| 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 | 47.7 | Very low | 57.7 | Low | 195 Ų | 195 | 115.2 Ų | 115.2 | 96% | 0.961 | 58% | 0.58 | S | S | * | * | 0 | -39.2 | 0 | -143.1 | 160.6 | 81.9 | 0 | 0 | 112.9 | I3 | M1-I3 PolarHBondContact O-N 3.42Š| |||
| 2 | Y | 47.5 | Very low | 58.1 | Low | 189 Ų | 189 | 109.4 Ų | 109.4 | 74% | 0.741 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -62.9 | -36.6 | 177.1 | -97.4 | -92 | 0 | 0 | 0 | 115.5 | F4 Q5 V6 | Y2-F4 PolarHBondContact O-N 3.27Å; Y2-Q5 PolarHBondContact O-N 3.49Å; Y2-V6 WeakPolarHBondContact O-CG2 3.25Å; Y2-V6 PolarHBondContact O-N 3.18Å |
| 3 | I | 49.1 | Very low | 58 | Low | 116 Ų | 116 | 109.8 Ų | 109.8 | 60% | 0.595 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -65.1 | -38 | -177.7 | -62.1 | 170.5 | 0 | 0 | 0 | 111.8 | M1 V6 T7 | M1-I3 PolarHBondContact O-N 3.42Å; I3-V6 PolarHBondContact O-N 3.3Å; I3-T7 WeakPolarHBondContact O-CG2 3.43Å; I3-T7 PolarHBondContact O-N 3.05Å; I3-T7 PolarHBondContact O-OG1 3.36Å; I3-T7 VanDerWaalsContact O-OG1 3.08Å |
| 4 | F | 50.3 | Low | 57.8 | Low | 165 Ų | 165 | 110.4 Ų | 110.4 | 72% | 0.724 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -70.1 | -30.4 | 176.9 | -78.6 | -81.2 | 0 | 0 | 0 | 113 | Y2 T7 A8 | Y2-F4 PolarHBondContact O-N 3.27Å; F4-T7 WeakPolarHBondContact CA-OG1 3.43Å; F4-T7 PolarHBondContact O-OG1 3.34Å; F4-A8 VanDerWaalsContact O-CB 3.25Å; F4-A8 WeakPolarHBondContact O-CB 3.16Å; F4-A8 PolarHBondContact O-N 2.94Å; F4-A8 VanDerWaalsContact O-N 3.08Å |
| 5 | Q | 57.7 | Low | 57.4 | Low | 118 Ų | 118 | 114.9 Ų | 114.9 | 55% | 0.551 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -73 | -36.8 | 173.4 | -79.5 | -174.4 | -36.1 | 0 | 0 | 111.8 | Y2 L9 | Y2-Q5 PolarHBondContact O-N 3.49Å; Q5-L9 WeakPolarHBondContact O-CB 3.27Å; Q5-L9 PolarHBondContact O-N 2.85Å |
| 6 | V | 60.7 | Low | 56.8 | Low | 80 Ų | 80 | 118.9 Ų | 118.9 | 49% | 0.485 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -71 | -39.3 | 178 | 175.9 | 0 | 0 | 0 | 0 | 111.5 | Y2 I3 L9 L10 | Y2-V6 WeakPolarHBondContact O-CG2 3.25Å; Y2-V6 PolarHBondContact O-N 3.18Å; I3-V6 PolarHBondContact O-N 3.3Å; V6-L9 PolarHBondContact O-N 2.88Å; V6-L10 HydrophobicContact CG1-CD1 4.04Å; V6-L10 WeakPolarHBondContact O-CB 3.34Å; V6-L10 PolarHBondContact O-N 2.84Å |
| 7 | T | 59.1 | Low | 55.9 | Low | 51 Ų | 51 | 115.1 Ų | 115.1 | 31% | 0.313 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -68.7 | -38.4 | 174.2 | 51.3 | 0 | 0 | 0 | 0 | 112.1 | I3 F4 L10 I11 | I3-T7 WeakPolarHBondContact O-CG2 3.43Å; I3-T7 PolarHBondContact O-N 3.05Å; I3-T7 PolarHBondContact O-OG1 3.36Å; I3-T7 VanDerWaalsContact O-OG1 3.08Å; F4-T7 WeakPolarHBondContact CA-OG1 3.43Å; F4-T7 PolarHBondContact O-OG1 3.34Å; T7-L10 PolarHBondContact O-N 3.1Å; T7-I11 WeakPolarHBondContact O-CB 3.29Å; T7-I11 WeakPolarHBondContact O-CD1 3.42Å; T7-I11 WeakPolarHBondContact O-CG1 3.37Å; T7-I11 PolarHBondContact O-N 3.12Å |
| 8 | A | 67.5 | Low | 55.1 | Low | 58 Ų | 58 | 116 Ų | 116 | 48% | 0.479 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -63.7 | -39.1 | 172.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | F4 A12 | F4-A8 VanDerWaalsContact O-CB 3.25Å; F4-A8 WeakPolarHBondContact O-CB 3.16Å; F4-A8 PolarHBondContact O-N 2.94Å; F4-A8 VanDerWaalsContact O-N 3.08Å; A8-A12 VanDerWaalsContact O-CB 3.27Å; A8-A12 WeakPolarHBondContact O-CB 3.27Å; A8-A12 PolarHBondContact O-N 3.49Å |
| 9 | L | 64.4 | Low | 54.2 | Low | 117 Ų | 117 | 113.3 Ų | 113.3 | 61% | 0.613 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -66.5 | -40.4 | 175.6 | -129.1 | 95 | 0 | 0 | 0 | 112.1 | Q5 V6 A12 L13 | Q5-L9 WeakPolarHBondContact O-CB 3.27Å; Q5-L9 PolarHBondContact O-N 2.85Å; V6-L9 PolarHBondContact O-N 2.88Å; L9-A12 PolarHBondContact O-N 3.12Å; L9-L13 WeakPolarHBondContact O-CB 3.42Å; L9-L13 VanDerWaalsContact O-CG 3.24Å; L9-L13 WeakPolarHBondContact O-CG 3.36Å; L9-L13 PolarHBondContact O-N 2.85Å |
| 10 | L | 60.7 | Low | 53.5 | Low | 77 Ų | 77 | 116.5 Ų | 116.5 | 40% | 0.403 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -68.2 | -39.9 | 177.5 | -86.9 | 157.1 | 0 | 0 | 0 | 112.3 | V6 T7 A12 L13 L14 | V6-L10 HydrophobicContact CG1-CD1 4.04Å; V6-L10 WeakPolarHBondContact O-CB 3.34Å; V6-L10 PolarHBondContact O-N 2.84Å; T7-L10 PolarHBondContact O-N 3.1Å; L10-A12 VanDerWaalsContact C-N 3.33Å; L10-L13 PolarHBondContact O-N 2.93Å; L10-L14 WeakPolarHBondContact O-CG 3.38Å; L10-L14 PolarHBondContact O-N 3.41Å |
| 11 | I | 69.8 | Low | 52.6 | Low | 101 Ų | 101 | 116.9 Ų | 116.9 | 52% | 0.518 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -66 | -39.7 | 173.6 | -66 | 164.9 | 0 | 0 | 0 | 110.1 | T7 L14 Y15 | T7-I11 WeakPolarHBondContact O-CB 3.29Å; T7-I11 WeakPolarHBondContact O-CD1 3.42Å; T7-I11 WeakPolarHBondContact O-CG1 3.37Å; T7-I11 PolarHBondContact O-N 3.12Å; I11-L14 PolarHBondContact O-N 3.43Å; I11-Y15 HydrophobicContact CG2-CD2 4.23Å; I11-Y15 WeakPolarHBondContact O-CB 3.41Å; I11-Y15 PolarHBondContact O-N 2.78Å |
| 12 | A | 62.6 | Low | 51.8 | Low | 46 Ų | 46 | 112.2 Ų | 112.2 | 38% | 0.38 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -64.2 | -38.5 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | A8 L9 L10 Y15 Y16 | A8-A12 VanDerWaalsContact O-CB 3.27Å; A8-A12 WeakPolarHBondContact O-CB 3.27Å; A8-A12 PolarHBondContact O-N 3.49Å; L9-A12 PolarHBondContact O-N 3.12Å; L10-A12 VanDerWaalsContact C-N 3.33Å; A12-Y15 PolarHBondContact O-N 3.11Å; A12-Y16 WeakPolarHBondContact O-CB 3.49Å; A12-Y16 WeakPolarHBondContact O-CD2 3.35Å; A12-Y16 PolarHBondContact O-N 3.45Å |
| 13 | L | 56.8 | Low | 51 | Low | 114 Ų | 114 | 109.8 Ų | 109.8 | 60% | 0.597 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -69.4 | -36.1 | 175.7 | -74.3 | 166.7 | 0 | 0 | 0 | 112.5 | L9 L10 Y16 G17 | L9-L13 WeakPolarHBondContact O-CB 3.42Å; L9-L13 VanDerWaalsContact O-CG 3.24Å; L9-L13 WeakPolarHBondContact O-CG 3.36Å; L9-L13 PolarHBondContact O-N 2.85Å; L10-L13 PolarHBondContact O-N 2.93Å; L13-Y16 PolarHBondContact O-N 3.49Å; L13-G17 PolarHBondContact O-N 3.48Å |
| 14 | L | 54.8 | Low | 49.8 | Very low | 118 Ų | 118 | 110.3 Ų | 110.3 | 62% | 0.618 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -69.3 | -33.8 | 172.5 | -71.2 | 170.2 | 0 | 0 | 0 | 112 | L10 I11 N18 | L10-L14 WeakPolarHBondContact O-CG 3.38Å; L10-L14 PolarHBondContact O-N 3.41Å; I11-L14 PolarHBondContact O-N 3.43Å; L14-N18 PolarHBondContact O-N 3.01Å; L14-N18 PolarHBondContact O-ND2 3.35Å |
| 15 | Y | 52.1 | Low | 48.7 | Very low | 178 Ų | 178 | 106.8 Ų | 106.8 | 70% | 0.698 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -71.7 | -40.9 | 171.9 | -103.6 | -90.9 | 0 | 0 | 0 | 112.3 | I11 A12 N18 A19 | I11-Y15 HydrophobicContact CG2-CD2 4.23Å; I11-Y15 WeakPolarHBondContact O-CB 3.41Å; I11-Y15 PolarHBondContact O-N 2.78Å; A12-Y15 PolarHBondContact O-N 3.11Å; Y15-N18 PolarHBondContact O-N 3.39Å; Y15-A19 PolarHBondContact O-N 3.42Å; Y15-A19 VanDerWaalsContact O-N 3.13Å |
| 16 | Y | 48.2 | Very low | 47.2 | Very low | 179 Ų | 179 | 106.9 Ų | 106.9 | 70% | 0.702 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -68.3 | -34.1 | 176.5 | -101.2 | -89.5 | 0 | 0 | 0 | 112.7 | A12 L13 N18 A19 | A12-Y16 WeakPolarHBondContact O-CB 3.49Å; A12-Y16 WeakPolarHBondContact O-CD2 3.35Å; A12-Y16 PolarHBondContact O-N 3.45Å; L13-Y16 PolarHBondContact O-N 3.49Å; Y16-N18 VanDerWaalsContact C-N 3.3Å; Y16-N18 PolarHBondContact O-N 2.97Å; Y16-A19 PolarHBondContact O-N 2.97Å |
| 17 | G | 40.7 | Very low | 45.6 | Very low | 55 Ų | 55 | 110 Ų | 110 | 57% | 0.567 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -65.9 | -29.8 | 173.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | L13 | L13-G17 PolarHBondContact O-N 3.48Å |
| 18 | N | 42.1 | Very low | 44.2 | Very low | 131 Ų | 131 | 112.7 Ų | 112.7 | 70% | 0.701 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -86.3 | -11.7 | 173.8 | -72.8 | -57.2 | 0 | 0 | 0 | 113.5 | L14 Y15 Y16 | L14-N18 PolarHBondContact O-N 3.01Å; L14-N18 PolarHBondContact O-ND2 3.35Å; Y15-N18 PolarHBondContact O-N 3.39Å; Y16-N18 VanDerWaalsContact C-N 3.3Å; Y16-N18 PolarHBondContact O-N 2.97Å |
| 19 | A | 38.8 | Very low | 42.2 | Very low | 65 Ų | 65 | 115.9 Ų | 115.9 | 54% | 0.537 | 66% | 0.664 | S | S | . | * | H | α-helix | trans | -91.9 | -6.1 | 178.6 | 0 | 0 | 0 | 0 | 0 | 114 | Y15 Y16 | Y15-A19 PolarHBondContact O-N 3.42Å; Y15-A19 VanDerWaalsContact O-N 3.13Å; Y16-A19 PolarHBondContact O-N 2.97Å |
| 20 | Q | 39.3 | Very low | 40.5 | Very low | 177 Ų | 177 | 117.7 Ų | 117.7 | 83% | 0.827 | 67% | 0.673 | S | S | * | * | trans | -92.7 | 14.9 | 176 | -89.7 | -169.5 | -12.1 | 0 | 0 | 115.2 | ||||
| 21 | T | 35.3 | Very low | 39.1 | Very low | 125 Ų | 125 | 122.5 Ų | 122.5 | 77% | 0.767 | 70% | 0.698 | S | S | * | * | trans | -100.8 | 65.7 | 157.7 | 56.1 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 22 | S | 30 | Very low | 37.1 | Very low | 97 Ų | 97 | 120.7 Ų | 120.7 | 68% | 0.678 | 70% | 0.704 | S | S | * | * | trans | -132.9 | 103.8 | 161 | -77 | 0 | 0 | 0 | 0 | 106.7 | V24 | S22-V24 PolarHBondContact O-N 2.96Å; S22-V24 VanDerWaalsContact O-N 3.08Å | ||
| 23 | T | 30.5 | Very low | 35.6 | Very low | 138 Ų | 138 | 123.9 Ų | 123.9 | 85% | 0.847 | 72% | 0.724 | S | S | * | * | trans | -46.7 | 112.6 | 167 | 44.8 | 0 | 0 | 0 | 0 | 109 | A25 | T23-A25 VanDerWaalsContact C-N 3.31Å; T23-A25 PolarHBondContact O-N 3.43Å | ||
| 24 | V | 25.3 | Very low | 34.3 | Very low | 127 Ų | 127 | 127.6 Ų | 127.6 | 77% | 0.77 | 74% | 0.738 | S | S | * | * | trans | -63.1 | 102 | 159.4 | 174.3 | 0 | 0 | 0 | 0 | 105.8 | S22 V26 | S22-V24 PolarHBondContact O-N 2.96Å; S22-V24 VanDerWaalsContact O-N 3.08Å; V24-V26 VanDerWaalsContact C-N 3.31Å; V24-V26 HydrophobicContact CG1-CG2 4.04Å; V24-V26 PolarHBondContact O-N 2.92Å | ||
| 25 | A | 26.6 | Very low | 33.4 | Very low | 91 Ų | 91 | 128.6 Ų | 128.6 | 75% | 0.752 | 74% | 0.743 | S | S | * | * | trans | -65.5 | 97.1 | 162.5 | 0 | 0 | 0 | 0 | 0 | 106.8 | T23 N27 | T23-A25 VanDerWaalsContact C-N 3.31Å; T23-A25 PolarHBondContact O-N 3.43Å; A25-N27 PolarHBondContact O-N 3.38Å | ||
| 26 | V | 26.5 | Very low | 32.6 | Very low | 119 Ų | 119 | 123.4 Ų | 123.4 | 72% | 0.721 | 73% | 0.733 | S | S | * | * | trans | -72.5 | 113.3 | 160.6 | -179.9 | 0 | 0 | 0 | 0 | 105.4 | V24 P28 | V24-V26 VanDerWaalsContact C-N 3.31Å; V24-V26 HydrophobicContact CG1-CG2 4.04Å; V24-V26 PolarHBondContact O-N 2.92Å; V26-P28 VanDerWaalsContact O-CD 3.23Å; V26-P28 WeakPolarHBondContact O-CD 3.45Å | ||
| 27 | N | 27.2 | Very low | 32.1 | Very low | 147 Ų | 147 | 118.7 Ų | 118.7 | 79% | 0.786 | 73% | 0.731 | S | S | * | * | trans | -79.5 | 114.2 | 165.3 | -124.8 | 12.2 | 0 | 0 | 0 | 107.2 | A25 | A25-N27 PolarHBondContact O-N 3.38Š| ||
| 28 | P | 28.1 | Very low | 32.1 | Very low | 107 Ų | 107 | 121.1 Ų | 121.1 | 70% | 0.695 | 73% | 0.731 | S | S | * | * | trans | -98.5 | 103.5 | 154.5 | 30.9 | -17 | 0 | 0 | 0 | 107.2 | V26 I30 | V26-P28 VanDerWaalsContact O-CD 3.23Å; V26-P28 WeakPolarHBondContact O-CD 3.45Å; P28-I30 PolarHBondContact O-N 2.95Å | ||
| 29 | T | 26.1 | Very low | 32 | Very low | 125 Ų | 125 | 116 Ų | 116 | 77% | 0.767 | 71% | 0.709 | S | S | * | * | trans | -52.3 | 105.2 | 153.2 | 34.8 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 30 | I | 28.9 | Very low | 32.2 | Very low | 155 Ų | 155 | 118.6 Ų | 118.6 | 80% | 0.795 | 71% | 0.713 | S | S | * | * | trans | 28.4 | 104.3 | 135.3 | -52.8 | 178.8 | 0 | 0 | 0 | 115.4 | P28 | P28-I30 PolarHBondContact O-N 2.95Š| ||
| 31 | L | 31 | Very low | 32.3 | Very low | 178 Ų | 178 | 117.1 Ų | 117.1 | 93% | 0.932 | 70% | 0.704 | S | S | * | * | trans | -146.9 | 67.3 | 130.1 | -164.5 | 72.9 | 0 | 0 | 0 | 108.5 | ||||
| 32 | G | 28.7 | Very low | 32.5 | Very low | 63 Ų | 63 | 118.1 Ų | 118.1 | 65% | 0.649 | 70% | 0.7 | S | S | * | * | trans | -103.6 | 102.9 | 163.4 | 0 | 0 | 0 | 0 | 0 | 107.4 | E34 | G32-E34 PolarHBondContact O-N 2.84Š| ||
| 33 | S | 30.2 | Very low | 32.9 | Very low | 113 Ų | 113 | 118.7 Ų | 118.7 | 79% | 0.79 | 70% | 0.695 | S | S | * | * | trans | -62.6 | 112.9 | 163.7 | 44.2 | 0 | 0 | 0 | 0 | 108.1 | L35 | S33-L35 PolarHBondContact O-N 3.08Å; S33-L35 VanDerWaalsContact O-N 3.15Å | ||
| 34 | E | 29.3 | Very low | 33.2 | Very low | 191 Ų | 191 | 115.4 Ų | 115.4 | 89% | 0.893 | 68% | 0.682 | S | S | * | * | trans | -57.8 | 112 | 171.3 | -68 | -175.9 | 149.4 | 0 | 0 | 109.5 | G32 S36 | G32-E34 PolarHBondContact O-N 2.84Å; E34-S36 PolarHBondContact O-N 3.23Å | ||
| 35 | L | 36.1 | Very low | 33.7 | Very low | 140 Ų | 140 | 113 Ų | 113 | 73% | 0.733 | 68% | 0.675 | S | S | * | * | trans | -85 | 93.2 | 168.7 | -155.8 | 74.5 | 0 | 0 | 0 | 107.6 | S33 | S33-L35 PolarHBondContact O-N 3.08Å; S33-L35 VanDerWaalsContact O-N 3.15Å | ||
| 36 | S | 34.8 | Very low | 34.1 | Very low | 69 Ų | 69 | 114.8 Ų | 114.8 | 48% | 0.483 | 67% | 0.671 | S | S | . | * | trans | -58.2 | 148.2 | 177.3 | 176.8 | 0 | 0 | 0 | 0 | 111.9 | E34 D38 G39 | E34-S36 PolarHBondContact O-N 3.23Å; S36-D38 PolarHBondContact O-N 3.41Å; S36-D38 PolarHBondContact OG-N 3.47Å; S36-G39 PolarHBondContact O-N 3.01Å | ||
| 37 | A | 39.4 | Very low | 34.5 | Very low | 79 Ų | 79 | 115.2 Ų | 115.2 | 65% | 0.653 | 67% | 0.674 | S | S | * | * | H | α-helix | trans | -57.8 | -16.1 | 174.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||
| 38 | D | 40.3 | Very low | 34.8 | Very low | 106 Ų | 106 | 111.5 Ų | 111.5 | 57% | 0.567 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -77.2 | -26.8 | 171 | -71.2 | -35.1 | 0 | 0 | 0 | 113.1 | S36 L40 K41 Q42 | S36-D38 PolarHBondContact O-N 3.41Å; S36-D38 PolarHBondContact OG-N 3.47Å; D38-L40 VanDerWaalsContact C-N 3.33Å; D38-L40 PolarHBondContact O-N 3.28Å; D38-K41 PolarHBondContact O-N 3.06Å; D38-Q42 PolarHBondContact O-N 2.97Å |
| 39 | G | 40.5 | Very low | 35 | Very low | 24 Ų | 24 | 112.6 Ų | 112.6 | 25% | 0.247 | 67% | 0.67 | C | S | . | * | H | α-helix | trans | -68.3 | -30 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | S36 Q42 L43 | S36-G39 PolarHBondContact O-N 3.01Å; G39-Q42 PolarHBondContact O-N 3.08Å; G39-L43 PolarHBondContact O-N 3.46Å |
| 40 | L | 42.3 | Very low | 35.3 | Very low | 119 Ų | 119 | 115.6 Ų | 115.6 | 62% | 0.623 | 68% | 0.675 | S | S | * | * | H | α-helix | trans | -72.7 | -32.6 | 176.2 | -131.5 | 86.9 | 0 | 0 | 0 | 112.2 | D38 Q42 A44 | D38-L40 VanDerWaalsContact C-N 3.33Å; D38-L40 PolarHBondContact O-N 3.28Å; L40-Q42 VanDerWaalsContact C-N 3.35Å; L40-A44 WeakPolarHBondContact O-CB 3.45Å; L40-A44 PolarHBondContact O-N 3.43Å |
| 41 | K | 40.8 | Very low | 35.4 | Very low | 146 Ų | 146 | 113.2 Ų | 113.2 | 64% | 0.635 | 67% | 0.673 | S | S | * | * | H | α-helix | trans | -71.5 | -32 | 174.4 | -69.9 | 179.3 | -178.8 | 170.7 | 0 | 111.9 | D38 A44 A45 | D38-K41 PolarHBondContact O-N 3.06Å; K41-A44 PolarHBondContact O-N 2.94Å; K41-A45 WeakPolarHBondContact O-CB 3.25Å; K41-A45 PolarHBondContact O-N 3.4Å |
| 42 | Q | 40.7 | Very low | 35.6 | Very low | 146 Ų | 146 | 110 Ų | 110 | 68% | 0.682 | 66% | 0.662 | S | S | * | * | H | α-helix | trans | -75.4 | -29.5 | 177.8 | -153.4 | 143.5 | 22.6 | 0 | 0 | 112.5 | D38 G39 L40 I46 | D38-Q42 PolarHBondContact O-N 2.97Å; G39-Q42 PolarHBondContact O-N 3.08Å; L40-Q42 VanDerWaalsContact C-N 3.35Å; Q42-I46 WeakPolarHBondContact O-CD1 3.21Å; Q42-I46 WeakPolarHBondContact O-CG1 3.47Å |
| 43 | L | 36.6 | Very low | 35.8 | Very low | 110 Ų | 110 | 112.8 Ų | 112.8 | 58% | 0.576 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -75.2 | -34.9 | 169.3 | -77.1 | 160.2 | 0 | 0 | 0 | 112.7 | G39 A45 I46 | G39-L43 PolarHBondContact O-N 3.46Å; L43-A45 VanDerWaalsContact C-N 3.34Å; L43-I46 PolarHBondContact O-N 3.16Å |
