; R297-E539 IonicContact NH1-OE2 3.94Å; R297-E539 PolarHBondContact NH1-OE2 2.83Å; R297-E539 IonicContact NH2-OE1 2.69Å; R297-E539 PolarHBondContact NH2-OE1 3.26Å; R297-E539 IonicContact NH2-OE2 3.05Å; R297-E539 PolarHBondContact NH2-OE2 3.13Å; E536-E539 WeakPolarHBondContact O-CA 3.19Å; E536-E539 WeakPolarHBondContact O-CB 3.36Å; E536-E539 PolarHBondContact O-N 2.88Å; Q537-E539 VanDerWaalsContact C-N 3.29Å; E539-L541 PolarHBondContact O-N 3.2Å |
| 540 | G | 38.6 | Very low | 41.4 | Very low | 53 Ų | 53 | 112.8 Ų | 112.8 | 55% | 0.546 | 66% | 0.659 | S | S | . | * | trans | -72.5 | 84.9 | -171.6 | 0 | 0 | 0 | 0 | 0 | 116 | Q537 E538 T542 | Q537-G540 WeakPolarHBondContact O-CA 3.4Å; Q537-G540 PolarHBondContact O-N 3.42Å; E538-G540 PolarHBondContact O-N 3.24Å; G540-T542 PolarHBondContact O-N 3.18Å | ||
| 541 | L | 34.1 | Very low | 40.3 | Very low | 162 Ų | 162 | 115.1 Ų | 115.1 | 85% | 0.848 | 68% | 0.678 | S | S | * | * | trans | -59.9 | 118.8 | 178 | -68.5 | 173.6 | 0 | 0 | 0 | 113.8 | E539 L543 | E539-L541 PolarHBondContact O-N 3.2Å; L541-L543 PolarHBondContact O-N 3.28Å | ||
| 542 | T | 28.4 | Very low | 39.9 | Very low | 141 Ų | 141 | 120 Ų | 120 | 87% | 0.865 | 71% | 0.711 | S | S | * | * | trans | -76.2 | 108.4 | 174.3 | 12.3 | 0 | 0 | 0 | 0 | 111.7 | G540 A544 | G540-T542 PolarHBondContact O-N 3.18Å; T542-A544 PolarHBondContact O-N 3.38Å | ||
| 543 | L | 37.2 | Very low | 39.3 | Very low | 176 Ų | 176 | 120.2 Ų | 120.2 | 92% | 0.921 | 73% | 0.725 | S | S | * | * | trans | -79.6 | 107 | -178.5 | -170.2 | 156.7 | 0 | 0 | 0 | 111.6 | L541 | L541-L543 PolarHBondContact O-N 3.28Š| ||
| 544 | A | 30 | Very low | 38.6 | Very low | 87 Ų | 87 | 122.3 Ų | 122.3 | 72% | 0.719 | 74% | 0.744 | S | S | * | * | trans | -139.4 | 100.2 | 179.2 | 0 | 0 | 0 | 0 | 0 | 114.1 | T542 | T542-A544 PolarHBondContact O-N 3.38Š| ||
| 545 | Q | 34.7 | Very low | 37.8 | Very low | 200 Ų | 200 | 122.4 Ų | 122.4 | 94% | 0.935 | 75% | 0.75 | S | S | * | * | trans | 62.3 | 123 | 156 | -59.6 | -174.8 | 5 | 0 | 0 | 120.1 | ||||
| 546 | G | 26.5 | Very low | 37.1 | Very low | 79 Ų | 79 | 130.1 Ų | 130.1 | 81% | 0.814 | 77% | 0.774 | S | S | * | * | trans | -172.7 | 43.6 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 547 | A | 29 | Very low | 36.3 | Very low | 94 Ų | 94 | 134.2 Ų | 134.2 | 78% | 0.777 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -70.5 | 146.7 | 178 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||
| 548 | P | 37.8 | Very low | 35.7 | Very low | 128 Ų | 128 | 133.5 Ų | 133.5 | 83% | 0.831 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -72.1 | 133.5 | -174.3 | 29.2 | -34.9 | 0 | 0 | 0 | 111.8 | ||
| 549 | S | 32.5 | Very low | 35.2 | Very low | 116 Ų | 116 | 132.2 Ų | 132.2 | 81% | 0.811 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -90.1 | 117.4 | 162.8 | -172.8 | 0 | 0 | 0 | 0 | 109.1 | ||
| 550 | D | 33.5 | Very low | 34.6 | Very low | 155 Ų | 155 | 134.9 Ų | 134.9 | 83% | 0.829 | 85% | 0.848 | S | S | * | * | P | Polyproline II helix | trans | -57.9 | 151 | 158.4 | -76.9 | -56 | 0 | 0 | 0 | 110.1 | ||
| 551 | A | 32.8 | Very low | 34.3 | Very low | 95 Ų | 95 | 139.8 Ų | 139.8 | 79% | 0.785 | 87% | 0.866 | S | S | * | * | trans | -121.7 | 113 | 172.8 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 552 | P | 42.8 | Very low | 34.3 | Very low | 125 Ų | 125 | 138.4 Ų | 138.4 | 81% | 0.812 | 87% | 0.867 | S | S | * | * | trans | -73.6 | 138.7 | 174.6 | 31 | -33.6 | 0 | 0 | 0 | 110.3 | ||||
| 553 | G | 36.7 | Very low | 34.7 | Very low | 73 Ų | 73 | 138.2 Ų | 138.2 | 75% | 0.753 | 87% | 0.868 | S | S | * | * | trans | -83.6 | 156.4 | 172.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 554 | T | 38.2 | Very low | 34.6 | Very low | 145 Ų | 145 | 135.5 Ų | 135.5 | 89% | 0.89 | 86% | 0.864 | S | S | * | * | trans | -150 | 143.6 | 165.6 | 14.8 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 555 | D | 38.1 | Very low | 34.9 | Very low | 154 Ų | 154 | 139.2 Ų | 139.2 | 82% | 0.824 | 88% | 0.875 | S | S | * | * | trans | -64.8 | 145.8 | 173.4 | -64.2 | -71.1 | 0 | 0 | 0 | 112.8 | ||||
| 556 | R | 34.8 | Very low | 34.9 | Very low | 235 Ų | 235 | 134.2 Ų | 134.2 | 89% | 0.887 | 87% | 0.87 | S | S | * | * | 170.5 | 112.9 | 112.5 | -93.4 | 175.4 | 179.9 | -159.2 | 1.1 | 113 | |||||
| 557 | C | 36.6 | Very low | 35.7 | Very low | 211 Ų | 211 | 139.2 Ų | 139.2 | 100% | 1.426 | 88% | 0.875 | S | S | * | * | 178.5 | 0 | 114.4 | -87.2 | 0 | 0 | 0 | 0 | 110.1 |
Retrieved 557 of 557 residues in 152.9 ms
(Link to these results)