| 44 | A | 37.8 | Very low | 35.7 | Very low | 69 Ų | 69 | 116.5 Ų | 116.5 | 57% | 0.57 | 67% | 0.669 | S | S | * | * | H | α-helix | trans | -70.6 | -27.9 | 174.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | L40 K41 I46 V47 | L40-A44 WeakPolarHBondContact O-CB 3.45Å; L40-A44 PolarHBondContact O-N 3.43Å; K41-A44 PolarHBondContact O-N 2.94Å; A44-I46 VanDerWaalsContact C-N 3.3Å; A44-I46 PolarHBondContact O-N 2.94Å; A44-V47 PolarHBondContact O-N 3.38Å |
| 45 | A | 36.1 | Very low | 36 | Very low | 77 Ų | 77 | 115.2 Ų | 115.2 | 64% | 0.636 | 66% | 0.662 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75 | -15.3 | 175.1 | 0 | 0 | 0 | 0 | 0 | 114 | K41 L43 | K41-A45 WeakPolarHBondContact O-CB 3.25Å; K41-A45 PolarHBondContact O-N 3.4Å; L43-A45 VanDerWaalsContact C-N 3.34Å |
| 46 | I | 35.6 | Very low | 36 | Very low | 128 Ų | 128 | 114.5 Ų | 114.5 | 66% | 0.656 | 67% | 0.666 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.6 | -13 | 176.4 | -65.5 | 165.2 | 0 | 0 | 0 | 111.4 | Q42 L43 A44 | Q42-I46 WeakPolarHBondContact O-CD1 3.21Å; Q42-I46 WeakPolarHBondContact O-CG1 3.47Å; L43-I46 PolarHBondContact O-N 3.16Å; A44-I46 VanDerWaalsContact C-N 3.3Å; A44-I46 PolarHBondContact O-N 2.94Å |
| 47 | V | 34.6 | Very low | 36 | Very low | 128 Ų | 128 | 117 Ų | 117 | 78% | 0.776 | 68% | 0.684 | S | S | * | * | trans | -113.7 | 57.1 | -178.9 | -167.9 | 0 | 0 | 0 | 0 | 110.7 | A44 | A44-V47 PolarHBondContact O-N 3.38Š| ||
| 48 | A | 32.2 | Very low | 36.1 | Very low | 68 Ų | 68 | 125.1 Ų | 125.1 | 56% | 0.562 | 70% | 0.698 | S | S | * | * | S | Bend | trans | -117.6 | 136.8 | 159.9 | 0 | 0 | 0 | 0 | 0 | 108.6 | Q50 | A48-Q50 PolarHBondContact O-N 3.37Š|
| 49 | P | 33.7 | Very low | 36.2 | Very low | 131 Ų | 131 | 123.2 Ų | 123.2 | 85% | 0.851 | 70% | 0.703 | S | S | * | * | trans | -76.4 | 99.2 | -172.4 | 30.3 | -31.2 | 0 | 0 | 0 | 109.8 | ||||
| 50 | Q | 30.9 | Very low | 36.3 | Very low | 187 Ų | 187 | 127.3 Ų | 127.3 | 87% | 0.874 | 73% | 0.728 | S | S | * | * | trans | -89.2 | 104.4 | 157.7 | -69.3 | -168.9 | 5.9 | 0 | 0 | 107.9 | A48 P52 | A48-Q50 PolarHBondContact O-N 3.37Å; Q50-P52 WeakPolarHBondContact O-CD 3.48Å | ||
| 51 | S | 32.4 | Very low | 36.8 | Very low | 106 Ų | 106 | 132 Ų | 132 | 74% | 0.741 | 74% | 0.739 | S | S | * | * | trans | -54.5 | 122 | 168.8 | -51.2 | 0 | 0 | 0 | 0 | 110 | V53 | S51-V53 PolarHBondContact O-N 3.08Š| ||
| 52 | P | 35.5 | Very low | 37.2 | Very low | 110 Ų | 110 | 133.9 Ų | 133.9 | 71% | 0.714 | 75% | 0.747 | S | S | * | * | trans | -76.8 | 110.8 | 168.3 | 28.4 | -27.9 | 0 | 0 | 0 | 108.6 | Q50 F54 | Q50-P52 WeakPolarHBondContact O-CD 3.48Å; P52-F54 PolarHBondContact O-N 3.38Å; P52-F54 VanDerWaalsContact O-N 3.11Å | ||
| 53 | V | 33.2 | Very low | 37.5 | Very low | 122 Ų | 122 | 131.8 Ų | 131.8 | 74% | 0.739 | 75% | 0.749 | S | S | * | * | trans | -58.4 | 109.8 | 164.2 | 173.1 | 0 | 0 | 0 | 0 | 107.7 | S51 H55 | S51-V53 PolarHBondContact O-N 3.08Å; V53-H55 PolarHBondContact O-N 2.95Å | ||
| 54 | F | 28 | Very low | 38.2 | Very low | 190 Ų | 190 | 133.9 Ų | 133.9 | 83% | 0.833 | 76% | 0.76 | S | S | * | * | trans | -75.3 | 110.3 | 177.5 | -122.6 | -95.6 | 0 | 0 | 0 | 109.3 | P52 | P52-F54 PolarHBondContact O-N 3.38Å; P52-F54 VanDerWaalsContact O-N 3.11Å | ||
| 55 | H | 34 | Very low | 38.8 | Very low | 164 Ų | 164 | 137 Ų | 137 | 76% | 0.759 | 77% | 0.767 | S | S | * | * | trans | -84.4 | 128.4 | 163.6 | -84.4 | -77.4 | 0 | 0 | 0 | 109.3 | V53 S57 | V53-H55 PolarHBondContact O-N 2.95Å; H55-S57 PolarHBondContact O-N 3.17Å; H55-S57 VanDerWaalsContact O-N 3.16Å | ||
| 56 | P | 36.5 | Very low | 39.3 | Very low | 125 Ų | 125 | 140.5 Ų | 140.5 | 81% | 0.812 | 77% | 0.774 | S | S | * | * | trans | -80.5 | 102.4 | -179.6 | 31.2 | -29.8 | 0 | 0 | 0 | 109.4 | ||||
| 57 | S | 35 | Very low | 39.9 | Very low | 123 Ų | 123 | 141.8 Ų | 141.8 | 86% | 0.86 | 78% | 0.782 | S | S | * | * | trans | -90.8 | 132.2 | 161.5 | -169.9 | 0 | 0 | 0 | 0 | 109.8 | H55 | H55-S57 PolarHBondContact O-N 3.17Å; H55-S57 VanDerWaalsContact O-N 3.16Å | ||
| 58 | R | 42.3 | Very low | 41 | Very low | 249 Ų | 249 | 139.4 Ų | 139.4 | 94% | 0.94 | 77% | 0.77 | S | S | * | * | trans | -75.6 | 127.3 | -167.5 | -164.7 | -179.4 | -160.4 | 168.7 | 4.2 | 110.7 | ||||
| 59 | G | 41.4 | Very low | 42.3 | Very low | 65 Ų | 65 | 140.3 Ų | 140.3 | 67% | 0.67 | 78% | 0.778 | S | S | * | * | trans | 106.4 | 87.5 | 153.3 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 60 | S | 42.9 | Very low | 43.6 | Very low | 111 Ų | 111 | 140.6 Ų | 140.6 | 78% | 0.776 | 77% | 0.766 | S | S | * | * | trans | -167 | 99.1 | 130.1 | -168.9 | 0 | 0 | 0 | 0 | 107.9 | F62 | S60-F62 PolarHBondContact O-N 3.26Š| ||
| 61 | Y | 53.2 | Low | 45.3 | Very low | 216 Ų | 216 | 135.3 Ų | 135.3 | 85% | 0.847 | 75% | 0.748 | S | S | * | * | trans | -80.2 | 97.8 | 174.7 | -68.7 | -86.8 | 0 | 0 | 0 | 108.8 | ||||
| 62 | F | 49.7 | Very low | 46.5 | Very low | 186 Ų | 186 | 138 Ų | 138 | 82% | 0.816 | 75% | 0.749 | S | S | * | * | trans | -139.7 | 76 | 153.1 | -90.6 | -78.9 | 0 | 0 | 0 | 108.6 | S60 | S60-F62 PolarHBondContact O-N 3.26Š| ||
| 63 | S | 46.9 | Very low | 47.4 | Very low | 103 Ų | 103 | 140.7 Ų | 140.7 | 72% | 0.72 | 76% | 0.757 | S | S | * | * | trans | -89.9 | 90.3 | 160.6 | -61.3 | 0 | 0 | 0 | 0 | 107.7 | N65 | S63-N65 PolarHBondContact O-N 3.16Å; S63-N65 VanDerWaalsContact O-N 3.09Å | ||
| 64 | L | 50 | Low | 48.8 | Very low | 154 Ų | 154 | 140.9 Ų | 140.9 | 81% | 0.806 | 75% | 0.754 | S | S | * | * | trans | -79.7 | 72.7 | 160.3 | -86.5 | 160.8 | 0 | 0 | 0 | 107.9 | L66 | L64-L66 PolarHBondContact O-N 3.14Å; L64-L66 VanDerWaalsContact O-N 3.08Å | ||
| 65 | N | 49.9 | Very low | 50.9 | Low | 133 Ų | 133 | 137.3 Ų | 137.3 | 71% | 0.711 | 74% | 0.739 | S | S | * | * | trans | -76.6 | 84.3 | 161.7 | -77.1 | -17.9 | 0 | 0 | 0 | 107.2 | S63 L67 | S63-N65 PolarHBondContact O-N 3.16Å; S63-N65 VanDerWaalsContact O-N 3.09Å; N65-L67 PolarHBondContact O-N 3.36Å | ||
| 66 | L | 47.6 | Very low | 53.2 | Low | 152 Ų | 152 | 132.4 Ų | 132.4 | 80% | 0.796 | 72% | 0.721 | S | S | * | * | trans | -77.8 | 74.5 | 162.8 | -166.9 | 76.6 | 0 | 0 | 0 | 107.9 | L64 S68 | L64-L66 PolarHBondContact O-N 3.14Å; L64-L66 VanDerWaalsContact O-N 3.08Å; L66-S68 VanDerWaalsContact C-N 3.29Å; L66-S68 PolarHBondContact O-N 3.31Å | ||
| 67 | L | 47.5 | Very low | 55.6 | Low | 155 Ų | 155 | 128.5 Ų | 128.5 | 81% | 0.812 | 70% | 0.697 | S | S | * | * | trans | -83.2 | 83.9 | 158.8 | -78.3 | 164.4 | 0 | 0 | 0 | 106.2 | N65 A69 | N65-L67 PolarHBondContact O-N 3.36Å; L67-A69 VanDerWaalsContact C-N 3.28Å; L67-A69 PolarHBondContact O-N 2.98Å | ||
| 68 | S | 57.8 | Low | 58.2 | Low | 77 Ų | 77 | 129.5 Ų | 129.5 | 54% | 0.538 | 69% | 0.692 | S | S | . | * | trans | -68.5 | 97.3 | 157.9 | 54 | 0 | 0 | 0 | 0 | 106.5 | L66 F70 | L66-S68 VanDerWaalsContact C-N 3.29Å; L66-S68 PolarHBondContact O-N 3.31Å; S68-F70 PolarHBondContact O-N 2.92Å | ||
| 69 | A | 60.2 | Low | 60.5 | Low | 88 Ų | 88 | 120.7 Ų | 120.7 | 73% | 0.727 | 66% | 0.659 | S | S | * | * | P | Polyproline II helix | trans | -62.2 | 124.1 | 165.7 | 0 | 0 | 0 | 0 | 0 | 107.3 | L67 | L67-A69 VanDerWaalsContact C-N 3.28Å; L67-A69 PolarHBondContact O-N 2.98Å |
| 70 | F | 60.9 | Low | 63 | Low | 137 Ų | 137 | 117.6 Ų | 117.6 | 60% | 0.601 | 63% | 0.627 | S | S | * | * | P | Polyproline II helix | trans | -72.3 | 159.3 | 172.2 | -73 | -83 | 0 | 0 | 0 | 108.7 | S68 E72 L74 | S68-F70 PolarHBondContact O-N 2.92Å; F70-E72 PolarHBondContact O-N 2.85Å; F70-L74 HydrophobicContact CB-CB 4.44Å |
| 71 | P | 66.1 | Low | 65.3 | Low | 75 Ų | 75 | 115.8 Ų | 115.8 | 49% | 0.487 | 61% | 0.612 | S | S | . | * | P | Polyproline II helix | trans | -53.7 | 140 | 173.4 | -21 | 31.1 | 0 | 0 | 0 | 110.8 | D73 L74 | P71-D73 PolarHBondContact O-N 2.93Å; P71-D73 VanDerWaalsContact O-N 3.09Å; P71-L74 HydrophobicContact CG-CD1 4.13Å; P71-L74 WeakPolarHBondContact O-CA 3.47Å; P71-L74 VanDerWaalsContact O-CB 3.25Å; P71-L74 WeakPolarHBondContact O-CB 3.27Å; P71-L74 PolarHBondContact O-N 3.11Å |
| 72 | E | 57 | Low | 67.3 | Low | 164 Ų | 164 | 111.3 Ų | 111.3 | 77% | 0.766 | 60% | 0.599 | S | S | * | * | G | 310 helix | trans | -56 | -27.7 | -179.4 | -82.3 | 153.6 | 147.3 | 0 | 0 | 113 | F70 L74 E75 | F70-E72 PolarHBondContact O-N 2.85Å; E72-L74 PolarHBondContact O-N 3.18Å; E72-E75 PolarHBondContact O-N 3.38Å; E72-E75 VanDerWaalsContact O-N 3.15Å |
| 73 | D | 56 | Low | 69.4 | Low | 166 Ų | 166 | 103.2 Ų | 103.2 | 89% | 0.888 | 56% | 0.563 | S | S | * | * | G | 310 helix | trans | -69.6 | -14.2 | 175.8 | -44.8 | -34.5 | 0 | 0 | 0 | 113.6 | P71 | P71-D73 PolarHBondContact O-N 2.93Å; P71-D73 VanDerWaalsContact O-N 3.09Å |
| 74 | L | 62.2 | Low | 71.8 | Confident | 126 Ų | 126 | 101.6 Ų | 101.6 | 66% | 0.66 | 55% | 0.546 | S | S | * | . | G | 310 helix | trans | -101 | -5.6 | 177.3 | -109.3 | 137.3 | 0 | 0 | 0 | 112 | F70 P71 E72 | F70-L74 HydrophobicContact CB-CB 4.44Å; P71-L74 HydrophobicContact CG-CD1 4.13Å; P71-L74 WeakPolarHBondContact O-CA 3.47Å; P71-L74 VanDerWaalsContact O-CB 3.25Å; P71-L74 WeakPolarHBondContact O-CB 3.27Å; P71-L74 PolarHBondContact O-N 3.11Å; E72-L74 PolarHBondContact O-N 3.18Å |
| 75 | E | 71.9 | Confident | 74 | Confident | 114 Ų | 114 | 97.3 Ų | 97.3 | 53% | 0.533 | 53% | 0.534 | S | S | . | . | S | Bend | trans | -83.3 | 136.7 | -179.7 | -66.4 | -169.2 | 157.5 | 0 | 0 | 111.1 | E72 S77 | E72-E75 PolarHBondContact O-N 3.38Å; E72-E75 VanDerWaalsContact O-N 3.15Å; E75-S77 PolarHBondContact O-N 3.44Å |
| 76 | V | 81.8 | Confident | 76.3 | Confident | 62 Ų | 62 | 93.5 Ų | 93.5 | 38% | 0.376 | 51% | 0.512 | S | S | . | . | P | Polyproline II helix | trans | -64 | 129.1 | 176.4 | 174.8 | 0 | 0 | 0 | 0 | 108.4 | D78 C80 V81 L141 | V76-D78 PolarHBondContact O-N 2.98Å; V76-C80 HydrophobicContact CG1-CB 3.47Å; V76-C80 VanDerWaalsContact CG1-CB 3.47Å; V76-V81 HydrophobicContact CB-CG2 4.22Å; V76-V81 HydrophobicContact CG1-CG2 3.97Å; V76-L141 HydrophobicContact CG1-CD2 3.92Å |
| 77 | S | 87.7 | Confident | 78.7 | Confident | 43 Ų | 43 | 86.5 Ų | 86.5 | 30% | 0.301 | 48% | 0.476 | S | S | . | . | P | Polyproline II helix | trans | -49.4 | 139.1 | 177.6 | 173.4 | 0 | 0 | 0 | 0 | 112.1 | E75 Y79 C80 V81 | E75-S77 PolarHBondContact O-N 3.44Å; S77-Y79 PolarHBondContact O-N 3.06Å; S77-Y79 PolarHBondContact OG-N 3.45Å; S77-C80 WeakPolarHBondContact O-CA 3.5Å; S77-C80 WeakPolarHBondContact O-CB 3.24Å; S77-C80 PolarHBondContact O-N 3.48Å; S77-V81 PolarHBondContact O-N 2.88Å |
| 78 | D | 89.8 | Confident | 81.1 | Confident | 143 Ų | 143 | 80.9 Ų | 80.9 | 77% | 0.765 | 46% | 0.455 | S | S | * | . | H | α-helix | trans | -47.8 | -37.3 | 176.1 | -70.4 | -27.7 | 0 | 0 | 0 | 112.8 | V76 V81 E82 | V76-D78 PolarHBondContact O-N 2.98Å; D78-V81 PolarHBondContact O-N 2.88Å; D78-E82 PolarHBondContact O-N 3.32Å |
| 79 | Y | 90.7 | Very high | 83.1 | Confident | 64 Ų | 64 | 82.5 Ų | 82.5 | 25% | 0.251 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -60.1 | -45.8 | 175.1 | 169.3 | -114.7 | 0 | 0 | 0 | 112.5 | S77 V81 E82 L83 P132 C137 | S77-Y79 PolarHBondContact O-N 3.06Å; S77-Y79 PolarHBondContact OG-N 3.45Å; Y79-V81 VanDerWaalsContact C-N 3.35Å; Y79-E82 PolarHBondContact O-N 3.36Å; Y79-L83 HydrophobicContact CE1-CD1 3.86Å; Y79-L83 HydrophobicContact CE2-CD1 4.17Å; Y79-L83 HydrophobicContact CE2-CD2 4.22Å; Y79-L83 HydrophobicContact CE2-CG 4.09Å; Y79-L83 WeakPolarHBondContact O-CG 3.36Å; Y79-L83 PolarHBondContact O-N 3.37Å; Y79-P132 HydrophobicContact CD2-CG 4.12Å; Y79-P132 HydrophobicContact CE2-CG 4.35Å; Y79-P132 HydrophobicContact CG-CG 4.47Å; Y79-C137 VanDerWaalsContact CD1-SG 3.54Å; Y79-C137 VanDerWaalsContact CE1-SG 3.56Å |
| 80 | C | 92.4 | Very high | 84.9 | Confident | 0 Ų | 0 | 82.4 Ų | 82.4 | 0% | 0 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -70.5 | -33.5 | 178.1 | -60.8 | 0 | 0 | 0 | 0 | 111.6 | V76 S77 E82 L83 L84 C137 L141 | V76-C80 HydrophobicContact CG1-CB 3.47Å; V76-C80 VanDerWaalsContact CG1-CB 3.47Å; S77-C80 WeakPolarHBondContact O-CA 3.5Å; S77-C80 WeakPolarHBondContact O-CB 3.24Å; S77-C80 PolarHBondContact O-N 3.48Å; C80-E82 VanDerWaalsContact C-N 3.33Å; C80-L83 PolarHBondContact O-N 3.38Å; C80-L84 WeakPolarHBondContact O-CB 3.43Å; C80-L84 PolarHBondContact O-N 3.48Å; C80-C137 WeakPolarHBondContact CA-SG 3.12Å; C80-C137 HydrophobicContact CB-CB 3.81Å; C80-C137 WeakPolarHBondContact CB-SG 3.27Å; C80-C137 WeakPolarHBondContact SG-CA 3.39Å; C80-C137 WeakPolarHBondContact SG-CB 3.34Å; C80-C137 CovalentContact SG-SG 2.04Å; C80-C137 PolarHBondContact SG-SG 2.81Å; C80-L141 HydrophobicContact CB-CD1 4.07Å; C80-L141 HydrophobicContact CB-CD2 4.37Å; C80-L141 HydrophobicContact CB-CG 4.26Å |
| 81 | V | 92.9 | Very high | 86.7 | Confident | 73 Ų | 73 | 78.3 Ų | 78.3 | 44% | 0.442 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -63 | -41.1 | 172.4 | 177.9 | 0 | 0 | 0 | 0 | 110.8 | V76 S77 D78 Y79 L84 A85 | V76-V81 HydrophobicContact CB-CG2 4.22Å; V76-V81 HydrophobicContact CG1-CG2 3.97Å; S77-V81 PolarHBondContact O-N 2.88Å; D78-V81 PolarHBondContact O-N 2.88Å; Y79-V81 VanDerWaalsContact C-N 3.35Å; V81-L84 PolarHBondContact O-N 3.48Å; V81-A85 PolarHBondContact O-N 3.2Å |
| 82 | E | 93.9 | Very high | 88.2 | Confident | 123 Ų | 123 | 77.8 Ų | 77.8 | 58% | 0.575 | 41% | 0.414 | S | S | * | . | H | α-helix | trans | -63.3 | -48 | 175.1 | -173.3 | -179.6 | -178.7 | 0 | 0 | 111.8 | D78 Y79 C80 L84 A85 I86 | D78-E82 PolarHBondContact O-N 3.32Å; Y79-E82 PolarHBondContact O-N 3.36Å; C80-E82 VanDerWaalsContact C-N 3.33Å; E82-L84 VanDerWaalsContact C-N 3.26Å; E82-L84 PolarHBondContact O-N 2.99Å; E82-A85 WeakPolarHBondContact O-CB 3.14Å; E82-A85 PolarHBondContact O-N 3.13Å; E82-A85 VanDerWaalsContact O-N 3.13Å; E82-I86 HydrophobicContact CG-CD1 4.22Å; E82-I86 WeakPolarHBondContact O-CG1 3.38Å; E82-I86 PolarHBondContact O-N 2.92Å |
| 83 | L | 95.1 | Very high | 90.2 | Very high | 15 Ų | 15 | 72.9 Ų | 72.9 | 8% | 0.079 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -58.5 | -39.7 | 175.5 | -68.2 | -174.7 | 0 | 0 | 0 | 112 | Y79 C80 I86 F87 I121 I125 C137 | Y79-L83 HydrophobicContact CE1-CD1 3.86Å; Y79-L83 HydrophobicContact CE2-CD1 4.17Å; Y79-L83 HydrophobicContact CE2-CD2 4.22Å; Y79-L83 HydrophobicContact CE2-CG 4.09Å; Y79-L83 WeakPolarHBondContact O-CG 3.36Å; Y79-L83 PolarHBondContact O-N 3.37Å; C80-L83 PolarHBondContact O-N 3.38Å; L83-I86 PolarHBondContact O-N 2.7Å; L83-F87 WeakPolarHBondContact O-CB 3.5Å; L83-F87 PolarHBondContact O-N 2.99Å; L83-I121 HydrophobicContact CB-CD1 4.46Å; L83-I121 HydrophobicContact CD2-CD1 3.76Å; L83-I125 HydrophobicContact CB-CD1 4.21Å; L83-I125 HydrophobicContact CB-CG1 3.84Å; L83-I125 HydrophobicContact CD1-CG1 3.98Å; L83-C137 HydrophobicContact CD1-CB 4.39Å |
| 84 | L | 95.6 | Very high | 92.2 | Very high | 69 Ų | 69 | 65.1 Ų | 65.1 | 36% | 0.361 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -64.8 | -39.8 | 176.9 | -175.6 | 62.2 | 0 | 0 | 0 | 111.9 | C80 V81 E82 F87 G88 L141 V150 | C80-L84 WeakPolarHBondContact O-CB 3.43Å; C80-L84 PolarHBondContact O-N 3.48Å; V81-L84 PolarHBondContact O-N 3.48Å; E82-L84 VanDerWaalsContact C-N 3.26Å; E82-L84 PolarHBondContact O-N 2.99Å; L84-F87 PolarHBondContact O-N 3.36Å; L84-G88 PolarHBondContact O-N 2.97Å; L84-L141 HydrophobicContact CB-CD1 4.33Å; L84-L141 HydrophobicContact CD2-CD2 4.35Å; L84-V150 HydrophobicContact CD1-CG2 3.51Å |
| 85 | A | 97.4 | Very high | 93.9 | Very high | 65 Ų | 65 | 61.3 Ų | 61.3 | 54% | 0.537 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -63.5 | -42.9 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | V81 E82 G88 Q89 | V81-A85 PolarHBondContact O-N 3.2Å; E82-A85 WeakPolarHBondContact O-CB 3.14Å; E82-A85 PolarHBondContact O-N 3.13Å; E82-A85 VanDerWaalsContact O-N 3.13Å; A85-G88 PolarHBondContact O-N 2.83Å; A85-Q89 PolarHBondContact O-N 3.27Å |
| 86 | I | 97.9 | Very high | 95.2 | Very high | 52 Ų | 52 | 61 Ų | 61 | 27% | 0.267 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -63.6 | -44.9 | 175.5 | -61.8 | 166.4 | 0 | 0 | 0 | 110.2 | E82 L83 G88 Q89 R90 I121 | E82-I86 HydrophobicContact CG-CD1 4.22Å; E82-I86 WeakPolarHBondContact O-CG1 3.38Å; E82-I86 PolarHBondContact O-N 2.92Å; L83-I86 PolarHBondContact O-N 2.7Å; I86-G88 VanDerWaalsContact C-N 3.32Å; I86-G88 PolarHBondContact O-N 3.41Å; I86-Q89 PolarHBondContact O-N 3.43Å; I86-R90 HydrophobicContact CG2-CG 4.19Å; I86-R90 WeakPolarHBondContact O-CG 3.38Å; I86-R90 PolarHBondContact O-N 3.45Å; I86-I121 HydrophobicContact CB-CD1 3.98Å; I86-I121 HydrophobicContact CB-CG1 4.14Å; I86-I121 HydrophobicContact CG2-CB 4.36Å; I86-I121 HydrophobicContact CG2-CD1 3.75Å; I86-I121 HydrophobicContact CG2-CG1 3.8Å |
| 87 | F | 98.3 | Very high | 96 | Very high | 6 Ų | 6 | 59.3 Ų | 59.3 | 3% | 0.026 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -55.5 | -48.3 | 175.1 | 176.4 | -89.3 | 0 | 0 | 0 | 111.1 | L83 L84 Q89 R90 Y91 L118 I121 Y122 I125 V150 L153 | L83-F87 WeakPolarHBondContact O-CB 3.5Å; L83-F87 PolarHBondContact O-N 2.99Å; L84-F87 PolarHBondContact O-N 3.36Å; F87-Q89 VanDerWaalsContact C-N 3.33Å; F87-Q89 PolarHBondContact O-N 3.08Å; F87-R90 PolarHBondContact O-N 3.3Å; F87-Y91 HydrophobicContact CE1-CD2 4.41Å; F87-Y91 HydrophobicContact CZ-CD2 4.26Å; F87-Y91 WeakPolarHBondContact O-CB 3.37Å; F87-Y91 PolarHBondContact O-N 3.4Å; F87-L118 HydrophobicContact CD2-CD1 3.89Å; F87-L118 HydrophobicContact CE2-CD1 3.63Å; F87-L118 HydrophobicContact CZ-CD1 4.23Å; F87-I121 HydrophobicContact CB-CG1 4.21Å; F87-I121 HydrophobicContact CB-CG2 4.41Å; F87-I121 HydrophobicContact CD2-CG2 4.15Å; F87-Y122 AromaticContact CE2-CD2 3.96Å; F87-Y122 HydrophobicContact CE2-CD2 3.96Å; F87-I125 HydrophobicContact CB-CD1 3.9Å; F87-I125 HydrophobicContact CD2-CD1 4.34Å; F87-I125 HydrophobicContact CG-CD1 4.36Å; F87-V150 HydrophobicContact CD1-CG1 4.1Å; F87-V150 HydrophobicContact CD2-CG1 4.22Å; F87-V150 HydrophobicContact CE1-CG1 3.88Å; F87-V150 HydrophobicContact CE2-CG1 4Å; F87-V150 HydrophobicContact CG-CG1 4.27Å; F87-V150 HydrophobicContact CZ-CG1 3.83Å; F87-L153 HydrophobicContact CZ-CB 4.39Å |
| 88 | G | 98.2 | Very high | 96.5 | Very high | 36 Ų | 36 | 58.2 Ų | 58.2 | 37% | 0.371 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -56.4 | -44.9 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | L84 A85 I86 S92 | L84-G88 PolarHBondContact O-N 2.97Å; A85-G88 PolarHBondContact O-N 2.83Å; I86-G88 VanDerWaalsContact C-N 3.32Å; I86-G88 PolarHBondContact O-N 3.41Å; G88-S92 WeakPolarHBondContact O-CB 3.46Å; G88-S92 PolarHBondContact O-N 2.89Å; G88-S92 PolarHBondContact O-OG 3.33Å |
| 89 | Q | 98.4 | Very high | 96.9 | Very high | 111 Ų | 111 | 56.4 Ų | 56.4 | 52% | 0.519 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -64.4 | -45.8 | 177.3 | -172.4 | -161.3 | 0.3 | 0 | 0 | 112.5 | A85 I86 F87 S92 T93 | A85-Q89 PolarHBondContact O-N 3.27Å; I86-Q89 PolarHBondContact O-N 3.43Å; F87-Q89 VanDerWaalsContact C-N 3.33Å; F87-Q89 PolarHBondContact O-N 3.08Å; Q89-S92 PolarHBondContact O-OG 3.33Å; Q89-T93 WeakPolarHBondContact O-CB 3.47Å; Q89-T93 PolarHBondContact O-N 2.96Å; Q89-T93 PolarHBondContact O-OG1 3.45Å |
| 90 | R | 98.4 | Very high | 97.2 | Very high | 87 Ų | 87 | 57.6 Ų | 57.6 | 33% | 0.328 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -67.6 | -41.5 | 180 | -62.4 | -50.1 | -179.1 | 160 | 1 | 111.2 | I86 F87 T93 Y94 N117 L118 I121 | I86-R90 HydrophobicContact CG2-CG 4.19Å; I86-R90 WeakPolarHBondContact O-CG 3.38Å; I86-R90 PolarHBondContact O-N 3.45Å; F87-R90 PolarHBondContact O-N 3.3Å; R90-T93 PolarHBondContact O-N 3.32Å; R90-Y94 PolarHBondContact O-N 2.84Å; R90-N117 HydrophobicContact CG-CB 4.49Å; R90-L118 HydrophobicContact CB-CB 4.47Å; R90-L118 HydrophobicContact CB-CD1 4.31Å; R90-I121 HydrophobicContact CB-CG2 4.18Å; R90-I121 HydrophobicContact CG-CG2 4.14Å |
| 91 | Y | 98.5 | Very high | 97.4 | Very high | 50 Ų | 50 | 57.8 Ų | 57.8 | 20% | 0.196 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -58.8 | -51 | 174.6 | -177.7 | -89 | 0 | 0 | 0 | 111.4 | F87 T93 Y94 V95 L118 L153 M157 | F87-Y91 HydrophobicContact CE1-CD2 4.41Å; F87-Y91 HydrophobicContact CZ-CD2 4.26Å; F87-Y91 WeakPolarHBondContact O-CB 3.37Å; F87-Y91 PolarHBondContact O-N 3.4Å; Y91-T93 VanDerWaalsContact C-N 3.27Å; Y91-T93 PolarHBondContact O-N 3.39Å; Y91-Y94 PolarHBondContact O-N 3.48Å; Y91-V95 HydrophobicContact CD1-CG2 4.07Å; Y91-V95 HydrophobicContact CE1-CG2 3.62Å; Y91-V95 HydrophobicContact CE2-CG2 4.3Å; Y91-V95 WeakPolarHBondContact O-CG2 3.26Å; Y91-V95 PolarHBondContact O-N 3.02Å; Y91-L118 HydrophobicContact CD2-CD2 4.29Å; Y91-L153 HydrophobicContact CD2-CB 4.23Å; Y91-L153 HydrophobicContact CE1-CD2 4.41Å; Y91-L153 HydrophobicContact CE2-CB 3.69Å; Y91-L153 HydrophobicContact CE2-CD2 4.26Å; Y91-L153 HydrophobicContact CE2-CG 4.41Å; Y91-L153 WeakPolarHBondContact OH-CD2 3.47Å; Y91-M157 HydrophobicContact CD2-CG 4.01Å; Y91-M157 HydrophobicContact CE2-CE 3.86Å; Y91-M157 HydrophobicContact CE2-CG 3.53Å; Y91-M157 HydrophobicContact CE2-SD 3.92Å; Y91-M157 WeakPolarHBondContact OH-CE 2.98Å |
| 92 | S | 98.4 | Very high | 97.6 | Very high | 65 Ų | 65 | 56.6 Ų | 56.6 | 46% | 0.455 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -61.8 | -37.2 | 178.7 | 62.6 | 0 | 0 | 0 | 0 | 112.4 | G88 Q89 N96 | G88-S92 WeakPolarHBondContact O-CB 3.46Å; G88-S92 PolarHBondContact O-N 2.89Å; G88-S92 PolarHBondContact O-OG 3.33Å; Q89-S92 PolarHBondContact O-OG 3.33Å; S92-N96 VanDerWaalsContact O-CB 3.25Å; S92-N96 WeakPolarHBondContact O-CB 3.33Å; S92-N96 PolarHBondContact O-N 3.29Å |
| 93 | T | 98.5 | Very high | 97.6 | Very high | 61 Ų | 61 | 60.4 Ų | 60.4 | 37% | 0.374 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -64.5 | -46.2 | 177 | -57.9 | 0 | 0 | 0 | 0 | 111 | Q89 R90 Y91 N96 C97 | Q89-T93 WeakPolarHBondContact O-CB 3.47Å; Q89-T93 PolarHBondContact O-N 2.96Å; Q89-T93 PolarHBondContact O-OG1 3.45Å; R90-T93 PolarHBondContact O-N 3.32Å; Y91-T93 VanDerWaalsContact C-N 3.27Å; Y91-T93 PolarHBondContact O-N 3.39Å; T93-N96 PolarHBondContact O-N 3.46Å; T93-C97 PolarHBondContact O-N 3.25Å |
| 94 | Y | 98.2 | Very high | 97.6 | Very high | 2 Ų | 2 | 63.8 Ų | 63.8 | 1% | 0.008 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -64.1 | -47.8 | 178.7 | -179.9 | -120.8 | 0 | 0 | 0 | 111.9 | R90 Y91 N96 C97 L98 C111 Y115 L118 M157 | R90-Y94 PolarHBondContact O-N 2.84Å; Y91-Y94 PolarHBondContact O-N 3.48Å; Y94-N96 VanDerWaalsContact C-N 3.33Å; Y94-N96 PolarHBondContact O-N 2.84Å; Y94-C97 WeakPolarHBondContact O-CB 3.49Å; Y94-C97 PolarHBondContact O-N 2.97Å; Y94-C97 VanDerWaalsContact O-N 3.1Å; Y94-L98 HydrophobicContact CD1-CD1 4.05Å; Y94-L98 HydrophobicContact CD1-CG 4.5Å; Y94-L98 HydrophobicContact CD2-CG 4.46Å; Y94-L98 HydrophobicContact CE1-CD1 3.54Å; Y94-L98 HydrophobicContact CE1-CG 4.1Å; Y94-L98 HydrophobicContact CE2-CD1 4.39Å; Y94-L98 HydrophobicContact CE2-CD2 4.02Å; Y94-L98 HydrophobicContact CE2-CG 4.06Å; Y94-L98 PolarHBondContact O-N 2.9Å; Y94-C111 HydrophobicContact CD2-CB 4.12Å; Y94-C111 HydrophobicContact CE2-CB 3.8Å; Y94-Y115 AromaticContact CE1-CD2 3.95Å; Y94-Y115 HydrophobicContact CE1-CD2 3.95Å; Y94-Y115 HydrophobicContact CE2-CD2 4.09Å; Y94-Y115 HydrophobicContact CE2-CG 4.28Å; Y94-Y115 AromaticContact CZ-CD2 3.64Å; Y94-L118 HydrophobicContact CD1-CD2 3.83Å; Y94-L118 HydrophobicContact CG-CD2 4.33Å; Y94-M157 HydrophobicContact CD1-CB 4.16Å; Y94-M157 HydrophobicContact CD1-CG 3.94Å; Y94-M157 HydrophobicContact CD1-SD 3.58Å; Y94-M157 VanDerWaalsContact CD1-SD 3.58Å; Y94-M157 HydrophobicContact CE1-CB 3.79Å; Y94-M157 HydrophobicContact CE1-CG 3.99Å; Y94-M157 HydrophobicContact CE1-SD 3.6Å; Y94-M157 VanDerWaalsContact CE1-SD 3.6Å |
| 95 | V | 98.3 | Very high | 97.6 | Very high | 46 Ų | 46 | 61.5 Ų | 61.5 | 28% | 0.279 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -59.8 | -43 | 176.5 | 172.1 | 0 | 0 | 0 | 0 | 111.5 | Y91 C97 L98 V99 M157 | Y91-V95 HydrophobicContact CD1-CG2 4.07Å; Y91-V95 HydrophobicContact CE1-CG2 3.62Å; Y91-V95 HydrophobicContact CE2-CG2 4.3Å; Y91-V95 WeakPolarHBondContact O-CG2 3.26Å; Y91-V95 PolarHBondContact O-N 3.02Å; V95-C97 VanDerWaalsContact C-N 3.28Å; V95-C97 PolarHBondContact O-N 3.2Å; V95-L98 PolarHBondContact O-N 3.04Å; V95-V99 HydrophobicContact CG1-CG2 4.37Å; V95-V99 WeakPolarHBondContact O-CG2 3.31Å; V95-V99 PolarHBondContact O-N 3.22Å; V95-M157 HydrophobicContact CG2-CE 4.25Å; V95-M157 HydrophobicContact CG2-SD 3.87Å |
| 96 | N | 98.4 | Very high | 97.6 | Very high | 109 Ų | 109 | 63 Ų | 63 | 58% | 0.583 | 35% | 0.345 | S | S | * | . | H | α-helix | trans | -61.4 | -37.7 | 176.7 | -174.8 | 58.6 | 0 | 0 | 0 | 112.1 | S92 T93 Y94 S100 | S92-N96 VanDerWaalsContact O-CB 3.25Å; S92-N96 WeakPolarHBondContact O-CB 3.33Å; S92-N96 PolarHBondContact O-N 3.29Å; T93-N96 PolarHBondContact O-N 3.46Å; Y94-N96 VanDerWaalsContact C-N 3.33Å; Y94-N96 PolarHBondContact O-N 2.84Å; N96-S100 WeakPolarHBondContact O-CB 3.09Å; N96-S100 PolarHBondContact O-N 3.15Å; N96-S100 VanDerWaalsContact O-N 3.13Å; N96-S100 PolarHBondContact O-OG 2.65Å |
| 97 | C | 98.4 | Very high | 97.6 | Very high | 25 Ų | 25 | 61.3 Ų | 61.3 | 17% | 0.169 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -63.5 | -48.9 | 172.6 | -174.2 | 0 | 0 | 0 | 0 | 111.7 | T93 Y94 V95 V99 S100 A101 C111 | T93-C97 PolarHBondContact O-N 3.25Å; Y94-C97 WeakPolarHBondContact O-CB 3.49Å; Y94-C97 PolarHBondContact O-N 2.97Å; Y94-C97 VanDerWaalsContact O-N 3.1Å; V95-C97 VanDerWaalsContact C-N 3.28Å; V95-C97 PolarHBondContact O-N 3.2Å; C97-V99 PolarHBondContact O-N 3.4Å; C97-S100 PolarHBondContact O-N 3.44Å; C97-A101 VanDerWaalsContact O-CB 3.29Å; C97-A101 WeakPolarHBondContact O-CB 3.41Å; C97-A101 PolarHBondContact O-N 3.03Å; C97-C111 HydrophobicContact CB-CB 3.85Å; C97-C111 WeakPolarHBondContact CB-SG 3.5Å; C97-C111 PolarHBondContact O-SG 3.42Å; C97-C111 WeakPolarHBondContact SG-CA 3.45Å; C97-C111 WeakPolarHBondContact SG-CB 3.26Å; C97-C111 CovalentContact SG-SG 2.04Å; C97-C111 PolarHBondContact SG-SG 3.12Å |
| 98 | L | 98.1 | Very high | 97.5 | Very high | 20 Ų | 20 | 61 Ų | 61 | 11% | 0.105 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -56.7 | -48 | 179.9 | -71.8 | -180 | 0 | 0 | 0 | 112 | Y94 V95 S100 A101 A102 V107 C111 M157 I160 | Y94-L98 HydrophobicContact CD1-CD1 4.05Å; Y94-L98 HydrophobicContact CD1-CG 4.5Å; Y94-L98 HydrophobicContact CD2-CG 4.46Å; Y94-L98 HydrophobicContact CE1-CD1 3.54Å; Y94-L98 HydrophobicContact CE1-CG 4.1Å; Y94-L98 HydrophobicContact CE2-CD1 4.39Å; Y94-L98 HydrophobicContact CE2-CD2 4.02Å; Y94-L98 HydrophobicContact CE2-CG 4.06Å; Y94-L98 PolarHBondContact O-N 2.9Å; V95-L98 PolarHBondContact O-N 3.04Å; L98-S100 PolarHBondContact O-N 3.4Å; L98-A101 CarbonylContact O-C 3.47Å; L98-A101 PolarHBondContact O-N 3.45Å; L98-A102 PolarHBondContact O-N 3.25Å; L98-V107 HydrophobicContact CD2-CB 3.84Å; L98-V107 HydrophobicContact CD2-CG1 3.93Å; L98-C111 HydrophobicContact CD2-CB 4.41Å; L98-M157 HydrophobicContact CD1-SD 4.14Å; L98-I160 HydrophobicContact CD1-CD1 4.34Å; L98-I160 HydrophobicContact CD1-CG2 4.24Å; L98-I160 HydrophobicContact CD2-CG2 4.48Å |
| 99 | V | 97.9 | Very high | 97.4 | Very high | 105 Ų | 105 | 60.9 Ų | 60.9 | 64% | 0.636 | 33% | 0.325 | S | S | * | . | H | α-helix | trans | -62.7 | -43.9 | 179.5 | 174.2 | 0 | 0 | 0 | 0 | 110.9 | V95 C97 A101 A102 | V95-V99 HydrophobicContact CG1-CG2 4.37Å; V95-V99 WeakPolarHBondContact O-CG2 3.31Å; V95-V99 PolarHBondContact O-N 3.22Å; C97-V99 PolarHBondContact O-N 3.4Å; V99-A101 VanDerWaalsContact C-N 3.28Å; V99-A101 PolarHBondContact O-N 3.41Å; V99-A102 WeakPolarHBondContact O-CB 3.21Å; V99-A102 PolarHBondContact O-N 3.14Å |
| 100 | S | 97.8 | Very high | 97.2 | Very high | 89 Ų | 89 | 60.1 Ų | 60.1 | 62% | 0.622 | 33% | 0.325 | S | S | * | . | H | α-helix | trans | -66.9 | -30.5 | 179.1 | -58.2 | 0 | 0 | 0 | 0 | 112.7 | N96 C97 L98 | N96-S100 WeakPolarHBondContact O-CB 3.09Å; N96-S100 PolarHBondContact O-N 3.15Å; N96-S100 VanDerWaalsContact O-N 3.13Å; N96-S100 PolarHBondContact O-OG 2.65Å; C97-S100 PolarHBondContact O-N 3.44Å; L98-S100 PolarHBondContact O-N 3.4Å |
| 101 | A | 97.3 | Very high | 97.2 | Very high | 5 Ų | 5 | 56 Ų | 56 | 4% | 0.041 | 31% | 0.309 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -97.1 | 8.6 | -179.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | C97 L98 V99 R103 V105 K106 V107 N110 | C97-A101 VanDerWaalsContact O-CB 3.29Å; C97-A101 WeakPolarHBondContact O-CB 3.41Å; C97-A101 PolarHBondContact O-N 3.03Å; L98-A101 CarbonylContact O-C 3.47Å; L98-A101 PolarHBondContact O-N 3.45Å; V99-A101 VanDerWaalsContact C-N 3.28Å; V99-A101 PolarHBondContact O-N 3.41Å; A101-R103 VanDerWaalsContact C-N 3.35Å; A101-R103 PolarHBondContact O-N 2.85Å; A101-V105 WeakPolarHBondContact O-CA 3.26Å; A101-K106 HydrophobicContact CB-CB 4.34Å; A101-K106 PolarHBondContact O-N 2.91Å; A101-V107 HydrophobicContact CB-CG1 4.15Å; A101-N110 HydrophobicContact CB-CB 4.37Å |
| 102 | A | 96.1 | Very high | 97.1 | Very high | 47 Ų | 47 | 56.5 Ų | 56.5 | 39% | 0.388 | 31% | 0.311 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -72.5 | -27.2 | -176.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | L98 V99 V105 | L98-A102 PolarHBondContact O-N 3.25Å; V99-A102 WeakPolarHBondContact O-CB 3.21Å; V99-A102 PolarHBondContact O-N 3.14Å; A102-V105 WeakPolarHBondContact O-CG2 3.28Å |
| 103 | R | 94.9 | Very high | 97 | Very high | 203 Ų | 203 | 54.6 Ų | 54.6 | 77% | 0.766 | 30% | 0.302 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -149.5 | 117.9 | -178.6 | -71.5 | -59 | -140.6 | -151.1 | 1.2 | 112.5 | A101 | A101-R103 VanDerWaalsContact C-N 3.35Å; A101-R103 PolarHBondContact O-N 2.85Å |
| 104 | P | 93.7 | Very high | 96.9 | Very high | 86 Ų | 86 | 53.1 Ų | 53.1 | 56% | 0.558 | 29% | 0.294 | S | S | * | . | T | Hydrogen-bonded Turn | cis | -60.6 | 152.3 | -14.3 | 28.6 | -35.2 | 0 | 0 | 0 | 111.1 | K106 | P104-K106 PolarHBondContact O-N 3.48Š|
| 105 | V | 97.3 | Very high | 96.8 | Very high | 22 Ų | 22 | 53.4 Ų | 53.4 | 13% | 0.133 | 30% | 0.295 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -68.3 | 118.3 | -171.5 | -176.4 | 0 | 0 | 0 | 0 | 110.4 | A101 A102 V107 I232 D236 | A101-V105 WeakPolarHBondContact O-CA 3.26Å; A102-V105 WeakPolarHBondContact O-CG2 3.28Å; V105-V107 HydrophobicContact CG1-CG1 4.38Å; V105-V107 HydrophobicContact CG1-CG2 4.03Å; V105-I232 HydrophobicContact CG1-CG1 4.02Å; V105-I232 HydrophobicContact CG1-CG2 3.91Å; V105-D236 HydrophobicContact CB-CB 3.71Å; V105-D236 HydrophobicContact CG2-CB 3.88Å; V105-D236 VanDerWaalsContact CG2-CG 3.49Å; V105-D236 PolarHBondContact N-OD2 3.39Å |
| 106 | K | 96.5 | Very high | 96.8 | Very high | 97 Ų | 97 | 52.8 Ų | 52.8 | 42% | 0.422 | 29% | 0.291 | S | S | . | . | trans | -141.5 | 32.2 | 178.4 | -64.1 | -174.4 | 178.2 | -177.6 | 0 | 111.9 | A101 P104 N110 D233 | A101-K106 HydrophobicContact CB-CB 4.34Å; A101-K106 PolarHBondContact O-N 2.91Å; P104-K106 PolarHBondContact O-N 3.48Å; K106-N110 WeakPolarHBondContact CB-ND2 3.23Å; K106-N110 VanDerWaalsContact O-CB 3.25Å; K106-N110 WeakPolarHBondContact O-CB 3.37Å; K106-N110 PolarHBondContact O-N 3.22Å; K106-D233 VanDerWaalsContact C-OD2 3.28Å; K106-D233 WeakPolarHBondContact CA-OD1 3.32Å; K106-D233 WeakPolarHBondContact CA-OD2 3.35Å | ||
| 107 | V | 97.1 | Very high | 96.7 | Very high | 16 Ų | 16 | 50.5 Ų | 50.5 | 10% | 0.097 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -68.8 | -41.1 | -170.1 | -65.4 | 0 | 0 | 0 | 0 | 111.2 | L98 A101 V105 C111 I232 D233 | L98-V107 HydrophobicContact CD2-CB 3.84Å; L98-V107 HydrophobicContact CD2-CG1 3.93Å; A101-V107 HydrophobicContact CB-CG1 4.15Å; V105-V107 HydrophobicContact CG1-CG1 4.38Å; V105-V107 HydrophobicContact CG1-CG2 4.03Å; V107-C111 WeakPolarHBondContact O-CB 3.31Å; V107-C111 PolarHBondContact O-N 3.09Å; V107-I232 HydrophobicContact CG2-CG2 3.59Å; V107-D233 PolarHBondContact N-OD1 3.03Å |
| 108 | C | 97.1 | Very high | 96.6 | Very high | 0 Ų | 0 | 49.3 Ų | 49.3 | 0% | 0 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -69.7 | -44.2 | 179.3 | -55.4 | 0 | 0 | 0 | 0 | 110.5 | Y112 C166 C169 D233 | C108-Y112 WeakPolarHBondContact O-CB 3.48Å; C108-Y112 WeakPolarHBondContact O-CD1 3.06Å; C108-C166 WeakPolarHBondContact CA-SG 3.31Å; C108-C166 HydrophobicContact CB-CB 3.71Å; C108-C166 WeakPolarHBondContact CB-SG 3.4Å; C108-C166 WeakPolarHBondContact SG-CA 3.24Å; C108-C166 WeakPolarHBondContact SG-CB 3.5Å; C108-C166 CovalentContact SG-SG 2.04Å; C108-C166 PolarHBondContact SG-SG 3.19Å; C108-C169 HydrophobicContact CB-CB 4.47Å; C108-D233 PolarHBondContact N-OD1 3.22Å; C108-D233 PolarHBondContact N-OD2 3.37Å |
| 109 | Q | 95.1 | Very high | 96.6 | Very high | 33 Ų | 33 | 51.8 Ų | 51.8 | 15% | 0.154 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -71.2 | -36.1 | -176.4 | -72.7 | 168.1 | 89.9 | 0 | 0 | 114.4 | Y112 L177 M185 D233 | Q109-Y112 WeakPolarHBondContact O-CD1 3.15Å; Q109-Y112 VanDerWaalsContact O-CE1 3.23Å; Q109-Y112 WeakPolarHBondContact O-CE1 3.36Å; Q109-L177 HydrophobicContact CB-CD1 4.43Å; Q109-L177 HydrophobicContact CB-CD2 4.33Å; Q109-L177 HydrophobicContact CG-CD1 3.9Å; Q109-L177 HydrophobicContact CG-CD2 3.9Å; Q109-M185 VanDerWaalsContact CD-CE 3.49Å; Q109-D233 WeakPolarHBondContact CB-OD2 3.2Å; Q109-D233 VanDerWaalsContact CG-OD2 3.24Å; Q109-D233 WeakPolarHBondContact CG-OD2 3.36Å; Q109-D233 PolarHBondContact N-OD2 2.96Å; Q109-D233 PolarHBondContact NE2-OD2 2.94Å |
| 110 | N | 96.1 | Very high | 96.5 | Very high | 94 Ų | 94 | 50.5 Ų | 50.5 | 50% | 0.503 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -94.6 | -27.6 | -174.1 | -66.1 | -10.2 | 0 | 0 | 0 | 112.6 | A101 K106 | A101-N110 HydrophobicContact CB-CB 4.37Å; K106-N110 WeakPolarHBondContact CB-ND2 3.23Å; K106-N110 VanDerWaalsContact O-CB 3.25Å; K106-N110 WeakPolarHBondContact O-CB 3.37Å; K106-N110 PolarHBondContact O-N 3.22Å |
| 111 | C | 97.4 | Very high | 96.4 | Very high | 0 Ų | 0 | 46.8 Ų | 46.8 | 0% | 0 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -110 | 0.8 | -167 | -49 | 0 | 0 | 0 | 0 | 114.5 | Y94 C97 L98 V107 G113 S114 Y115 | Y94-C111 HydrophobicContact CD2-CB 4.12Å; Y94-C111 HydrophobicContact CE2-CB 3.8Å; C97-C111 HydrophobicContact CB-CB 3.85Å; C97-C111 WeakPolarHBondContact CB-SG 3.5Å; C97-C111 PolarHBondContact O-SG 3.42Å; C97-C111 WeakPolarHBondContact SG-CA 3.45Å; C97-C111 WeakPolarHBondContact SG-CB 3.26Å; C97-C111 CovalentContact SG-SG 2.04Å; C97-C111 PolarHBondContact SG-SG 3.12Å; L98-C111 HydrophobicContact CD2-CB 4.41Å; V107-C111 WeakPolarHBondContact O-CB 3.31Å; V107-C111 PolarHBondContact O-N 3.09Å; C111-G113 VanDerWaalsContact C-N 3.31Å; C111-G113 PolarHBondContact O-N 3.38Å; C111-S114 PolarHBondContact O-N 2.87Å; C111-S114 VanDerWaalsContact O-N 3.13Å; C111-Y115 PolarHBondContact O-N 3.49Å |
| 112 | Y | 96.8 | Very high | 96.4 | Very high | 61 Ų | 61 | 47.5 Ų | 47.5 | 24% | 0.239 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -56.7 | -41.6 | -179.1 | 69.9 | -96.6 | 0 | 0 | 0 | 113.1 | C108 Q109 S114 Y115 D116 V170 L174 H175 L177 | C108-Y112 WeakPolarHBondContact O-CB 3.48Å; C108-Y112 WeakPolarHBondContact O-CD1 3.06Å; Q109-Y112 WeakPolarHBondContact O-CD1 3.15Å; Q109-Y112 VanDerWaalsContact O-CE1 3.23Å; Q109-Y112 WeakPolarHBondContact O-CE1 3.36Å; Y112-S114 PolarHBondContact O-N 3.47Å; Y112-Y115 WeakPolarHBondContact O-CB 3.48Å; Y112-Y115 PolarHBondContact O-N 3.21Å; Y112-D116 WeakPolarHBondContact O-CB 3.42Å; Y112-D116 PolarHBondContact O-N 2.75Å; Y112-V170 HydrophobicContact CD2-CG1 4.22Å; Y112-V170 HydrophobicContact CG-CG1 4.12Å; Y112-V170 HydrophobicContact CG-CG2 4.43Å; Y112-L174 WeakPolarHBondContact CD2-O 3.31Å; Y112-L174 VanDerWaalsContact CE2-O 3.24Å; Y112-L174 WeakPolarHBondContact CE2-O 2.95Å; Y112-H175 PolarHBondContact OH-O 3.25Å; Y112-L177 HydrophobicContact CD1-CD2 4.47Å; Y112-L177 HydrophobicContact CE1-CD2 4.47Å |
| 113 | G | 95.9 | Very high | 96.4 | Very high | 26 Ų | 26 | 48.1 Ų | 48.1 | 27% | 0.268 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -69.3 | -34.6 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | C111 N117 | C111-G113 VanDerWaalsContact C-N 3.31Å; C111-G113 PolarHBondContact O-N 3.38Å; G113-N117 PolarHBondContact O-N 3.01Å; G113-N117 PolarHBondContact O-ND2 3.24Å |
| 114 | S | 96.4 | Very high | 96.4 | Very high | 29 Ų | 29 | 42.9 Ų | 42.9 | 20% | 0.203 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -71.8 | -33.2 | 174.6 | -61.1 | 0 | 0 | 0 | 0 | 112.1 | C111 Y112 L118 | C111-S114 PolarHBondContact O-N 2.87Å; C111-S114 VanDerWaalsContact O-N 3.13Å; Y112-S114 PolarHBondContact O-N 3.47Å; S114-L118 PolarHBondContact O-N 2.89Å |
| 115 | Y | 97.3 | Very high | 96.4 | Very high | 8 Ų | 8 | 38.8 Ų | 38.8 | 3% | 0.031 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -64.9 | -46.2 | 172.4 | -177 | -108.7 | 0 | 0 | 0 | 111.6 | Y94 C111 Y112 N117 L118 M119 W161 L174 | Y94-Y115 AromaticContact CE1-CD2 3.95Å; Y94-Y115 HydrophobicContact CE1-CD2 3.95Å; Y94-Y115 HydrophobicContact CE2-CD2 4.09Å; Y94-Y115 HydrophobicContact CE2-CG 4.28Å; Y94-Y115 AromaticContact CZ-CD2 3.64Å; C111-Y115 PolarHBondContact O-N 3.49Å; Y112-Y115 WeakPolarHBondContact O-CB 3.48Å; Y112-Y115 PolarHBondContact O-N 3.21Å; Y115-N117 PolarHBondContact O-N 2.97Å; Y115-L118 WeakPolarHBondContact O-CB 3.28Å; Y115-L118 PolarHBondContact O-N 3.5Å; Y115-M119 HydrophobicContact CE1-SD 4.5Å; Y115-M119 PolarHBondContact O-N 3.27Å; Y115-W161 AromaticContact CD1-CD2 3.43Å; Y115-W161 HydrophobicContact CD1-CD2 3.43Å; Y115-W161 VanDerWaalsContact CD1-CD2 3.43Å; Y115-W161 AromaticContact CD1-CE2 3.66Å; Y115-W161 AromaticContact CD1-CE3 3.59Å; Y115-W161 HydrophobicContact CD1-CE3 3.59Å; Y115-W161 AromaticContact CD1-CG 3.92Å; Y115-W161 HydrophobicContact CD1-CG 3.92Å; Y115-W161 HydrophobicContact CD1-CH2 4.2Å; Y115-W161 HydrophobicContact CD1-CZ2 4.07Å; Y115-W161 AromaticContact CD1-CZ3 3.98Å; Y115-W161 HydrophobicContact CD1-CZ3 3.98Å; Y115-W161 HydrophobicContact CD2-CB 4.2Å; Y115-W161 HydrophobicContact CD2-CD2 4.19Å; Y115-W161 HydrophobicContact CD2-CE3 4.01Å; Y115-W161 HydrophobicContact CD2-CG 4.29Å; Y115-W161 HydrophobicContact CE1-CB 4.15Å; Y115-W161 AromaticContact CE1-CD1 3.56Å; Y115-W161 AromaticContact CE1-CD2 3.48Å; Y115-W161 HydrophobicContact CE1-CD2 3.48Å; Y115-W161 VanDerWaalsContact CE1-CD2 3.48Å; Y115-W161 AromaticContact CE1-CE2 3.67Å; Y115-W161 HydrophobicContact CE1-CE3 4.12Å; Y115-W161 AromaticContact CE1-CG 3.46Å; Y115-W161 HydrophobicContact CE1-CG 3.46Å; Y115-W161 VanDerWaalsContact CE1-CG 3.46Å; Y115-W161 HydrophobicContact CE1-CZ2 4.45Å; Y115-W161 AromaticContact CE1-NE1 3.67Å; Y115-W161 HydrophobicContact CE2-CB 3.62Å; Y115-W161 HydrophobicContact CE2-CD2 4.22Å; Y115-W161 HydrophobicContact CE2-CE3 4.47Å; Y115-W161 AromaticContact CE2-CG 3.86Å; Y115-W161 HydrophobicContact CE2-CG 3.86Å; Y115-W161 AromaticContact CG-CD2 3.81Å; Y115-W161 HydrophobicContact CG-CD2 3.81Å; Y115-W161 AromaticContact CG-CE3 3.54Å; Y115-W161 HydrophobicContact CG-CE3 3.54Å; Y115-W161 HydrophobicContact CG-CG 4.31Å; Y115-W161 AromaticContact CG-CZ3 3.98Å; Y115-W161 HydrophobicContact CG-CZ3 3.98Å; Y115-W161 AromaticContact CZ-CD1 3.71Å; Y115-W161 AromaticContact CZ-CD2 3.89Å; Y115-W161 AromaticContact CZ-CG 3.42Å; Y115-W161 VanDerWaalsContact CZ-CG 3.42Å; Y115-L174 HydrophobicContact CD1-CD1 3.81Å; Y115-L174 HydrophobicContact CE1-CD1 4.3Å |
| 116 | D | 96.6 | Very high | 96.3 | Very high | 34 Ų | 34 | 39.1 Ų | 39.1 | 18% | 0.182 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -53.9 | -51.4 | 175.4 | -169.5 | 51.5 | 0 | 0 | 0 | 111.5 | Y112 L118 M119 D120 L174 | Y112-D116 WeakPolarHBondContact O-CB 3.42Å; Y112-D116 PolarHBondContact O-N 2.75Å; D116-L118 VanDerWaalsContact C-N 3.27Å; D116-L118 PolarHBondContact O-N 2.87Å; D116-M119 WeakPolarHBondContact O-CB 3.35Å; D116-M119 PolarHBondContact O-N 3.45Å; D116-M119 VanDerWaalsContact O-N 3.11Å; D116-D120 PolarHBondContact O-N 3.29Å; D116-L174 HydrophobicContact CB-CB 3.81Å; D116-L174 HydrophobicContact CB-CD1 3.68Å; D116-L174 HydrophobicContact CB-CG 4.38Å; D116-L174 WeakPolarHBondContact OD1-CD1 3.09Å |
| 117 | N | 96.4 | Very high | 96 | Very high | 60 Ų | 60 | 36 Ų | 36 | 32% | 0.321 | 20% | 0.2 | S | C | . | . | H | α-helix | trans | -60.2 | -33.3 | 176.4 | -76.2 | -75.7 | 0 | 0 | 0 | 113.8 | R90 G113 Y115 I121 | R90-N117 HydrophobicContact CG-CB 4.49Å; G113-N117 PolarHBondContact O-N 3.01Å; G113-N117 PolarHBondContact O-ND2 3.24Å; Y115-N117 PolarHBondContact O-N 2.97Å; N117-I121 WeakPolarHBondContact O-CG2 3.41Å; N117-I121 PolarHBondContact O-N 3.46Å |
| 118 | L | 97.7 | Very high | 95.4 | Very high | 0 Ų | 0 | 40.8 Ų | 40.8 | 0% | 0 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -73.2 | -40.6 | 176.7 | 177.2 | 61.5 | 0 | 0 | 0 | 111 | F87 R90 Y91 Y94 S114 Y115 D116 I121 Y122 Y154 M157 | F87-L118 HydrophobicContact CD2-CD1 3.89Å; F87-L118 HydrophobicContact CE2-CD1 3.63Å; F87-L118 HydrophobicContact CZ-CD1 4.23Å; R90-L118 HydrophobicContact CB-CB 4.47Å; R90-L118 HydrophobicContact CB-CD1 4.31Å; Y91-L118 HydrophobicContact CD2-CD2 4.29Å; Y94-L118 HydrophobicContact CD1-CD2 3.83Å; Y94-L118 HydrophobicContact CG-CD2 4.33Å; S114-L118 PolarHBondContact O-N 2.89Å; Y115-L118 WeakPolarHBondContact O-CB 3.28Å; Y115-L118 PolarHBondContact O-N 3.5Å; D116-L118 VanDerWaalsContact C-N 3.27Å; D116-L118 PolarHBondContact O-N 2.87Å; L118-I121 HydrophobicContact CD1-CG2 4.34Å; L118-I121 VanDerWaalsContact O-CG2 3.26Å; L118-I121 WeakPolarHBondContact O-CG2 3.02Å; L118-Y122 WeakPolarHBondContact O-CB 3.32Å; L118-Y122 PolarHBondContact O-N 2.88Å; L118-Y154 HydrophobicContact CG-CD2 4.3Å; L118-M157 HydrophobicContact CD2-CB 3.99Å; L118-M157 HydrophobicContact CD2-CG 3.88Å |
| 119 | M | 96.5 | Very high | 94.7 | Very high | 72 Ų | 72 | 48.1 Ų | 48.1 | 36% | 0.355 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -62.4 | -44.2 | 174.5 | -178.1 | 171 | 179.1 | 0 | 0 | 111.3 | Y115 D116 Y122 T123 | Y115-M119 HydrophobicContact CE1-SD 4.5Å; Y115-M119 PolarHBondContact O-N 3.27Å; D116-M119 WeakPolarHBondContact O-CB 3.35Å; D116-M119 PolarHBondContact O-N 3.45Å; D116-M119 VanDerWaalsContact O-N 3.11Å; M119-Y122 PolarHBondContact O-N 2.93Å; M119-T123 HydrophobicContact CG-CG2 4.36Å; M119-T123 WeakPolarHBondContact O-CB 3.47Å; M119-T123 VanDerWaalsContact O-CG2 3.28Å; M119-T123 WeakPolarHBondContact O-CG2 3.39Å; M119-T123 PolarHBondContact O-N 3.47Å; M119-T123 PolarHBondContact O-OG1 3.01Å |
| 120 | D | 95.9 | Very high | 94.1 | Very high | 78 Ų | 78 | 52.8 Ų | 52.8 | 42% | 0.417 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -60 | -48.2 | 177.7 | -77.9 | -2.7 | 0 | 0 | 0 | 112.6 | D116 Y122 T123 N124 | D116-D120 PolarHBondContact O-N 3.29Å; D120-Y122 VanDerWaalsContact C-N 3.34Å; D120-Y122 PolarHBondContact O-N 3.38Å; D120-T123 WeakPolarHBondContact CA-OG1 3.5Å; D120-T123 PolarHBondContact O-N 3.01Å; D120-T123 PolarHBondContact O-OG1 3.04Å; D120-N124 VanDerWaalsContact O-CG 3.29Å; D120-N124 PolarHBondContact O-N 3.45Å; D120-N124 PolarHBondContact O-ND2 3.29Å |
| 121 | I | 97 | Very high | 93.5 | Very high | 11 Ų | 11 | 49 Ų | 49 | 6% | 0.056 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -68.7 | -36.3 | 179.2 | -172.9 | 61 | 0 | 0 | 0 | 111.8 | L83 I86 F87 R90 N117 L118 N124 I125 | L83-I121 HydrophobicContact CB-CD1 4.46Å; L83-I121 HydrophobicContact CD2-CD1 3.76Å; I86-I121 HydrophobicContact CB-CD1 3.98Å; I86-I121 HydrophobicContact CB-CG1 4.14Å; I86-I121 HydrophobicContact CG2-CB 4.36Å; I86-I121 HydrophobicContact CG2-CD1 3.75Å; I86-I121 HydrophobicContact CG2-CG1 3.8Å; F87-I121 HydrophobicContact CB-CG1 4.21Å; F87-I121 HydrophobicContact CB-CG2 4.41Å; F87-I121 HydrophobicContact CD2-CG2 4.15Å; R90-I121 HydrophobicContact CB-CG2 4.18Å; R90-I121 HydrophobicContact CG-CG2 4.14Å; N117-I121 WeakPolarHBondContact O-CG2 3.41Å; N117-I121 PolarHBondContact O-N 3.46Å; L118-I121 HydrophobicContact CD1-CG2 4.34Å; L118-I121 VanDerWaalsContact O-CG2 3.26Å; L118-I121 WeakPolarHBondContact O-CG2 3.02Å; I121-N124 PolarHBondContact O-N 3.46Å; I121-I125 HydrophobicContact CG1-CD1 4.26Å; I121-I125 WeakPolarHBondContact O-CG1 3.16Å; I121-I125 PolarHBondContact O-N 3.27Å |
| 122 | Y | 97 | Very high | 92.7 | Very high | 21 Ų | 21 | 53.3 Ų | 53.3 | 8% | 0.082 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -68.3 | -39.5 | 177.3 | -177.1 | -97 | 0 | 0 | 0 | 112.2 | F87 L118 M119 D120 N124 I125 S126 L142 V150 F151 Y154 | F87-Y122 AromaticContact CE2-CD2 3.96Å; F87-Y122 HydrophobicContact CE2-CD2 3.96Å; L118-Y122 WeakPolarHBondContact O-CB 3.32Å; L118-Y122 PolarHBondContact O-N 2.88Å; M119-Y122 PolarHBondContact O-N 2.93Å; D120-Y122 VanDerWaalsContact C-N 3.34Å; D120-Y122 PolarHBondContact O-N 3.38Å; Y122-N124 VanDerWaalsContact C-N 3.32Å; Y122-N124 PolarHBondContact O-N 3.47Å; Y122-I125 PolarHBondContact O-N 2.86Å; Y122-S126 WeakPolarHBondContact O-CB 3.39Å; Y122-S126 PolarHBondContact O-N 3.43Å; Y122-S126 PolarHBondContact O-OG 2.95Å; Y122-L142 HydrophobicContact CE2-CD1 4.45Å; Y122-L142 HydrophobicContact CE2-CD2 4.01Å; Y122-V150 HydrophobicContact CD2-CG1 4.45Å; Y122-V150 HydrophobicContact CE2-CG1 4.45Å; Y122-F151 VanDerWaalsContact OH-CD2 3.25Å; Y122-F151 WeakPolarHBondContact OH-CD2 3.39Å; Y122-Y154 AromaticContact CD1-CD1 3.48Å; Y122-Y154 HydrophobicContact CD1-CD1 3.48Å; Y122-Y154 VanDerWaalsContact CD1-CD1 3.48Å; Y122-Y154 AromaticContact CD1-CD2 3.8Å; Y122-Y154 HydrophobicContact CD1-CD2 3.8Å; Y122-Y154 AromaticContact CD1-CE1 3.4Å; Y122-Y154 HydrophobicContact CD1-CE1 3.4Å; Y122-Y154 AromaticContact CD1-CE2 3.75Å; Y122-Y154 HydrophobicContact CD1-CE2 3.75Å; Y122-Y154 AromaticContact CD1-CG 3.66Å; Y122-Y154 HydrophobicContact CD1-CG 3.66Å; Y122-Y154 AromaticContact CD1-CZ 3.52Å; Y122-Y154 HydrophobicContact CD2-CD1 4.01Å; Y122-Y154 AromaticContact CD2-CD2 3.78Å; Y122-Y154 HydrophobicContact CD2-CD2 3.78Å; Y122-Y154 AromaticContact CD2-CG 3.48Å; Y122-Y154 HydrophobicContact CD2-CG 3.48Å; Y122-Y154 VanDerWaalsContact CD2-CG 3.48Å; Y122-Y154 AromaticContact CE1-CD1 3.28Å; Y122-Y154 HydrophobicContact CE1-CD1 3.28Å; Y122-Y154 HydrophobicContact CE1-CD2 4.42Å; Y122-Y154 AromaticContact CE1-CE1 3.4Å; Y122-Y154 HydrophobicContact CE1-CE1 3.4Å; Y122-Y154 VanDerWaalsContact CE1-CE1 3.4Å; Y122-Y154 AromaticContact CE1-CG 3.82Å; Y122-Y154 HydrophobicContact CE1-CG 3.82Å; Y122-Y154 AromaticContact CE2-CD1 3.85Å; Y122-Y154 HydrophobicContact CE2-CD1 3.85Å; Y122-Y154 HydrophobicContact CE2-CD2 4.41Å; Y122-Y154 AromaticContact CE2-CG 3.65Å; Y122-Y154 HydrophobicContact CE2-CG 3.65Å; Y122-Y154 AromaticContact CG-CD1 3.82Å; Y122-Y154 HydrophobicContact CG-CD1 3.82Å; Y122-Y154 AromaticContact CG-CD2 3.42Å; Y122-Y154 HydrophobicContact CG-CD2 3.42Å; Y122-Y154 VanDerWaalsContact CG-CD2 3.42Å; Y122-Y154 HydrophobicContact CG-CE1 4.07Å; Y122-Y154 AromaticContact CG-CE2 3.71Å; Y122-Y154 HydrophobicContact CG-CE2 3.71Å; Y122-Y154 AromaticContact CG-CG 3.46Å; Y122-Y154 HydrophobicContact CG-CG 3.46Å; Y122-Y154 VanDerWaalsContact CG-CG 3.46Å; Y122-Y154 AromaticContact CZ-CD1 3.46Å; Y122-Y154 VanDerWaalsContact CZ-CD1 3.46Å; Y122-Y154 AromaticContact CZ-CG 3.79Å |
| 123 | T | 95.5 | Very high | 91.9 | Very high | 59 Ų | 59 | 53.8 Ų | 53.8 | 36% | 0.362 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -63.6 | -38.8 | 173.9 | 51.8 | 0 | 0 | 0 | 0 | 111.3 | M119 D120 I125 S126 S127 | M119-T123 HydrophobicContact CG-CG2 4.36Å; M119-T123 WeakPolarHBondContact O-CB 3.47Å; M119-T123 VanDerWaalsContact O-CG2 3.28Å; M119-T123 WeakPolarHBondContact O-CG2 3.39Å; M119-T123 PolarHBondContact O-N 3.47Å; M119-T123 PolarHBondContact O-OG1 3.01Å; D120-T123 WeakPolarHBondContact CA-OG1 3.5Å; D120-T123 PolarHBondContact O-N 3.01Å; D120-T123 PolarHBondContact O-OG1 3.04Å; T123-I125 PolarHBondContact O-N 3.2Å; T123-S126 WeakPolarHBondContact CA-OG 3.42Å; T123-S126 PolarHBondContact O-N 3.41Å; T123-S126 PolarHBondContact O-OG 2.89Å; T123-S127 VanDerWaalsContact O-CB 3.25Å; T123-S127 WeakPolarHBondContact O-CB 3.25Å; T123-S127 PolarHBondContact O-N 2.82Å |
| 124 | N | 94.4 | Very high | 91.4 | Very high | 93 Ų | 93 | 58.9 Ų | 58.9 | 50% | 0.497 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -61.4 | -42.5 | 172.5 | -71.5 | -16.2 | 0 | 0 | 0 | 112.7 | D120 I121 Y122 | D120-N124 VanDerWaalsContact O-CG 3.29Å; D120-N124 PolarHBondContact O-N 3.45Å; D120-N124 PolarHBondContact O-ND2 3.29Å; I121-N124 PolarHBondContact O-N 3.46Å; Y122-N124 VanDerWaalsContact C-N 3.32Å; Y122-N124 PolarHBondContact O-N 3.47Å |
| 125 | I | 94.7 | Very high | 90.8 | Very high | 0 Ų | 0 | 59.9 Ų | 59.9 | 0% | 0 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -68 | -41.2 | 177.4 | -69.2 | 166.3 | 0 | 0 | 0 | 111.8 | L83 F87 I121 Y122 T123 S127 R138 L141 L142 | L83-I125 HydrophobicContact CB-CD1 4.21Å; L83-I125 HydrophobicContact CB-CG1 3.84Å; L83-I125 HydrophobicContact CD1-CG1 3.98Å; F87-I125 HydrophobicContact CB-CD1 3.9Å; F87-I125 HydrophobicContact CD2-CD1 4.34Å; F87-I125 HydrophobicContact CG-CD1 4.36Å; I121-I125 HydrophobicContact CG1-CD1 4.26Å; I121-I125 WeakPolarHBondContact O-CG1 3.16Å; I121-I125 PolarHBondContact O-N 3.27Å; Y122-I125 PolarHBondContact O-N 2.86Å; T123-I125 PolarHBondContact O-N 3.2Å; I125-S127 VanDerWaalsContact C-N 3.35Å; I125-R138 WeakPolarHBondContact O-CA 3.36Å; I125-R138 PolarHBondContact O-N 3.29Å; I125-L141 HydrophobicContact CG1-CD1 4.43Å; I125-L141 HydrophobicContact CG2-CB 4.16Å; I125-L141 HydrophobicContact CG2-CD1 3.95Å; I125-L142 HydrophobicContact CG2-CD1 4.23Å; I125-L142 HydrophobicContact CG2-CD2 3.9Å; I125-L142 HydrophobicContact CG2-CG 4.01Å |
| 126 | S | 94.6 | Very high | 90.5 | Very high | 30 Ų | 30 | 61.6 Ų | 61.6 | 21% | 0.21 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -84.3 | -9.1 | -174.8 | 59 | 0 | 0 | 0 | 0 | 114.1 | Y122 T123 R138 | Y122-S126 WeakPolarHBondContact O-CB 3.39Å; Y122-S126 PolarHBondContact O-N 3.43Å; Y122-S126 PolarHBondContact O-OG 2.95Å; T123-S126 WeakPolarHBondContact CA-OG 3.42Å; T123-S126 PolarHBondContact O-N 3.41Å; T123-S126 PolarHBondContact O-OG 2.89Å; S126-R138 VanDerWaalsContact O-CD 3.31Å; S126-R138 WeakPolarHBondContact O-CD 3.22Å |
| 127 | S | 90.1 | Very high | 90.2 | Very high | 32 Ų | 32 | 60.2 Ų | 60.2 | 22% | 0.224 | 35% | 0.349 | C | S | . | . | trans | -64.5 | 146.7 | 177.2 | -177 | 0 | 0 | 0 | 0 | 112.1 | T123 I125 Q129 | T123-S127 VanDerWaalsContact O-CB 3.25Å; T123-S127 WeakPolarHBondContact O-CB 3.25Å; T123-S127 PolarHBondContact O-N 2.82Å; I125-S127 VanDerWaalsContact C-N 3.35Å; S127-Q129 PolarHBondContact O-N 2.96Å; S127-Q129 WeakPolarHBondContact OG-CB 3.45Å; S127-Q129 WeakPolarHBondContact OG-CG 3.41Å; S127-Q129 PolarHBondContact OG-N 2.83Å; S127-Q129 VanDerWaalsContact OG-N 3.1Å | ||
| 128 | D | 84.8 | Confident | 90.1 | Very high | 115 Ų | 115 | 60.5 Ų | 60.5 | 62% | 0.615 | 35% | 0.346 | S | S | * | . | S | Bend | trans | -81.2 | 0.3 | 170.9 | -64.5 | -40.3 | 0 | 0 | 0 | 112.2 | M130 R138 | D128-M130 PolarHBondContact O-N 3.28Å; D128-R138 VanDerWaalsContact CG-NH1 3.33Å; D128-R138 WeakPolarHBondContact OD1-CD 3.32Å; D128-R138 IonicContact OD1-CZ 3.71Å; D128-R138 IonicContact OD1-NH1 2.69Å; D128-R138 PolarHBondContact OD1-NH1 3.4Å; D128-R138 IonicContact OD2-NH1 3.21Å; D128-R138 PolarHBondContact OD2-NH1 2.91Å |
| 129 | Q | 82.6 | Confident | 89.7 | Confident | 154 Ų | 154 | 64.9 Ų | 64.9 | 72% | 0.72 | 37% | 0.37 | S | S | * | . | trans | -66.9 | 130.9 | 174.6 | -69.6 | 178.9 | -10.3 | 0 | 0 | 110.6 | S127 | S127-Q129 PolarHBondContact O-N 2.96Å; S127-Q129 WeakPolarHBondContact OG-CB 3.45Å; S127-Q129 WeakPolarHBondContact OG-CG 3.41Å; S127-Q129 PolarHBondContact OG-N 2.83Å; S127-Q129 VanDerWaalsContact OG-N 3.1Å | ||
| 130 | M | 83.3 | Confident | 89.4 | Confident | 131 Ų | 131 | 63.2 Ų | 63.2 | 65% | 0.645 | 37% | 0.365 | S | S | * | . | trans | -77.3 | 127.9 | 175.7 | -69.1 | 177.1 | -179.2 | 0 | 0 | 109.9 | D128 N134 | D128-M130 PolarHBondContact O-N 3.28Å; M130-N134 HydrophobicContact SD-CB 4.12Å | ||
| 131 | G | 82.1 | Confident | 89.2 | Confident | 15 Ų | 15 | 60.2 Ų | 60.2 | 16% | 0.155 | 35% | 0.349 | C | S | . | . | trans | -78.4 | -169.5 | 173 | 0 | 0 | 0 | 0 | 0 | 112.8 | G133 N134 V135 | G131-G133 PolarHBondContact O-N 2.9Å; G131-N134 PolarHBondContact O-N 2.03Å; G131-N134 VanDerWaalsContact O-N 3.15Å; G131-V135 PolarHBondContact N-O 3.08Å | ||
| 132 | P | 81.7 | Confident | 89 | Confident | 90 Ų | 90 | 60 Ų | 60 | 58% | 0.584 | 35% | 0.348 | S | S | * | . | G | 310 helix | trans | -51 | 133.2 | 172.8 | -22.4 | 32.7 | 0 | 0 | 0 | 111.1 | Y79 | Y79-P132 HydrophobicContact CD2-CG 4.12Å; Y79-P132 HydrophobicContact CE2-CG 4.35Å; Y79-P132 HydrophobicContact CG-CG 4.47Å |
| 133 | G | 80.3 | Confident | 88.7 | Confident | 72 Ų | 72 | 65.5 Ų | 65.5 | 74% | 0.742 | 37% | 0.368 | S | S | * | . | G | 310 helix | trans | 79.8 | 16.5 | -178.9 | 0 | 0 | 0 | 0 | 0 | 115.3 | G131 V135 | G131-G133 PolarHBondContact O-N 2.9Å; G133-V135 PolarHBondContact O-N 3.22Å |
| 134 | N | 84.1 | Confident | 88.2 | Confident | 133 Ų | 133 | 66.5 Ų | 66.5 | 71% | 0.711 | 38% | 0.378 | S | S | * | . | G | 310 helix | trans | 59.8 | 29.6 | -177.9 | -65.9 | -26.5 | 0 | 0 | 0 | 113.8 | M130 G131 | M130-N134 HydrophobicContact SD-CB 4.12Å; G131-N134 PolarHBondContact O-N 2.03Å; G131-N134 VanDerWaalsContact O-N 3.15Å |
| 135 | V | 85 | Confident | 87.9 | Confident | 49 Ų | 49 | 65.7 Ų | 65.7 | 30% | 0.297 | 37% | 0.374 | S | S | . | . | trans | -98 | 134.4 | -179.1 | -177.8 | 0 | 0 | 0 | 0 | 110.4 | G131 G133 | G131-V135 PolarHBondContact N-O 3.08Å; G133-V135 PolarHBondContact O-N 3.22Å | ||
| 136 | S | 89.9 | Confident | 87.9 | Confident | 44 Ų | 44 | 77.7 Ų | 77.7 | 31% | 0.308 | 42% | 0.419 | S | S | . | . | trans | -103.6 | 135.3 | 166.7 | 176.7 | 0 | 0 | 0 | 0 | 110.1 | R138 | S136-R138 PolarHBondContact OG-N 3.1Š| ||
| 137 | C | 91.7 | Very high | 87.8 | Confident | 5 Ų | 5 | 81.4 Ų | 81.4 | 3% | 0.034 | 44% | 0.436 | C | S | . | . | trans | -91.5 | -7.6 | -179.5 | -55.9 | 0 | 0 | 0 | 0 | 113.6 | Y79 C80 L83 S140 L141 | Y79-C137 VanDerWaalsContact CD1-SG 3.54Å; Y79-C137 VanDerWaalsContact CE1-SG 3.56Å; C80-C137 WeakPolarHBondContact CA-SG 3.12Å; C80-C137 HydrophobicContact CB-CB 3.81Å; C80-C137 WeakPolarHBondContact CB-SG 3.27Å; C80-C137 WeakPolarHBondContact SG-CA 3.39Å; C80-C137 WeakPolarHBondContact SG-CB 3.34Å; C80-C137 CovalentContact SG-SG 2.04Å; C80-C137 PolarHBondContact SG-SG 2.81Å; L83-C137 HydrophobicContact CD1-CB 4.39Å; C137-S140 WeakPolarHBondContact CA-OG 3.38Å; C137-S140 PolarHBondContact O-OG 2.9Å; C137-L141 HydrophobicContact CB-CD1 3.87Å; C137-L141 HydrophobicContact CB-CG 4.17Å; C137-L141 VanDerWaalsContact O-CB 3.27Å; C137-L141 WeakPolarHBondContact O-CB 3.05Å; C137-L141 WeakPolarHBondContact O-CG 3.42Å; C137-L141 PolarHBondContact O-N 3.46Å | ||
| 138 | R | 92.8 | Very high | 88.1 | Confident | 66 Ų | 66 | 82.6 Ų | 82.6 | 25% | 0.249 | 44% | 0.439 | C | S | . | . | H | α-helix | trans | -59.8 | -58 | -172.3 | -178.1 | -175.3 | -174.2 | 177.6 | 6.2 | 111.8 | I125 S126 D128 S136 L142 | I125-R138 WeakPolarHBondContact O-CA 3.36Å; I125-R138 PolarHBondContact O-N 3.29Å; S126-R138 VanDerWaalsContact O-CD 3.31Å; S126-R138 WeakPolarHBondContact O-CD 3.22Å; D128-R138 VanDerWaalsContact CG-NH1 3.33Å; D128-R138 WeakPolarHBondContact OD1-CD 3.32Å; D128-R138 IonicContact OD1-CZ 3.71Å; D128-R138 IonicContact OD1-NH1 2.69Å; D128-R138 PolarHBondContact OD1-NH1 3.4Å; D128-R138 IonicContact OD2-NH1 3.21Å; D128-R138 PolarHBondContact OD2-NH1 2.91Å; S136-R138 PolarHBondContact OG-N 3.1Å; R138-L142 HydrophobicContact CG-CD1 4.3Å; R138-L142 WeakPolarHBondContact O-CA 3.31Å; R138-L142 WeakPolarHBondContact O-CB 3.47Å; R138-L142 WeakPolarHBondContact O-CG 3.36Å; R138-L142 PolarHBondContact O-N 2.86Å |
| 139 | D | 90.3 | Very high | 88.5 | Confident | 93 Ų | 93 | 81 Ų | 81 | 50% | 0.497 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -76.1 | -31.4 | -175.8 | -66.7 | -33.8 | 0 | 0 | 0 | 111.6 | R143 S144 | D139-R143 CarbonylContact O-C 3.59Å; D139-R143 PolarHBondContact O-N 3.19Å; D139-R143 WeakPolarHBondContact OD1-CD 3.41Å; D139-R143 IonicContact OD1-CZ 3.88Å; D139-R143 IonicContact OD1-NH1 2.94Å; D139-R143 PolarHBondContact OD1-NH1 3.32Å; D139-S144 PolarHBondContact O-N 3.04Å |
| 140 | S | 89.5 | Confident | 89.2 | Confident | 37 Ų | 37 | 74.3 Ų | 74.3 | 26% | 0.259 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -74.2 | -29.3 | 179.7 | 60 | 0 | 0 | 0 | 0 | 114.1 | C137 S144 | C137-S140 WeakPolarHBondContact CA-OG 3.38Å; C137-S140 PolarHBondContact O-OG 2.9Å; S140-S144 WeakPolarHBondContact O-CB 3.5Å; S140-S144 PolarHBondContact O-OG 2.98Å |
| 141 | L | 91.8 | Very high | 89.8 | Confident | 14 Ų | 14 | 72 Ų | 72 | 7% | 0.073 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -103.9 | -30.8 | 179 | -61.4 | -175.2 | 0 | 0 | 0 | 114 | V76 C80 L84 I125 C137 | V76-L141 HydrophobicContact CG1-CD2 3.92Å; C80-L141 HydrophobicContact CB-CD1 4.07Å; C80-L141 HydrophobicContact CB-CD2 4.37Å; C80-L141 HydrophobicContact CB-CG 4.26Å; L84-L141 HydrophobicContact CB-CD1 4.33Å; L84-L141 HydrophobicContact CD2-CD2 4.35Å; I125-L141 HydrophobicContact CG1-CD1 4.43Å; I125-L141 HydrophobicContact CG2-CB 4.16Å; I125-L141 HydrophobicContact CG2-CD1 3.95Å; C137-L141 HydrophobicContact CB-CD1 3.87Å; C137-L141 HydrophobicContact CB-CG 4.17Å; C137-L141 VanDerWaalsContact O-CB 3.27Å; C137-L141 WeakPolarHBondContact O-CB 3.05Å; C137-L141 WeakPolarHBondContact O-CG 3.42Å; C137-L141 PolarHBondContact O-N 3.46Å |
| 142 | L | 93.8 | Very high | 90.5 | Very high | 8 Ų | 8 | 75 Ų | 75 | 4% | 0.042 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -101.3 | -20.4 | -173.8 | -50.9 | -179.1 | 0 | 0 | 0 | 113.3 | Y122 I125 R138 M148 V150 | Y122-L142 HydrophobicContact CE2-CD1 4.45Å; Y122-L142 HydrophobicContact CE2-CD2 4.01Å; I125-L142 HydrophobicContact CG2-CD1 4.23Å; I125-L142 HydrophobicContact CG2-CD2 3.9Å; I125-L142 HydrophobicContact CG2-CG 4.01Å; R138-L142 HydrophobicContact CG-CD1 4.3Å; R138-L142 WeakPolarHBondContact O-CA 3.31Å; R138-L142 WeakPolarHBondContact O-CB 3.47Å; R138-L142 WeakPolarHBondContact O-CG 3.36Å; R138-L142 PolarHBondContact O-N 2.86Å; L142-M148 WeakPolarHBondContact O-CB 3.18Å; L142-M148 WeakPolarHBondContact O-CE 3.49Å; L142-M148 WeakPolarHBondContact O-CG 3.39Å; L142-V150 HydrophobicContact CD2-CB 3.83Å; L142-V150 HydrophobicContact CD2-CG1 3.58Å |
| 143 | R | 89 | Confident | 91.3 | Very high | 136 Ų | 136 | 72.9 Ų | 72.9 | 51% | 0.513 | 38% | 0.381 | S | S | . | . | S | Bend | trans | -136.2 | 10 | -171.1 | -63.8 | 178.3 | 178.3 | 152.9 | -7 | 114.6 | D139 D145 M148 | D139-R143 CarbonylContact O-C 3.59Å; D139-R143 PolarHBondContact O-N 3.19Å; D139-R143 WeakPolarHBondContact OD1-CD 3.41Å; D139-R143 IonicContact OD1-CZ 3.88Å; D139-R143 IonicContact OD1-NH1 2.94Å; D139-R143 PolarHBondContact OD1-NH1 3.32Å; R143-D145 VanDerWaalsContact C-N 3.33Å; R143-M148 HydrophobicContact CG-CE 4.09Å |
| 144 | S | 86.4 | Confident | 92.1 | Very high | 80 Ų | 80 | 70 Ų | 70 | 56% | 0.559 | 35% | 0.348 | S | S | * | . | S | Bend | trans | -78.1 | -18.5 | -176.7 | 53.8 | 0 | 0 | 0 | 0 | 113.6 | D139 S140 | D139-S144 PolarHBondContact O-N 3.04Å; S140-S144 WeakPolarHBondContact O-CB 3.5Å; S140-S144 PolarHBondContact O-OG 2.98Å |
| 145 | D | 88.4 | Confident | 92.7 | Very high | 76 Ų | 76 | 65.4 Ų | 65.4 | 41% | 0.406 | 32% | 0.324 | S | S | . | . | S | Bend | trans | -135.6 | 165 | -178.6 | 74.4 | 73.5 | 0 | 0 | 0 | 112.2 | R143 L147 M148 | R143-D145 VanDerWaalsContact C-N 3.33Å; D145-L147 VanDerWaalsContact C-N 3.33Å; D145-L147 PolarHBondContact O-N 3.07Å; D145-L147 VanDerWaalsContact OD1-CA 3.24Å; D145-L147 WeakPolarHBondContact OD1-CA 3.31Å; D145-L147 VanDerWaalsContact OD1-CB 3.23Å; D145-L147 WeakPolarHBondContact OD1-CB 3.38Å; D145-L147 PolarHBondContact OD1-N 2.95Å; D145-M148 WeakPolarHBondContact O-CG 3.34Å; D145-M148 PolarHBondContact OD1-N 3.48Å |
| 146 | R | 92.9 | Very high | 93.3 | Very high | 251 Ų | 251 | 66.5 Ų | 66.5 | 95% | 0.947 | 33% | 0.328 | S | S | * | . | S | Bend | trans | -70.6 | -26.4 | -178.6 | -170.9 | -176.5 | 71.1 | -179.8 | -0.4 | 113.3 | ||
| 147 | L | 94.1 | Very high | 93.7 | Very high | 109 Ų | 109 | 65 Ų | 65 | 57% | 0.571 | 32% | 0.316 | S | S | * | . | S | Bend | trans | -78.2 | -34 | -178.4 | 175.4 | 64.1 | 0 | 0 | 0 | 111.2 | D145 L149 | D145-L147 VanDerWaalsContact C-N 3.33Å; D145-L147 PolarHBondContact O-N 3.07Å; D145-L147 VanDerWaalsContact OD1-CA 3.24Å; D145-L147 WeakPolarHBondContact OD1-CA 3.31Å; D145-L147 VanDerWaalsContact OD1-CB 3.23Å; D145-L147 WeakPolarHBondContact OD1-CB 3.38Å; D145-L147 PolarHBondContact OD1-N 2.95Å; L147-L149 VanDerWaalsContact C-N 3.32Å; L147-L149 HydrophobicContact CD2-CB 4.08Å; L147-L149 HydrophobicContact CD2-CD1 4.3Å; L147-L149 HydrophobicContact CG-CB 4.16Å; L147-L149 PolarHBondContact O-N 3.11Å |
| 148 | M | 94.9 | Very high | 94 | Very high | 57 Ų | 57 | 68.3 Ų | 68.3 | 28% | 0.281 | 33% | 0.331 | S | S | . | . | trans | 50.5 | 51.3 | -178.9 | -57.5 | 173 | 62.4 | 0 | 0 | 111.3 | L142 R143 D145 V150 F151 L152 | L142-M148 WeakPolarHBondContact O-CB 3.18Å; L142-M148 WeakPolarHBondContact O-CE 3.49Å; L142-M148 WeakPolarHBondContact O-CG 3.39Å; R143-M148 HydrophobicContact CG-CE 4.09Å; D145-M148 WeakPolarHBondContact O-CG 3.34Å; D145-M148 PolarHBondContact OD1-N 3.48Å; M148-V150 PolarHBondContact O-N 2.93Å; M148-F151 HydrophobicContact CB-CB 4.23Å; M148-F151 HydrophobicContact CE-CB 4.45Å; M148-F151 HydrophobicContact CE-CD1 4.03Å; M148-F151 HydrophobicContact CE-CE1 4.45Å; M148-F151 HydrophobicContact CE-CG 4.17Å; M148-F151 WeakPolarHBondContact O-CB 3.34Å; M148-F151 PolarHBondContact O-N 3.03Å; M148-L152 PolarHBondContact O-N 3.37Å | ||
| 149 | L | 94.9 | Very high | 94.2 | Very high | 81 Ų | 81 | 69.8 Ų | 69.8 | 42% | 0.424 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -58.7 | -44.5 | -164.3 | -178.6 | 60.7 | 0 | 0 | 0 | 113.3 | L147 F151 L152 L153 | L147-L149 VanDerWaalsContact C-N 3.32Å; L147-L149 HydrophobicContact CD2-CB 4.08Å; L147-L149 HydrophobicContact CD2-CD1 4.3Å; L147-L149 HydrophobicContact CG-CB 4.16Å; L147-L149 PolarHBondContact O-N 3.11Å; L149-F151 VanDerWaalsContact C-N 3.34Å; L149-F151 PolarHBondContact O-N 3.34Å; L149-L152 PolarHBondContact O-N 3Å; L149-L153 HydrophobicContact CD1-CD1 3.98Å; L149-L153 HydrophobicContact CD1-CD2 4.32Å; L149-L153 HydrophobicContact CD1-CG 3.91Å; L149-L153 HydrophobicContact CG-CD1 3.85Å; L149-L153 HydrophobicContact CG-CG 4.22Å; L149-L153 WeakPolarHBondContact O-CB 3.45Å; L149-L153 VanDerWaalsContact O-CG 3.24Å; L149-L153 WeakPolarHBondContact O-CG 3.35Å; L149-L153 PolarHBondContact O-N 2.96Å |
| 150 | V | 96.1 | Very high | 94.6 | Very high | 14 Ų | 14 | 68.8 Ų | 68.8 | 9% | 0.085 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -61 | -44.7 | -179.4 | 178.9 | 0 | 0 | 0 | 0 | 111.1 | L84 F87 Y122 L142 M148 L153 Y154 | L84-V150 HydrophobicContact CD1-CG2 3.51Å; F87-V150 HydrophobicContact CD1-CG1 4.1Å; F87-V150 HydrophobicContact CD2-CG1 4.22Å; F87-V150 HydrophobicContact CE1-CG1 3.88Å; F87-V150 HydrophobicContact CE2-CG1 4Å; F87-V150 HydrophobicContact CG-CG1 4.27Å; F87-V150 HydrophobicContact CZ-CG1 3.83Å; Y122-V150 HydrophobicContact CD2-CG1 4.45Å; Y122-V150 HydrophobicContact CE2-CG1 4.45Å; L142-V150 HydrophobicContact CD2-CB 3.83Å; L142-V150 HydrophobicContact CD2-CG1 3.58Å; M148-V150 PolarHBondContact O-N 2.93Å; V150-L153 PolarHBondContact O-N 3.36Å; V150-Y154 WeakPolarHBondContact O-CB 3.41Å; V150-Y154 PolarHBondContact O-N 2.92Å |
| 151 | F | 96.1 | Very high | 94.9 | Very high | 83 Ų | 83 | 67.2 Ų | 67.2 | 36% | 0.364 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -61.4 | -48.1 | 175.5 | 173 | -97.5 | 0 | 0 | 0 | 111.4 | Y122 M148 L149 L153 Y154 N155 | Y122-F151 VanDerWaalsContact OH-CD2 3.25Å; Y122-F151 WeakPolarHBondContact OH-CD2 3.39Å; M148-F151 HydrophobicContact CB-CB 4.23Å; M148-F151 HydrophobicContact CE-CB 4.45Å; M148-F151 HydrophobicContact CE-CD1 4.03Å; M148-F151 HydrophobicContact CE-CE1 4.45Å; M148-F151 HydrophobicContact CE-CG 4.17Å; M148-F151 WeakPolarHBondContact O-CB 3.34Å; M148-F151 PolarHBondContact O-N 3.03Å; L149-F151 VanDerWaalsContact C-N 3.34Å; L149-F151 PolarHBondContact O-N 3.34Å; F151-L153 PolarHBondContact O-N 2.92Å; F151-Y154 PolarHBondContact O-N 3.36Å; F151-N155 VanDerWaalsContact CD1-ND2 3.31Å; F151-N155 WeakPolarHBondContact CD1-ND2 3.39Å; F151-N155 WeakPolarHBondContact CE1-ND2 3.41Å; F151-N155 WeakPolarHBondContact CE2-ND2 3.13Å; F151-N155 WeakPolarHBondContact CZ-ND2 2.92Å; F151-N155 VanDerWaalsContact O-CG 3.31Å; F151-N155 PolarHBondContact O-N 3.37Å; F151-N155 PolarHBondContact O-ND2 3.37Å; F151-N155 VanDerWaalsContact O-ND2 3.16Å |
| 152 | L | 97 | Very high | 95.2 | Very high | 78 Ų | 78 | 69.3 Ų | 69.3 | 41% | 0.408 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -59.9 | -46.1 | 178.6 | 179 | 65.2 | 0 | 0 | 0 | 111.8 | M148 L149 N156 | M148-L152 PolarHBondContact O-N 3.37Å; L149-L152 PolarHBondContact O-N 3Å; L152-N156 PolarHBondContact O-N 2.9Å; L152-N156 VanDerWaalsContact O-N 3.14Å; L152-N156 PolarHBondContact O-ND2 3.05Å |
| 153 | L | 97.5 | Very high | 95.3 | Very high | 45 Ų | 45 | 72 Ų | 72 | 24% | 0.236 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -63.4 | -45.4 | -179.9 | -70.5 | 174.7 | 0 | 0 | 0 | 111.4 | F87 Y91 L149 V150 F151 N156 M157 | F87-L153 HydrophobicContact CZ-CB 4.39Å; Y91-L153 HydrophobicContact CD2-CB 4.23Å; Y91-L153 HydrophobicContact CE1-CD2 4.41Å; Y91-L153 HydrophobicContact CE2-CB 3.69Å; Y91-L153 HydrophobicContact CE2-CD2 4.26Å; Y91-L153 HydrophobicContact CE2-CG 4.41Å; Y91-L153 WeakPolarHBondContact OH-CD2 3.47Å; L149-L153 HydrophobicContact CD1-CD1 3.98Å; L149-L153 HydrophobicContact CD1-CD2 4.32Å; L149-L153 HydrophobicContact CD1-CG 3.91Å; L149-L153 HydrophobicContact CG-CD1 3.85Å; L149-L153 HydrophobicContact CG-CG 4.22Å; L149-L153 WeakPolarHBondContact O-CB 3.45Å; L149-L153 VanDerWaalsContact O-CG 3.24Å; L149-L153 WeakPolarHBondContact O-CG 3.35Å; L149-L153 PolarHBondContact O-N 2.96Å; V150-L153 PolarHBondContact O-N 3.36Å; F151-L153 PolarHBondContact O-N 2.92Å; L153-N156 PolarHBondContact O-N 2.79Å; L153-M157 WeakPolarHBondContact O-CG 3.2Å; L153-M157 PolarHBondContact O-N 3.48Å |
| 154 | Y | 98.1 | Very high | 95.7 | Very high | 11 Ų | 11 | 66.6 Ų | 66.6 | 4% | 0.043 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -62.5 | -49.2 | 177.8 | 177.5 | -97.3 | 0 | 0 | 0 | 112.3 | L118 Y122 V150 F151 N156 M157 E158 | L118-Y154 HydrophobicContact CG-CD2 4.3Å; Y122-Y154 AromaticContact CD1-CD1 3.48Å; Y122-Y154 HydrophobicContact CD1-CD1 3.48Å; Y122-Y154 VanDerWaalsContact CD1-CD1 3.48Å; Y122-Y154 AromaticContact CD1-CD2 3.8Å; Y122-Y154 HydrophobicContact CD1-CD2 3.8Å; Y122-Y154 AromaticContact CD1-CE1 3.4Å; Y122-Y154 HydrophobicContact CD1-CE1 3.4Å; Y122-Y154 AromaticContact CD1-CE2 3.75Å; Y122-Y154 HydrophobicContact CD1-CE2 3.75Å; Y122-Y154 AromaticContact CD1-CG 3.66Å; Y122-Y154 HydrophobicContact CD1-CG 3.66Å; Y122-Y154 AromaticContact CD1-CZ 3.52Å; Y122-Y154 HydrophobicContact CD2-CD1 4.01Å; Y122-Y154 AromaticContact CD2-CD2 3.78Å; Y122-Y154 HydrophobicContact CD2-CD2 3.78Å; Y122-Y154 AromaticContact CD2-CG 3.48Å; Y122-Y154 HydrophobicContact CD2-CG 3.48Å; Y122-Y154 VanDerWaalsContact CD2-CG 3.48Å; Y122-Y154 AromaticContact CE1-CD1 3.28Å; Y122-Y154 HydrophobicContact CE1-CD1 3.28Å; Y122-Y154 HydrophobicContact CE1-CD2 4.42Å; Y122-Y154 AromaticContact CE1-CE1 3.4Å; Y122-Y154 HydrophobicContact CE1-CE1 3.4Å; Y122-Y154 VanDerWaalsContact CE1-CE1 3.4Å; Y122-Y154 AromaticContact CE1-CG 3.82Å; Y122-Y154 HydrophobicContact CE1-CG 3.82Å; Y122-Y154 AromaticContact CE2-CD1 3.85Å; Y122-Y154 HydrophobicContact CE2-CD1 3.85Å; Y122-Y154 HydrophobicContact CE2-CD2 4.41Å; Y122-Y154 AromaticContact CE2-CG 3.65Å; Y122-Y154 HydrophobicContact CE2-CG 3.65Å; Y122-Y154 AromaticContact CG-CD1 3.82Å; Y122-Y154 HydrophobicContact CG-CD1 3.82Å; Y122-Y154 AromaticContact CG-CD2 3.42Å; Y122-Y154 HydrophobicContact CG-CD2 3.42Å; Y122-Y154 VanDerWaalsContact CG-CD2 3.42Å; Y122-Y154 HydrophobicContact CG-CE1 4.07Å; Y122-Y154 AromaticContact CG-CE2 3.71Å; Y122-Y154 HydrophobicContact CG-CE2 3.71Å; Y122-Y154 AromaticContact CG-CG 3.46Å; Y122-Y154 HydrophobicContact CG-CG 3.46Å; Y122-Y154 VanDerWaalsContact CG-CG 3.46Å; Y122-Y154 AromaticContact CZ-CD1 3.46Å; Y122-Y154 VanDerWaalsContact CZ-CD1 3.46Å; Y122-Y154 AromaticContact CZ-CG 3.79Å; V150-Y154 WeakPolarHBondContact O-CB 3.41Å; V150-Y154 PolarHBondContact O-N 2.92Å; F151-Y154 PolarHBondContact O-N 3.36Å; Y154-N156 VanDerWaalsContact C-N 3.27Å; Y154-N156 PolarHBondContact O-N 3.14Å; Y154-M157 WeakPolarHBondContact O-CA 3.26Å; Y154-M157 WeakPolarHBondContact O-CB 3.34Å; Y154-M157 PolarHBondContact O-N 3Å; Y154-E158 HydrophobicContact CE1-CB 4.39Å; Y154-E158 PolarHBondContact O-N 3.34Å |
| 155 | N | 97.3 | Very high | 96.2 | Very high | 37 Ų | 37 | 68 Ų | 68 | 20% | 0.198 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -61.6 | -35.8 | -178.7 | -68.4 | -29.9 | 0 | 0 | 0 | 112.4 | F151 M157 E158 D159 | F151-N155 VanDerWaalsContact CD1-ND2 3.31Å; F151-N155 WeakPolarHBondContact CD1-ND2 3.39Å; F151-N155 WeakPolarHBondContact CE1-ND2 3.41Å; F151-N155 WeakPolarHBondContact CE2-ND2 3.13Å; F151-N155 WeakPolarHBondContact CZ-ND2 2.92Å; F151-N155 VanDerWaalsContact O-CG 3.31Å; F151-N155 PolarHBondContact O-N 3.37Å; F151-N155 PolarHBondContact O-ND2 3.37Å; F151-N155 VanDerWaalsContact O-ND2 3.16Å; N155-M157 VanDerWaalsContact C-N 3.26Å; N155-M157 PolarHBondContact O-N 3.22Å; N155-E158 PolarHBondContact O-N 2.94Å; N155-D159 WeakPolarHBondContact O-CB 3.32Å; N155-D159 VanDerWaalsContact O-CG 3.26Å; N155-D159 PolarHBondContact O-N 3.44Å |
| 156 | N | 97.6 | Very high | 96.6 | Very high | 72 Ų | 72 | 64.5 Ų | 64.5 | 39% | 0.385 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -62 | -35.9 | 173.3 | -76.3 | -57.9 | 0 | 0 | 0 | 112 | L152 L153 Y154 I160 | L152-N156 PolarHBondContact O-N 2.9Å; L152-N156 VanDerWaalsContact O-N 3.14Å; L152-N156 PolarHBondContact O-ND2 3.05Å; L153-N156 PolarHBondContact O-N 2.79Å; Y154-N156 VanDerWaalsContact C-N 3.27Å; Y154-N156 PolarHBondContact O-N 3.14Å; N156-I160 WeakPolarHBondContact O-CD1 3.39Å; N156-I160 VanDerWaalsContact O-CG1 3.26Å; N156-I160 WeakPolarHBondContact O-CG1 3.14Å; N156-I160 PolarHBondContact O-N 3.28Å; N156-I160 VanDerWaalsContact O-N 3.12Å |
| 157 | M | 97.4 | Very high | 96.7 | Very high | 12 Ų | 12 | 57.2 Ų | 57.2 | 6% | 0.059 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -71.7 | -39.5 | 175.9 | -63.2 | -58 | 110.4 | 0 | 0 | 111.5 | Y91 Y94 V95 L98 L118 L153 Y154 N155 I160 W161 | Y91-M157 HydrophobicContact CD2-CG 4.01Å; Y91-M157 HydrophobicContact CE2-CE 3.86Å; Y91-M157 HydrophobicContact CE2-CG 3.53Å; Y91-M157 HydrophobicContact CE2-SD 3.92Å; Y91-M157 WeakPolarHBondContact OH-CE 2.98Å; Y94-M157 HydrophobicContact CD1-CB 4.16Å; Y94-M157 HydrophobicContact CD1-CG 3.94Å; Y94-M157 HydrophobicContact CD1-SD 3.58Å; Y94-M157 VanDerWaalsContact CD1-SD 3.58Å; Y94-M157 HydrophobicContact CE1-CB 3.79Å; Y94-M157 HydrophobicContact CE1-CG 3.99Å; Y94-M157 HydrophobicContact CE1-SD 3.6Å; Y94-M157 VanDerWaalsContact CE1-SD 3.6Å; V95-M157 HydrophobicContact CG2-CE 4.25Å; V95-M157 HydrophobicContact CG2-SD 3.87Å; L98-M157 HydrophobicContact CD1-SD 4.14Å; L118-M157 HydrophobicContact CD2-CB 3.99Å; L118-M157 HydrophobicContact CD2-CG 3.88Å; L153-M157 WeakPolarHBondContact O-CG 3.2Å; L153-M157 PolarHBondContact O-N 3.48Å; Y154-M157 WeakPolarHBondContact O-CA 3.26Å; Y154-M157 WeakPolarHBondContact O-CB 3.34Å; Y154-M157 PolarHBondContact O-N 3Å; N155-M157 VanDerWaalsContact C-N 3.26Å; N155-M157 PolarHBondContact O-N 3.22Å; M157-I160 HydrophobicContact CE-CD1 3.98Å; M157-I160 PolarHBondContact O-N 3.48Å; M157-I160 HydrophobicContact SD-CD1 4.42Å; M157-W161 WeakPolarHBondContact O-CB 3.2Å; M157-W161 PolarHBondContact O-N 3.26Å |
| 158 | E | 97.6 | Very high | 96.8 | Very high | 74 Ų | 74 | 53.4 Ų | 53.4 | 35% | 0.346 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -60.3 | -47.2 | 172.6 | -175.4 | 174 | -151.3 | 0 | 0 | 110.9 | Y154 N155 I160 W161 T162 | Y154-E158 HydrophobicContact CE1-CB 4.39Å; Y154-E158 PolarHBondContact O-N 3.34Å; N155-E158 PolarHBondContact O-N 2.94Å; E158-I160 VanDerWaalsContact C-N 3.32Å; E158-I160 PolarHBondContact O-N 3.37Å; E158-W161 WeakPolarHBondContact O-CA 3.31Å; E158-W161 WeakPolarHBondContact O-CB 3.25Å; E158-W161 PolarHBondContact O-N 3.12Å; E158-T162 HydrophobicContact CG-CG2 4.28Å; E158-T162 PolarHBondContact O-N 3.37Å; E158-T162 PolarHBondContact O-OG1 2.81Å |
| 159 | D | 98 | Very high | 96.8 | Very high | 98 Ų | 98 | 50.7 Ų | 50.7 | 52% | 0.524 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -59.4 | -40.3 | 177.7 | -76.5 | -22.8 | 0 | 0 | 0 | 112.3 | N155 T162 G163 | N155-D159 WeakPolarHBondContact O-CB 3.32Å; N155-D159 VanDerWaalsContact O-CG 3.26Å; N155-D159 PolarHBondContact O-N 3.44Å; D159-T162 PolarHBondContact O-OG1 2.87Å; D159-G163 WeakPolarHBondContact O-CA 3.26Å; D159-G163 PolarHBondContact O-N 3.16Å |
| 160 | I | 97.4 | Very high | 96.8 | Very high | 72 Ų | 72 | 47.1 Ų | 47.1 | 37% | 0.369 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -63.6 | -45.1 | 174.3 | -70.6 | 164.9 | 0 | 0 | 0 | 110.1 | L98 N156 M157 E158 S164 | L98-I160 HydrophobicContact CD1-CD1 4.34Å; L98-I160 HydrophobicContact CD1-CG2 4.24Å; L98-I160 HydrophobicContact CD2-CG2 4.48Å; N156-I160 WeakPolarHBondContact O-CD1 3.39Å; N156-I160 VanDerWaalsContact O-CG1 3.26Å; N156-I160 WeakPolarHBondContact O-CG1 3.14Å; N156-I160 PolarHBondContact O-N 3.28Å; N156-I160 VanDerWaalsContact O-N 3.12Å; M157-I160 HydrophobicContact CE-CD1 3.98Å; M157-I160 PolarHBondContact O-N 3.48Å; M157-I160 HydrophobicContact SD-CD1 4.42Å; E158-I160 VanDerWaalsContact C-N 3.32Å; E158-I160 PolarHBondContact O-N 3.37Å; I160-S164 WeakPolarHBondContact O-CB 3.38Å; I160-S164 PolarHBondContact O-N 2.9Å; I160-S164 PolarHBondContact O-OG 2.8Å |
| 161 | W | 97.5 | Very high | 96.6 | Very high | 4 Ų | 4 | 48 Ų | 48 | 2% | 0.015 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -63.5 | -50.1 | -179.2 | -179.5 | -92.9 | 0 | 0 | 0 | 112.2 | Y115 M157 E158 S164 E165 C166 N167 V170 L174 | Y115-W161 AromaticContact CD1-CD2 3.43Å; Y115-W161 HydrophobicContact CD1-CD2 3.43Å; Y115-W161 VanDerWaalsContact CD1-CD2 3.43Å; Y115-W161 AromaticContact CD1-CE2 3.66Å; Y115-W161 AromaticContact CD1-CE3 3.59Å; Y115-W161 HydrophobicContact CD1-CE3 3.59Å; Y115-W161 AromaticContact CD1-CG 3.92Å; Y115-W161 HydrophobicContact CD1-CG 3.92Å; Y115-W161 HydrophobicContact CD1-CH2 4.2Å; Y115-W161 HydrophobicContact CD1-CZ2 4.07Å; Y115-W161 AromaticContact CD1-CZ3 3.98Å; Y115-W161 HydrophobicContact CD1-CZ3 3.98Å; Y115-W161 HydrophobicContact CD2-CB 4.2Å; Y115-W161 HydrophobicContact CD2-CD2 4.19Å; Y115-W161 HydrophobicContact CD2-CE3 4.01Å; Y115-W161 HydrophobicContact CD2-CG 4.29Å; Y115-W161 HydrophobicContact CE1-CB 4.15Å; Y115-W161 AromaticContact CE1-CD1 3.56Å; Y115-W161 AromaticContact CE1-CD2 3.48Å; Y115-W161 HydrophobicContact CE1-CD2 3.48Å; Y115-W161 VanDerWaalsContact CE1-CD2 3.48Å; Y115-W161 AromaticContact CE1-CE2 3.67Å; Y115-W161 HydrophobicContact CE1-CE3 4.12Å; Y115-W161 AromaticContact CE1-CG 3.46Å; Y115-W161 HydrophobicContact CE1-CG 3.46Å; Y115-W161 VanDerWaalsContact CE1-CG 3.46Å; Y115-W161 HydrophobicContact CE1-CZ2 4.45Å; Y115-W161 AromaticContact CE1-NE1 3.67Å; Y115-W161 HydrophobicContact CE2-CB 3.62Å; Y115-W161 HydrophobicContact CE2-CD2 4.22Å; Y115-W161 HydrophobicContact CE2-CE3 4.47Å; Y115-W161 AromaticContact CE2-CG 3.86Å; Y115-W161 HydrophobicContact CE2-CG 3.86Å; Y115-W161 AromaticContact CG-CD2 3.81Å; Y115-W161 HydrophobicContact CG-CD2 3.81Å; Y115-W161 AromaticContact CG-CE3 3.54Å; Y115-W161 HydrophobicContact CG-CE3 3.54Å; Y115-W161 HydrophobicContact CG-CG 4.31Å; Y115-W161 AromaticContact CG-CZ3 3.98Å; Y115-W161 HydrophobicContact CG-CZ3 3.98Å; Y115-W161 AromaticContact CZ-CD1 3.71Å; Y115-W161 AromaticContact CZ-CD2 3.89Å; Y115-W161 AromaticContact CZ-CG 3.42Å; Y115-W161 VanDerWaalsContact CZ-CG 3.42Å; M157-W161 WeakPolarHBondContact O-CB 3.2Å; M157-W161 PolarHBondContact O-N 3.26Å; E158-W161 WeakPolarHBondContact O-CA 3.31Å; E158-W161 WeakPolarHBondContact O-CB 3.25Å; E158-W161 PolarHBondContact O-N 3.12Å; W161-S164 PolarHBondContact O-N 3.03Å; W161-E165 PolarHBondContact O-N 2.68Å; W161-C166 HydrophobicContact CD2-CB 3.67Å; W161-C166 HydrophobicContact CE3-CB 3.83Å; W161-C166 HydrophobicContact CG-CB 4.34Å; W161-C166 HydrophobicContact CH2-CB 3.68Å; W161-C166 HydrophobicContact CZ2-CB 3.49Å; W161-C166 VanDerWaalsContact CZ2-CB 3.49Å; W161-C166 HydrophobicContact CZ3-CB 3.85Å; W161-C166 PolarHBondContact O-N 3.4Å; W161-N167 PolarHBondContact NE1-OD1 3.35Å; W161-V170 HydrophobicContact CH2-CG2 4.05Å; W161-V170 HydrophobicContact CZ2-CG2 4.36Å; W161-L174 HydrophobicContact CH2-CD2 3.68Å; W161-L174 HydrophobicContact CZ2-CD2 3.27Å |
| 162 | T | 97.1 | Very high | 96 | Very high | 58 Ų | 58 | 52.7 Ų | 52.7 | 36% | 0.356 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -71.1 | -42.1 | -179.7 | 56 | 0 | 0 | 0 | 0 | 111.5 | E158 D159 S164 E165 | E158-T162 HydrophobicContact CG-CG2 4.28Å; E158-T162 PolarHBondContact O-N 3.37Å; E158-T162 PolarHBondContact O-OG1 2.81Å; D159-T162 PolarHBondContact O-OG1 2.87Å; T162-S164 PolarHBondContact O-N 3.05Å; T162-E165 PolarHBondContact O-N 3.41Å |
| 163 | G | 96.9 | Very high | 95.1 | Very high | 65 Ų | 65 | 50.8 Ų | 50.8 | 67% | 0.67 | 30% | 0.296 | S | S | * | . | H | α-helix | trans | -65.5 | -22.7 | 177 | 0 | 0 | 0 | 0 | 0 | 113.7 | D159 E165 | D159-G163 WeakPolarHBondContact O-CA 3.26Å; D159-G163 PolarHBondContact O-N 3.16Å; G163-E165 VanDerWaalsContact C-N 3.32Å |
| 164 | S | 96.9 | Very high | 94.6 | Very high | 21 Ų | 21 | 49.5 Ų | 49.5 | 15% | 0.147 | 29% | 0.289 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -86 | -2.2 | 173.1 | -63.2 | 0 | 0 | 0 | 0 | 113.7 | I160 W161 T162 C166 I232 | I160-S164 WeakPolarHBondContact O-CB 3.38Å; I160-S164 PolarHBondContact O-N 2.9Å; I160-S164 PolarHBondContact O-OG 2.8Å; W161-S164 PolarHBondContact O-N 3.03Å; T162-S164 PolarHBondContact O-N 3.05Å; S164-C166 PolarHBondContact O-N 3.43Å; S164-I232 PolarHBondContact O-N 3.48Å |
| 165 | E | 97.2 | Very high | 94 | Very high | 110 Ų | 110 | 55.8 Ų | 55.8 | 51% | 0.514 | 32% | 0.318 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 52.4 | 33.8 | -175.2 | -65.3 | -70.5 | 175.2 | 0 | 0 | 112.8 | W161 T162 G163 N167 S168 C231 | W161-E165 PolarHBondContact O-N 2.68Å; T162-E165 PolarHBondContact O-N 3.41Å; G163-E165 VanDerWaalsContact C-N 3.32Å; E165-N167 PolarHBondContact O-N 2.68Å; E165-N167 VanDerWaalsContact O-N 3.13Å; E165-S168 WeakPolarHBondContact O-CB 3.41Å; E165-S168 PolarHBondContact O-N 2.83Å; E165-C231 VanDerWaalsContact O-CB 3.31Å; E165-C231 WeakPolarHBondContact O-CB 3.48Å |
| 166 | C | 96.8 | Very high | 93.7 | Very high | 2 Ų | 2 | 56.7 Ų | 56.7 | 1% | 0.014 | 33% | 0.328 | C | S | . | . | G | 310 helix | trans | -62.6 | -24.8 | -175 | -71.8 | 0 | 0 | 0 | 0 | 113.4 | C108 W161 S164 S168 C169 V170 | C108-C166 WeakPolarHBondContact CA-SG 3.31Å; C108-C166 HydrophobicContact CB-CB 3.71Å; C108-C166 WeakPolarHBondContact CB-SG 3.4Å; C108-C166 WeakPolarHBondContact SG-CA 3.24Å; C108-C166 WeakPolarHBondContact SG-CB 3.5Å; C108-C166 CovalentContact SG-SG 2.04Å; C108-C166 PolarHBondContact SG-SG 3.19Å; W161-C166 HydrophobicContact CD2-CB 3.67Å; W161-C166 HydrophobicContact CE3-CB 3.83Å; W161-C166 HydrophobicContact CG-CB 4.34Å; W161-C166 HydrophobicContact CH2-CB 3.68Å; W161-C166 HydrophobicContact CZ2-CB 3.49Å; W161-C166 VanDerWaalsContact CZ2-CB 3.49Å; W161-C166 HydrophobicContact CZ3-CB 3.85Å; W161-C166 PolarHBondContact O-N 3.4Å; S164-C166 PolarHBondContact O-N 3.43Å; C166-S168 PolarHBondContact O-N 2.84Å; C166-C169 PolarHBondContact O-N 3.04Å; C166-V170 PolarHBondContact O-N 3.36Å; C166-V170 VanDerWaalsContact O-N 3.1Å |
| 167 | N | 95.3 | Very high | 93.6 | Very high | 99 Ų | 99 | 54.7 Ų | 54.7 | 53% | 0.529 | 32% | 0.317 | S | S | . | . | G | 310 helix | trans | -59.8 | -24 | 173.6 | -68 | -28.5 | 0 | 0 | 0 | 113.4 | W161 E165 C169 | W161-N167 PolarHBondContact NE1-OD1 3.35Å; E165-N167 PolarHBondContact O-N 2.68Å; E165-N167 VanDerWaalsContact O-N 3.13Å; N167-C169 VanDerWaalsContact C-N 3.33Å |
| 168 | S | 95.1 | Very high | 93.5 | Very high | 29 Ų | 29 | 55.8 Ų | 55.8 | 20% | 0.203 | 32% | 0.324 | C | S | . | . | G | 310 helix | trans | -74.5 | -24.8 | 174.6 | -68.1 | 0 | 0 | 0 | 0 | 113 | E165 C166 T178 L230 | E165-S168 WeakPolarHBondContact O-CB 3.41Å; E165-S168 PolarHBondContact O-N 2.83Å; C166-S168 PolarHBondContact O-N 2.84Å; S168-T178 PolarHBondContact O-OG1 3.31Å; S168-L230 WeakPolarHBondContact CB-O 3.34Å |
| 169 | C | 94.6 | Very high | 93.3 | Very high | 0 Ų | 0 | 58.7 Ų | 58.7 | 0% | 0 | 34% | 0.342 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -103.2 | -16.8 | -174.2 | -78.7 | 0 | 0 | 0 | 0 | 114.3 | C108 C166 N167 L177 T178 T181 C231 I234 | C108-C169 HydrophobicContact CB-CB 4.47Å; C166-C169 PolarHBondContact O-N 3.04Å; N167-C169 VanDerWaalsContact C-N 3.33Å; C169-L177 WeakPolarHBondContact O-CA 3.38Å; C169-T178 PolarHBondContact O-N 2.04Å; C169-T178 PolarHBondContact O-OG1 3.19Å; C169-T181 VanDerWaalsContact CA-OG1 3.3Å; C169-T181 WeakPolarHBondContact CA-OG1 3.49Å; C169-T181 HydrophobicContact CB-CG2 4.21Å; C169-T181 PolarHBondContact O-OG1 2.8Å; C169-C231 HydrophobicContact CB-CB 3.75Å; C169-C231 WeakPolarHBondContact CB-SG 3.4Å; C169-C231 WeakPolarHBondContact SG-CB 3.45Å; C169-C231 CovalentContact SG-SG 2.01Å; C169-C231 PolarHBondContact SG-SG 2.93Å; C169-I234 VanDerWaalsContact SG-CD1 3.55Å |
| 170 | V | 95.3 | Very high | 93.1 | Very high | 6 Ų | 6 | 57.6 Ų | 57.6 | 4% | 0.036 | 34% | 0.337 | C | S | . | . | B | Isolated β-bridge | trans | -116.3 | 143.7 | -177.4 | -171.2 | 0 | 0 | 0 | 0 | 109.7 | Y112 W161 C166 L174 S176 L177 | Y112-V170 HydrophobicContact CD2-CG1 4.22Å; Y112-V170 HydrophobicContact CG-CG1 4.12Å; Y112-V170 HydrophobicContact CG-CG2 4.43Å; W161-V170 HydrophobicContact CH2-CG2 4.05Å; W161-V170 HydrophobicContact CZ2-CG2 4.36Å; C166-V170 PolarHBondContact O-N 3.36Å; C166-V170 VanDerWaalsContact O-N 3.1Å; V170-L174 HydrophobicContact CB-CD2 4.37Å; V170-L174 HydrophobicContact CG1-CD2 3.84Å; V170-S176 WeakPolarHBondContact CG1-O 3.49Å; V170-L177 HydrophobicContact CG2-CD2 4.24Å |
| 171 | S | 91.4 | Very high | 93.1 | Very high | 33 Ų | 33 | 54.2 Ų | 54.2 | 23% | 0.231 | 32% | 0.319 | C | S | . | . | trans | -68.2 | 158.9 | 178.1 | 62.1 | 0 | 0 | 0 | 0 | 111.9 | G173 L174 S176 | S171-G173 PolarHBondContact O-N 3.16Å; S171-L174 PolarHBondContact O-N 2.01Å; S171-S176 WeakPolarHBondContact CB-O 3.48Å; S171-S176 PolarHBondContact N-O 3.42Å; S171-S176 PolarHBondContact OG-N 2.77Å; S171-S176 PolarHBondContact OG-O 3.2Å; S171-S176 PolarHBondContact OG-OG 2.88Å | ||
| 172 | L | 84 | Confident | 93 | Very high | 180 Ų | 180 | 58.2 Ų | 58.2 | 94% | 0.942 | 34% | 0.34 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.5 | 127 | 173.6 | -161.3 | 94 | 0 | 0 | 0 | 109.3 | ||
| 173 | G | 78.6 | Confident | 93 | Very high | 38 Ų | 38 | 62.4 Ų | 62.4 | 39% | 0.392 | 35% | 0.351 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 88.3 | 10.2 | -175.2 | 0 | 0 | 0 | 0 | 0 | 114.8 | S171 H175 | S171-G173 PolarHBondContact O-N 3.16Å; G173-H175 PolarHBondContact O-CD2 3.01Å; G173-H175 PolarHBondContact O-CE1 3.13Å; G173-H175 VanDerWaalsContact O-CG 3.28Å; G173-H175 PolarHBondContact O-N 2.99Å; G173-H175 PolarHBondContact O-ND1 2.04Å; G173-H175 VanDerWaalsContact O-ND1 3.15Å; G173-H175 PolarHBondContact O-NE2 2.98Å |
| 174 | L | 86.2 | Confident | 93 | Very high | 18 Ų | 18 | 59.3 Ų | 59.3 | 9% | 0.094 | 32% | 0.319 | C | S | . | . | S | Bend | trans | 55.9 | 33 | 168.5 | -59.2 | 170 | 0 | 0 | 0 | 114 | Y112 Y115 D116 W161 V170 S171 | Y112-L174 WeakPolarHBondContact CD2-O 3.31Å; Y112-L174 VanDerWaalsContact CE2-O 3.24Å; Y112-L174 WeakPolarHBondContact CE2-O 2.95Å; Y115-L174 HydrophobicContact CD1-CD1 3.81Å; Y115-L174 HydrophobicContact CE1-CD1 4.3Å; D116-L174 HydrophobicContact CB-CB 3.81Å; D116-L174 HydrophobicContact CB-CD1 3.68Å; D116-L174 HydrophobicContact CB-CG 4.38Å; D116-L174 WeakPolarHBondContact OD1-CD1 3.09Å; W161-L174 HydrophobicContact CH2-CD2 3.68Å; W161-L174 HydrophobicContact CZ2-CD2 3.27Å; V170-L174 HydrophobicContact CB-CD2 4.37Å; V170-L174 HydrophobicContact CG1-CD2 3.84Å; S171-L174 PolarHBondContact O-N 2.01Å |
| 175 | H | 85.6 | Confident | 93 | Very high | 143 Ų | 143 | 59.5 Ų | 59.5 | 66% | 0.662 | 32% | 0.318 | S | S | * | . | S | Bend | trans | -97.9 | -27.4 | -178.1 | -64.4 | -39.4 | 0 | 0 | 0 | 113.4 | Y112 G173 | Y112-H175 PolarHBondContact OH-O 3.25Å; G173-H175 PolarHBondContact O-CD2 3.01Å; G173-H175 PolarHBondContact O-CE1 3.13Å; G173-H175 VanDerWaalsContact O-CG 3.28Å; G173-H175 PolarHBondContact O-N 2.99Å; G173-H175 PolarHBondContact O-ND1 2.04Å; G173-H175 VanDerWaalsContact O-ND1 3.15Å; G173-H175 PolarHBondContact O-NE2 2.98Å |
| 176 | S | 91.9 | Very high | 93 | Very high | 56 Ų | 56 | 57 Ų | 57 | 39% | 0.392 | 32% | 0.316 | S | S | . | . | S | Bend | trans | -155.7 | 164.6 | -173.4 | 61.9 | 0 | 0 | 0 | 0 | 112.8 | V170 S171 | V170-S176 WeakPolarHBondContact CG1-O 3.49Å; S171-S176 WeakPolarHBondContact CB-O 3.48Å; S171-S176 PolarHBondContact N-O 3.42Å; S171-S176 PolarHBondContact OG-N 2.77Å; S171-S176 PolarHBondContact OG-O 3.2Å; S171-S176 PolarHBondContact OG-OG 2.88Å |
| 177 | L | 94.3 | Very high | 93.1 | Very high | 30 Ų | 30 | 57.7 Ų | 57.7 | 16% | 0.157 | 32% | 0.32 | C | S | . | . | B | Isolated β-bridge | trans | -75 | 151.1 | 170.5 | -59.1 | 177.4 | 0 | 0 | 0 | 111.2 | Q109 Y112 C169 V170 T181 L182 | Q109-L177 HydrophobicContact CB-CD1 4.43Å; Q109-L177 HydrophobicContact CB-CD2 4.33Å; Q109-L177 HydrophobicContact CG-CD1 3.9Å; Q109-L177 HydrophobicContact CG-CD2 3.9Å; Y112-L177 HydrophobicContact CD1-CD2 4.47Å; Y112-L177 HydrophobicContact CE1-CD2 4.47Å; C169-L177 WeakPolarHBondContact O-CA 3.38Å; V170-L177 HydrophobicContact CG2-CD2 4.24Å; L177-T181 HydrophobicContact CB-CG2 4.47Å; L177-T181 HydrophobicContact CD1-CG2 4.46Å; L177-L182 HydrophobicContact CB-CD2 3.95Å; L177-L182 HydrophobicContact CB-CG 3.93Å; L177-L182 HydrophobicContact CD1-CD2 3.86Å; L177-L182 HydrophobicContact CG-CD2 4.47Å |
| 178 | T | 95.3 | Very high | 93.2 | Very high | 36 Ų | 36 | 53.5 Ų | 53.5 | 22% | 0.221 | 30% | 0.297 | C | S | . | . | trans | -66.5 | 150.8 | 173.6 | 59.9 | 0 | 0 | 0 | 0 | 111 | S168 C169 D180 T181 L182 | S168-T178 PolarHBondContact O-OG1 3.31Å; C169-T178 PolarHBondContact O-N 2.04Å; C169-T178 PolarHBondContact O-OG1 3.19Å; T178-D180 PolarHBondContact O-N 3.1Å; T178-T181 WeakPolarHBondContact O-CB 3.09Å; T178-T181 PolarHBondContact O-N 2.75Å; T178-T181 VanDerWaalsContact O-N 3.08Å; T178-T181 WeakPolarHBondContact OG1-CB 3.36Å; T178-T181 PolarHBondContact OG1-N 3.27Å; T178-T181 PolarHBondContact OG1-OG1 2.84Å; T178-L182 PolarHBondContact O-N 3Å | ||
| 179 | N | 94.7 | Very high | 93.3 | Very high | 134 Ų | 134 | 56 Ų | 56 | 72% | 0.717 | 31% | 0.309 | S | S | * | . | H | α-helix | trans | -56.2 | -38.1 | 177.8 | -72.7 | -24.8 | 0 | 0 | 0 | 111.9 | L182 Y183 | N179-L182 PolarHBondContact O-N 3.15Å; N179-Y183 VanDerWaalsContact O-CB 3.29Å; N179-Y183 WeakPolarHBondContact O-CB 3.47Å; N179-Y183 PolarHBondContact O-N 3.03Å |
| 180 | D | 93.9 | Very high | 93.4 | Very high | 76 Ų | 76 | 61.6 Ų | 61.6 | 41% | 0.406 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -63.2 | -43.5 | 177 | -73.8 | -4.1 | 0 | 0 | 0 | 111.7 | T178 Y183 F184 M224 | T178-D180 PolarHBondContact O-N 3.1Å; D180-Y183 PolarHBondContact O-N 3.34Å; D180-F184 WeakPolarHBondContact O-CB 3.46Å; D180-F184 PolarHBondContact O-N 3.43Å; D180-M224 HydrophobicContact CB-CE 4.06Å |
| 181 | T | 95.9 | Very high | 93.5 | Very high | 0 Ų | 0 | 61.3 Ų | 61.3 | 0% | 0 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -63 | -47.2 | 176.2 | -57.2 | 0 | 0 | 0 | 0 | 111 | C169 L177 T178 Y183 F184 M185 I234 | C169-T181 VanDerWaalsContact CA-OG1 3.3Å; C169-T181 WeakPolarHBondContact CA-OG1 3.49Å; C169-T181 HydrophobicContact CB-CG2 4.21Å; C169-T181 PolarHBondContact O-OG1 2.8Å; L177-T181 HydrophobicContact CB-CG2 4.47Å; L177-T181 HydrophobicContact CD1-CG2 4.46Å; T178-T181 WeakPolarHBondContact O-CB 3.09Å; T178-T181 PolarHBondContact O-N 2.75Å; T178-T181 VanDerWaalsContact O-N 3.08Å; T178-T181 WeakPolarHBondContact OG1-CB 3.36Å; T178-T181 PolarHBondContact OG1-N 3.27Å; T178-T181 PolarHBondContact OG1-OG1 2.84Å; T181-Y183 VanDerWaalsContact C-N 3.31Å; T181-Y183 PolarHBondContact O-N 2.86Å; T181-F184 PolarHBondContact O-N 3.08Å; T181-M185 HydrophobicContact CG2-CE 4.35Å; T181-M185 HydrophobicContact CG2-CG 4.43Å; T181-M185 VanDerWaalsContact O-CG 3.26Å; T181-M185 WeakPolarHBondContact O-CG 3.35Å; T181-M185 PolarHBondContact O-N 3.2Å; T181-I234 HydrophobicContact CG2-CD1 4.41Å |
| 182 | L | 96.1 | Very high | 93.8 | Very high | 88 Ų | 88 | 62.1 Ų | 62.1 | 46% | 0.461 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -60.1 | -42.5 | 177 | -68.9 | 173.9 | 0 | 0 | 0 | 111.7 | L177 T178 N179 M185 A186 | L177-L182 HydrophobicContact CB-CD2 3.95Å; L177-L182 HydrophobicContact CB-CG 3.93Å; L177-L182 HydrophobicContact CD1-CD2 3.86Å; L177-L182 HydrophobicContact CG-CD2 4.47Å; T178-L182 PolarHBondContact O-N 3Å; N179-L182 PolarHBondContact O-N 3.15Å; L182-M185 PolarHBondContact O-N 3.15Å; L182-A186 WeakPolarHBondContact O-CB 3.01Å; L182-A186 PolarHBondContact O-N 3.37Å |
| 183 | Y | 96.8 | Very high | 94.4 | Very high | 147 Ų | 147 | 62 Ų | 62 | 58% | 0.576 | 32% | 0.322 | S | S | * | . | H | α-helix | trans | -65.3 | -41.8 | 177.4 | -177.5 | -111.4 | 0 | 0 | 0 | 112.3 | N179 D180 T181 A186 T187 L220 | N179-Y183 VanDerWaalsContact O-CB 3.29Å; N179-Y183 WeakPolarHBondContact O-CB 3.47Å; N179-Y183 PolarHBondContact O-N 3.03Å; D180-Y183 PolarHBondContact O-N 3.34Å; T181-Y183 VanDerWaalsContact C-N 3.31Å; T181-Y183 PolarHBondContact O-N 2.86Å; Y183-A186 PolarHBondContact O-N 3.45Å; Y183-T187 WeakPolarHBondContact O-CB 3.33Å; Y183-T187 PolarHBondContact O-N 3.42Å; Y183-T187 PolarHBondContact O-OG1 2.75Å; Y183-L220 HydrophobicContact CD1-CD1 3.81Å; Y183-L220 HydrophobicContact CD1-CD2 3.57Å; Y183-L220 HydrophobicContact CD1-CG 4.35Å; Y183-L220 HydrophobicContact CE1-CD1 3.75Å; Y183-L220 HydrophobicContact CE1-CD2 3.61Å; Y183-L220 HydrophobicContact CE1-CG 4.28Å |
| 184 | F | 97.8 | Very high | 95.2 | Very high | 0 Ų | 0 | 61.3 Ų | 61.3 | 0% | 0 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -60.3 | -49.5 | 173.1 | 178.6 | -89 | 0 | 0 | 0 | 111.5 | D180 T181 A186 T187 L188 L217 L220 Y221 M224 I234 S237 M238 | D180-F184 WeakPolarHBondContact O-CB 3.46Å; D180-F184 PolarHBondContact O-N 3.43Å; T181-F184 PolarHBondContact O-N 3.08Å; F184-A186 VanDerWaalsContact C-N 3.32Å; F184-A186 PolarHBondContact O-N 3.24Å; F184-T187 PolarHBondContact O-N 3.35Å; F184-T187 VanDerWaalsContact O-N 3.15Å; F184-L188 HydrophobicContact CE1-CB 4.33Å; F184-L188 HydrophobicContact CE1-CD2 4.16Å; F184-L188 WeakPolarHBondContact O-CB 3.34Å; F184-L188 PolarHBondContact O-N 3.06Å; F184-L217 HydrophobicContact CD2-CD1 4.02Å; F184-L217 HydrophobicContact CE2-CD1 3.57Å; F184-L217 HydrophobicContact CZ-CD1 3.96Å; F184-L220 HydrophobicContact CB-CD2 4.18Å; F184-L220 HydrophobicContact CD2-CD2 4.11Å; F184-L220 HydrophobicContact CD2-CG 4.31Å; F184-Y221 HydrophobicContact CE2-CD2 4.14Å; F184-M224 HydrophobicContact CB-CE 4.42Å; F184-M224 HydrophobicContact CB-SD 3.91Å; F184-M224 HydrophobicContact CD2-SD 3.95Å; F184-M224 HydrophobicContact CG-SD 4.23Å; F184-I234 HydrophobicContact CD1-CB 4.44Å; F184-I234 HydrophobicContact CD1-CD1 4.4Å; F184-I234 HydrophobicContact CD1-CG1 3.98Å; F184-I234 HydrophobicContact CD1-CG2 4.03Å; F184-I234 HydrophobicContact CD2-CG2 4.12Å; F184-I234 HydrophobicContact CE1-CB 4.26Å; F184-I234 HydrophobicContact CE1-CG1 4.24Å; F184-I234 HydrophobicContact CE1-CG2 3.77Å; F184-I234 HydrophobicContact CE2-CG2 3.86Å; F184-I234 HydrophobicContact CG-CD1 4.46Å; F184-I234 HydrophobicContact CG-CG1 4.48Å; F184-I234 HydrophobicContact CG-CG2 4.2Å; F184-I234 HydrophobicContact CZ-CG2 3.69Å; F184-S237 WeakPolarHBondContact CE1-OG 3.41Å; F184-M238 HydrophobicContact CZ-CB 4.29Å |
| 185 | M | 96.7 | Very high | 95.6 | Very high | 25 Ų | 25 | 60.7 Ų | 60.7 | 12% | 0.123 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -62.8 | -37.5 | -179.7 | -66.8 | -60.8 | 162.2 | 0 | 0 | 112.2 | Q109 T181 L182 L188 N189 I234 | Q109-M185 VanDerWaalsContact CD-CE 3.49Å; T181-M185 HydrophobicContact CG2-CE 4.35Å; T181-M185 HydrophobicContact CG2-CG 4.43Å; T181-M185 VanDerWaalsContact O-CG 3.26Å; T181-M185 WeakPolarHBondContact O-CG 3.35Å; T181-M185 PolarHBondContact O-N 3.2Å; L182-M185 PolarHBondContact O-N 3.15Å; M185-L188 HydrophobicContact SD-CD2 4.17Å; M185-N189 WeakPolarHBondContact O-CB 3.45Å; M185-N189 VanDerWaalsContact O-CG 3.27Å; M185-N189 PolarHBondContact O-N 3.27Å; M185-N189 PolarHBondContact O-ND2 3.29Å; M185-I234 HydrophobicContact CE-CG1 3.98Å |
| 186 | A | 97.5 | Very high | 96 | Very high | 57 Ų | 57 | 59.8 Ų | 59.8 | 47% | 0.471 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -62.9 | -45.5 | 173.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | L182 Y183 F184 N189 Q190 | L182-A186 WeakPolarHBondContact O-CB 3.01Å; L182-A186 PolarHBondContact O-N 3.37Å; Y183-A186 PolarHBondContact O-N 3.45Å; F184-A186 VanDerWaalsContact C-N 3.32Å; F184-A186 PolarHBondContact O-N 3.24Å; A186-N189 PolarHBondContact O-N 2.95Å; A186-Q190 PolarHBondContact O-N 2.74Å |
| 187 | T | 97.8 | Very high | 96.1 | Very high | 17 Ų | 17 | 64.8 Ų | 64.8 | 10% | 0.104 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -66.7 | -38.8 | 178.7 | -53.7 | 0 | 0 | 0 | 0 | 111.9 | Y183 F184 Q190 S191 L217 L220 | Y183-T187 WeakPolarHBondContact O-CB 3.33Å; Y183-T187 PolarHBondContact O-N 3.42Å; Y183-T187 PolarHBondContact O-OG1 2.75Å; F184-T187 PolarHBondContact O-N 3.35Å; F184-T187 VanDerWaalsContact O-N 3.15Å; T187-Q190 PolarHBondContact O-N 3.49Å; T187-S191 PolarHBondContact O-N 3.45Å; T187-S191 PolarHBondContact O-OG 3.46Å; T187-L217 HydrophobicContact CG2-CB 4.1Å; T187-L217 HydrophobicContact CG2-CD1 4.04Å; T187-L220 HydrophobicContact CG2-CD2 4.38Å |
| 188 | L | 97.8 | Very high | 95.9 | Very high | 11 Ų | 11 | 66 Ų | 66 | 6% | 0.058 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -61.9 | -51.3 | 173.4 | 174.6 | 66.5 | 0 | 0 | 0 | 110.6 | F184 M185 Q190 S191 L192 L217 T241 | F184-L188 HydrophobicContact CE1-CB 4.33Å; F184-L188 HydrophobicContact CE1-CD2 4.16Å; F184-L188 WeakPolarHBondContact O-CB 3.34Å; F184-L188 PolarHBondContact O-N 3.06Å; M185-L188 HydrophobicContact SD-CD2 4.17Å; L188-Q190 VanDerWaalsContact C-N 3.26Å; L188-Q190 PolarHBondContact O-N 3.39Å; L188-S191 WeakPolarHBondContact O-CA 3.36Å; L188-S191 WeakPolarHBondContact O-CB 3.3Å; L188-S191 PolarHBondContact O-N 2.88Å; L188-L192 HydrophobicContact CD1-CD1 4.18Å; L188-L192 HydrophobicContact CD1-CG 4.17Å; L188-L192 HydrophobicContact CG-CD1 4.07Å; L188-L192 HydrophobicContact CG-CG 4.4Å; L188-L192 WeakPolarHBondContact O-CG 3.29Å; L188-L192 PolarHBondContact O-N 3.47Å; L188-L217 HydrophobicContact CB-CD1 4.13Å; L188-L217 HydrophobicContact CD1-CD2 3.8Å; L188-T241 HydrophobicContact CD1-CG2 4.4Å; L188-T241 VanDerWaalsContact CD1-OG1 3.24Å; L188-T241 WeakPolarHBondContact CD1-OG1 3.4Å |
| 189 | N | 97.6 | Very high | 95.4 | Very high | 82 Ų | 82 | 69.2 Ų | 69.2 | 44% | 0.439 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -59 | -38.2 | 177.9 | -79 | -29.9 | 0 | 0 | 0 | 112 | M185 A186 S191 R193 | M185-N189 WeakPolarHBondContact O-CB 3.45Å; M185-N189 VanDerWaalsContact O-CG 3.27Å; M185-N189 PolarHBondContact O-N 3.27Å; M185-N189 PolarHBondContact O-ND2 3.29Å; A186-N189 PolarHBondContact O-N 2.95Å; N189-S191 VanDerWaalsContact C-N 3.34Å; N189-R193 WeakPolarHBondContact O-CB 3.09Å; N189-R193 WeakPolarHBondContact O-CG 3.03Å; N189-R193 PolarHBondContact O-N 3.19Å |
| 190 | Q | 97.2 | Very high | 94.6 | Very high | 116 Ų | 116 | 72.2 Ų | 72.2 | 54% | 0.542 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -62.6 | -41.7 | 173.3 | -172.4 | -177.1 | 1.3 | 0 | 0 | 111.9 | A186 T187 L188 C194 T213 | A186-Q190 PolarHBondContact O-N 2.74Å; T187-Q190 PolarHBondContact O-N 3.49Å; L188-Q190 VanDerWaalsContact C-N 3.26Å; L188-Q190 PolarHBondContact O-N 3.39Å; Q190-C194 PolarHBondContact O-N 3.49Å; Q190-C194 VanDerWaalsContact O-N 3.08Å; Q190-T213 HydrophobicContact CB-CG2 4.38Å; Q190-T213 HydrophobicContact CG-CG2 3.92Å |
| 191 | S | 96.9 | Very high | 93.5 | Very high | 0 Ų | 0 | 70.9 Ų | 70.9 | 0% | 0 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -64.8 | -46.8 | 177.7 | -56.2 | 0 | 0 | 0 | 0 | 111.6 | T187 L188 N189 C194 F195 | T187-S191 PolarHBondContact O-N 3.45Å; T187-S191 PolarHBondContact O-OG 3.46Å; L188-S191 WeakPolarHBondContact O-CA 3.36Å; L188-S191 WeakPolarHBondContact O-CB 3.3Å; L188-S191 PolarHBondContact O-N 2.88Å; N189-S191 VanDerWaalsContact C-N 3.34Å; S191-C194 WeakPolarHBondContact O-CB 3.41Å; S191-C194 PolarHBondContact O-N 3.18Å; S191-C194 VanDerWaalsContact O-N 3.16Å; S191-F195 VanDerWaalsContact O-CD1 3.31Å; S191-F195 WeakPolarHBondContact O-CD1 3.44Å; S191-F195 WeakPolarHBondContact O-CG 3.43Å; S191-F195 PolarHBondContact O-N 3.24Å |
| 192 | L | 96.6 | Very high | 92.6 | Very high | 51 Ų | 51 | 76.6 Ų | 76.6 | 27% | 0.267 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -64.4 | -41.2 | 178.5 | -65.9 | 177.9 | 0 | 0 | 0 | 111.9 | L188 C194 F195 E196 L244 | L188-L192 HydrophobicContact CD1-CD1 4.18Å; L188-L192 HydrophobicContact CD1-CG 4.17Å; L188-L192 HydrophobicContact CG-CD1 4.07Å; L188-L192 HydrophobicContact CG-CG 4.4Å; L188-L192 WeakPolarHBondContact O-CG 3.29Å; L188-L192 PolarHBondContact O-N 3.47Å; L192-C194 VanDerWaalsContact C-N 3.27Å; L192-C194 PolarHBondContact O-N 3.26Å; L192-F195 HydrophobicContact CD2-CD2 4.12Å; L192-F195 WeakPolarHBondContact O-CA 3.48Å; L192-F195 WeakPolarHBondContact O-CB 3.24Å; L192-F195 PolarHBondContact O-N 3.48Å; L192-E196 WeakPolarHBondContact O-CG 3.48Å; L192-E196 PolarHBondContact O-N 2.99Å; L192-L244 HydrophobicContact CD2-CD1 4.36Å |
| 193 | R | 96.6 | Very high | 92.1 | Very high | 178 Ų | 178 | 76 Ų | 76 | 67% | 0.672 | 37% | 0.373 | S | S | * | . | H | α-helix | trans | -59.9 | -37.9 | 172.7 | -75.1 | 172.8 | -175.6 | 174.4 | 2.5 | 112.3 | N189 K197 | N189-R193 WeakPolarHBondContact O-CB 3.09Å; N189-R193 WeakPolarHBondContact O-CG 3.03Å; N189-R193 PolarHBondContact O-N 3.19Å; R193-K197 WeakPolarHBondContact O-CB 3.23Å; R193-K197 PolarHBondContact O-N 2.91Å; R193-K197 VanDerWaalsContact O-N 3.08Å |
| 194 | C | 95.5 | Very high | 91.6 | Very high | 22 Ų | 22 | 72.8 Ų | 72.8 | 15% | 0.149 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -63.2 | -45.2 | 173.2 | -168.4 | 0 | 0 | 0 | 0 | 110.8 | Q190 S191 L192 K197 F198 C210 | Q190-C194 PolarHBondContact O-N 3.49Å; Q190-C194 VanDerWaalsContact O-N 3.08Å; S191-C194 WeakPolarHBondContact O-CB 3.41Å; S191-C194 PolarHBondContact O-N 3.18Å; S191-C194 VanDerWaalsContact O-N 3.16Å; L192-C194 VanDerWaalsContact C-N 3.27Å; L192-C194 PolarHBondContact O-N 3.26Å; C194-K197 PolarHBondContact O-N 3.3Å; C194-F198 WeakPolarHBondContact O-CD2 3.24Å; C194-F198 PolarHBondContact O-N 3.33Å; C194-C210 HydrophobicContact CB-CB 3.93Å; C194-C210 WeakPolarHBondContact CB-SG 3.35Å; C194-C210 PolarHBondContact O-SG 2.92Å; C194-C210 WeakPolarHBondContact SG-CA 3.47Å; C194-C210 WeakPolarHBondContact SG-CB 3.49Å; C194-C210 CovalentContact SG-SG 2.04Å; C194-C210 PolarHBondContact SG-SG 3.29Å |
| 195 | F | 95.2 | Very high | 91.2 | Very high | 5 Ų | 5 | 74.8 Ų | 74.8 | 2% | 0.022 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -59.7 | -50.4 | 178.2 | -63.1 | -7.5 | 0 | 0 | 0 | 111.1 | S191 L192 K197 F198 Q199 L206 C210 Y214 T241 W245 F249 | S191-F195 VanDerWaalsContact O-CD1 3.31Å; S191-F195 WeakPolarHBondContact O-CD1 3.44Å; S191-F195 WeakPolarHBondContact O-CG 3.43Å; S191-F195 PolarHBondContact O-N 3.24Å; L192-F195 HydrophobicContact CD2-CD2 4.12Å; L192-F195 WeakPolarHBondContact O-CA 3.48Å; L192-F195 WeakPolarHBondContact O-CB 3.24Å; L192-F195 PolarHBondContact O-N 3.48Å; F195-K197 VanDerWaalsContact C-N 3.31Å; F195-K197 PolarHBondContact O-N 2.91Å; F195-F198 CarbonylContact O-C 3.33Å; F195-F198 PolarHBondContact O-N 3.25Å; F195-Q199 WeakPolarHBondContact O-CA 3.41Å; F195-Q199 VanDerWaalsContact O-CB 3.27Å; F195-Q199 WeakPolarHBondContact O-CB 3.36Å; F195-Q199 PolarHBondContact O-N 2.98Å; F195-L206 HydrophobicContact CB-CD1 4.43Å; F195-L206 HydrophobicContact CD1-CD2 4.14Å; F195-L206 WeakPolarHBondContact O-CD1 3.14Å; F195-C210 HydrophobicContact CD1-CB 3.81Å; F195-C210 HydrophobicContact CE1-CB 3.79Å; F195-Y214 AromaticContact CZ-CD2 4Å; F195-Y214 HydrophobicContact CZ-CD2 4Å; F195-Y214 HydrophobicContact CZ-CG 4.44Å; F195-T241 HydrophobicContact CE2-CG2 3.87Å; F195-T241 HydrophobicContact CZ-CG2 4.32Å; F195-W245 AromaticContact CE1-CE3 3.62Å; F195-W245 HydrophobicContact CE1-CE3 3.62Å; F195-W245 AromaticContact CE1-CZ3 3.76Å; F195-W245 HydrophobicContact CE1-CZ3 3.76Å; F195-W245 AromaticContact CZ-CE3 3.59Å; F195-W245 HydrophobicContact CZ-CE3 3.59Å; F195-W245 HydrophobicContact CZ-CZ3 4.2Å; F195-F249 HydrophobicContact CB-CE2 4.02Å; F195-F249 HydrophobicContact CB-CZ 4.36Å; F195-F249 AromaticContact CD2-CE2 3.78Å; F195-F249 HydrophobicContact CD2-CE2 3.78Å; F195-F249 HydrophobicContact CE2-CE2 4.38Å; F195-F249 AromaticContact CG-CE2 3.92Å; F195-F249 HydrophobicContact CG-CE2 3.92Å |
| 196 | E | 94.1 | Very high | 91.1 | Very high | 124 Ų | 124 | 73.6 Ų | 73.6 | 58% | 0.579 | 38% | 0.383 | S | S | * | . | H | α-helix | trans | -55.7 | -44.4 | 178.1 | -73.4 | 173.9 | -178.2 | 0 | 0 | 112.1 | L192 F198 Q199 | L192-E196 WeakPolarHBondContact O-CG 3.48Å; L192-E196 PolarHBondContact O-N 2.99Å; E196-F198 VanDerWaalsContact C-N 3.28Å; E196-F198 PolarHBondContact O-N 3.4Å; E196-Q199 PolarHBondContact O-N 3.03Å |
| 197 | K | 93.2 | Very high | 90.9 | Very high | 162 Ų | 162 | 71.2 Ų | 71.2 | 70% | 0.704 | 36% | 0.363 | S | S | * | . | H | α-helix | trans | -59.5 | -36.9 | -179.6 | -178 | 177.1 | 177.8 | -178.9 | 0 | 113.2 | R193 C194 F195 | R193-K197 WeakPolarHBondContact O-CB 3.23Å; R193-K197 PolarHBondContact O-N 2.91Å; R193-K197 VanDerWaalsContact O-N 3.08Å; C194-K197 PolarHBondContact O-N 3.3Å; F195-K197 VanDerWaalsContact C-N 3.31Å; F195-K197 PolarHBondContact O-N 2.91Å |
| 198 | F | 90.2 | Very high | 90.6 | Very high | 55 Ų | 55 | 77.9 Ų | 77.9 | 24% | 0.241 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -106.3 | 1.8 | -176.5 | -65.3 | -77.6 | 0 | 0 | 0 | 113.6 | C194 F195 E196 G201 L206 E209 | C194-F198 WeakPolarHBondContact O-CD2 3.24Å; C194-F198 PolarHBondContact O-N 3.33Å; F195-F198 CarbonylContact O-C 3.33Å; F195-F198 PolarHBondContact O-N 3.25Å; E196-F198 VanDerWaalsContact C-N 3.28Å; E196-F198 PolarHBondContact O-N 3.4Å; F198-G201 PolarHBondContact O-N 3.18Å; F198-L206 HydrophobicContact CB-CB 3.71Å; F198-L206 HydrophobicContact CB-CD1 4.35Å; F198-L206 HydrophobicContact CB-CG 4.09Å; F198-E209 HydrophobicContact CD2-CB 4.17Å; F198-E209 HydrophobicContact CE1-CB 4.37Å; F198-E209 HydrophobicContact CE1-CG 4.03Å; F198-E209 HydrophobicContact CE2-CB 3.74Å; F198-E209 HydrophobicContact CE2-CG 4.28Å; F198-E209 HydrophobicContact CZ-CB 3.84Å; F198-E209 HydrophobicContact CZ-CG 3.85Å |
| 199 | Q | 85.1 | Confident | 90.4 | Very high | 103 Ų | 103 | 82.3 Ų | 82.3 | 48% | 0.481 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -66.4 | -37 | -178.2 | -178.6 | 177.8 | 0 | 0 | 0 | 112.5 | F195 E196 G201 F249 | F195-Q199 WeakPolarHBondContact O-CA 3.41Å; F195-Q199 VanDerWaalsContact O-CB 3.27Å; F195-Q199 WeakPolarHBondContact O-CB 3.36Å; F195-Q199 PolarHBondContact O-N 2.98Å; E196-Q199 PolarHBondContact O-N 3.03Å; Q199-G201 PolarHBondContact O-N 2.99Å; Q199-F249 HydrophobicContact CG-CE1 4.4Å |
| 200 | Q | 78.1 | Confident | 90.3 | Very high | 197 Ų | 197 | 78.4 Ų | 78.4 | 92% | 0.921 | 39% | 0.39 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.2 | 0.9 | -177.6 | -67.3 | 172 | -6 | 0 | 0 | 113.3 | ||
| 201 | G | 70.1 | Confident | 90.2 | Very high | 48 Ų | 48 | 78.6 Ų | 78.6 | 50% | 0.495 | 39% | 0.389 | S | S | . | . | S | Bend | trans | -114.5 | -160.6 | 179.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | F198 Q199 H203 | F198-G201 PolarHBondContact O-N 3.18Å; Q199-G201 PolarHBondContact O-N 2.99Å; G201-H203 PolarHBondContact O-N 2.87Å |
| 202 | N | 78.4 | Confident | 90.1 | Very high | 120 Ų | 120 | 82.2 Ų | 82.2 | 64% | 0.642 | 42% | 0.419 | S | S | * | . | trans | -68.8 | 121.5 | 173.9 | -173.8 | -20 | 0 | 0 | 0 | 110 | S204 A205 | N202-S204 PolarHBondContact O-N 3.34Å; N202-S204 WeakPolarHBondContact OD1-CB 3.27Å; N202-S204 PolarHBondContact OD1-N 3.08Å; N202-A205 WeakPolarHBondContact O-CB 3.39Å; N202-A205 PolarHBondContact O-N 3.35Å | ||
| 203 | H | 84.4 | Confident | 90.1 | Very high | 77 Ų | 77 | 81.4 Ų | 81.4 | 36% | 0.356 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -52.8 | -27.9 | 178.1 | -67 | -179.4 | 0 | 0 | 0 | 112.8 | G201 A205 L206 C207 | G201-H203 PolarHBondContact O-N 2.87Å; H203-A205 VanDerWaalsContact C-N 3.27Å; H203-A205 PolarHBondContact O-N 3.05Å; H203-L206 WeakPolarHBondContact O-CB 3.36Å; H203-L206 PolarHBondContact O-N 3.34Å; H203-C207 PolarHBondContact O-N 3.19Å; H203-C207 PolarHBondContact O-SG 3.25Å |
| 204 | S | 86.8 | Confident | 90.1 | Very high | 78 Ų | 78 | 74.4 Ų | 74.4 | 55% | 0.545 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -60.9 | -33.7 | 174.8 | -174.5 | 0 | 0 | 0 | 0 | 113.3 | N202 K208 | N202-S204 PolarHBondContact O-N 3.34Å; N202-S204 WeakPolarHBondContact OD1-CB 3.27Å; N202-S204 PolarHBondContact OD1-N 3.08Å; S204-K208 PolarHBondContact O-N 3.32Å |
| 205 | A | 90.1 | Very high | 90.1 | Very high | 43 Ų | 43 | 81 Ų | 81 | 36% | 0.355 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -71.6 | -43.6 | 175.2 | 0 | 0 | 0 | 0 | 0 | 110.5 | N202 H203 C207 K208 E209 | N202-A205 WeakPolarHBondContact O-CB 3.39Å; N202-A205 PolarHBondContact O-N 3.35Å; H203-A205 VanDerWaalsContact C-N 3.27Å; H203-A205 PolarHBondContact O-N 3.05Å; A205-C207 VanDerWaalsContact C-N 3.34Å; A205-C207 PolarHBondContact O-N 2.99Å; A205-K208 PolarHBondContact O-N 2.94Å; A205-K208 VanDerWaalsContact O-N 3.08Å; A205-E209 WeakPolarHBondContact O-CB 3.5Å; A205-E209 WeakPolarHBondContact O-CG 3.39Å; A205-E209 PolarHBondContact O-N 3.36Å |
| 206 | L | 93.7 | Very high | 90.2 | Very high | 0 Ų | 0 | 82.2 Ų | 82.2 | 0% | 0 | 43% | 0.425 | C | S | . | . | H | α-helix | trans | -54.4 | -49.8 | 173.5 | -176.7 | 159.3 | 0 | 0 | 0 | 111.2 | F195 F198 H203 K208 E209 C210 W245 F249 | F195-L206 HydrophobicContact CB-CD1 4.43Å; F195-L206 HydrophobicContact CD1-CD2 4.14Å; F195-L206 WeakPolarHBondContact O-CD1 3.14Å; F198-L206 HydrophobicContact CB-CB 3.71Å; F198-L206 HydrophobicContact CB-CD1 4.35Å; F198-L206 HydrophobicContact CB-CG 4.09Å; H203-L206 WeakPolarHBondContact O-CB 3.36Å; H203-L206 PolarHBondContact O-N 3.34Å; L206-K208 PolarHBondContact O-N 2.76Å; L206-E209 PolarHBondContact O-N 3.29Å; L206-C210 VanDerWaalsContact O-CB 3.31Å; L206-C210 WeakPolarHBondContact O-CB 3.4Å; L206-C210 PolarHBondContact O-N 2.86Å; L206-W245 HydrophobicContact CD2-CE3 4.45Å; L206-W245 HydrophobicContact CD2-CZ3 4.11Å; L206-F249 HydrophobicContact CD1-CD1 4.16Å; L206-F249 HydrophobicContact CD1-CD2 4.1Å; L206-F249 HydrophobicContact CD1-CE1 4.13Å; L206-F249 HydrophobicContact CD1-CE2 4.07Å; L206-F249 HydrophobicContact CD1-CG 4.16Å; L206-F249 HydrophobicContact CD1-CZ 4.09Å; L206-F249 HydrophobicContact CD2-CB 4.24Å; L206-F249 HydrophobicContact CD2-CD2 3.76Å; L206-F249 HydrophobicContact CD2-CE2 4.33Å; L206-F249 HydrophobicContact CD2-CG 4.04Å |
| 207 | C | 92.8 | Very high | 90.4 | Very high | 6 Ų | 6 | 76.3 Ų | 76.3 | 4% | 0.041 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -62.7 | -27.2 | -179.7 | -57.4 | 0 | 0 | 0 | 0 | 113.1 | H203 A205 K211 C251 F253 | H203-C207 PolarHBondContact O-N 3.19Å; H203-C207 PolarHBondContact O-SG 3.25Å; A205-C207 VanDerWaalsContact C-N 3.34Å; A205-C207 PolarHBondContact O-N 2.99Å; C207-K211 WeakPolarHBondContact O-CB 3.41Å; C207-C251 WeakPolarHBondContact CA-SG 3.43Å; C207-C251 HydrophobicContact CB-CB 3.64Å; C207-C251 WeakPolarHBondContact CB-SG 3.47Å; C207-C251 WeakPolarHBondContact SG-CA 3.34Å; C207-C251 WeakPolarHBondContact SG-CB 3.39Å; C207-C251 CovalentContact SG-SG 2.03Å; C207-C251 PolarHBondContact SG-SG 3.4Å; C207-F253 HydrophobicContact CB-CE2 4.2Å; C207-F253 HydrophobicContact CB-CZ 4.39Å |
| 208 | K | 92.6 | Very high | 90.6 | Very high | 157 Ų | 157 | 70.9 Ų | 70.9 | 68% | 0.683 | 38% | 0.377 | S | S | * | . | H | α-helix | trans | -82.7 | -52.2 | 178.5 | -174.1 | -175.5 | 176.4 | -169.9 | 0 | 111.1 | S204 A205 L206 | S204-K208 PolarHBondContact O-N 3.32Å; A205-K208 PolarHBondContact O-N 2.94Å; A205-K208 VanDerWaalsContact O-N 3.08Å; L206-K208 PolarHBondContact O-N 2.76Å |
| 209 | E | 94.3 | Very high | 91 | Very high | 104 Ų | 104 | 72.7 Ų | 72.7 | 49% | 0.486 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -72.9 | -40.1 | -173.5 | -61.8 | -55.2 | 135.6 | 0 | 0 | 112.1 | F198 A205 L206 | F198-E209 HydrophobicContact CD2-CB 4.17Å; F198-E209 HydrophobicContact CE1-CB 4.37Å; F198-E209 HydrophobicContact CE1-CG 4.03Å; F198-E209 HydrophobicContact CE2-CB 3.74Å; F198-E209 HydrophobicContact CE2-CG 4.28Å; F198-E209 HydrophobicContact CZ-CB 3.84Å; F198-E209 HydrophobicContact CZ-CG 3.85Å; A205-E209 WeakPolarHBondContact O-CB 3.5Å; A205-E209 WeakPolarHBondContact O-CG 3.39Å; A205-E209 PolarHBondContact O-N 3.36Å; L206-E209 PolarHBondContact O-N 3.29Å |
| 210 | C | 95.4 | Very high | 91.6 | Very high | 0 Ų | 0 | 68.8 Ų | 68.8 | 0% | 0 | 37% | 0.368 | C | S | . | . | S | Bend | trans | -88.6 | -0.2 | -178.6 | -56 | 0 | 0 | 0 | 0 | 114.1 | C194 F195 L206 A212 T213 Y214 W245 | C194-C210 HydrophobicContact CB-CB 3.93Å; C194-C210 WeakPolarHBondContact CB-SG 3.35Å; C194-C210 PolarHBondContact O-SG 2.92Å; C194-C210 WeakPolarHBondContact SG-CA 3.47Å; C194-C210 WeakPolarHBondContact SG-CB 3.49Å; C194-C210 CovalentContact SG-SG 2.04Å; C194-C210 PolarHBondContact SG-SG 3.29Å; F195-C210 HydrophobicContact CD1-CB 3.81Å; F195-C210 HydrophobicContact CE1-CB 3.79Å; L206-C210 VanDerWaalsContact O-CB 3.31Å; L206-C210 WeakPolarHBondContact O-CB 3.4Å; L206-C210 PolarHBondContact O-N 2.86Å; C210-A212 VanDerWaalsContact C-N 3.34Å; C210-A212 PolarHBondContact O-N 3.37Å; C210-T213 PolarHBondContact O-N 2.88Å; C210-Y214 WeakPolarHBondContact O-CB 3.5Å; C210-Y214 PolarHBondContact O-N 2.9Å; C210-W245 HydrophobicContact CB-CZ3 4.2Å |
| 211 | K | 94.8 | Very high | 92.5 | Very high | 121 Ų | 121 | 60.1 Ų | 60.1 | 53% | 0.526 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -57.3 | -45.1 | -178 | -167.4 | 171.7 | 176.7 | 176 | 0 | 112.7 | C207 R215 W245 | C207-K211 WeakPolarHBondContact O-CB 3.41Å; K211-R215 WeakPolarHBondContact O-CB 3.41Å; K211-R215 PolarHBondContact O-N 3.07Å; K211-W245 HydrophobicContact CB-CH2 4.28Å |
| 212 | A | 95.1 | Very high | 93.8 | Very high | 76 Ų | 76 | 59.6 Ų | 59.6 | 63% | 0.628 | 32% | 0.316 | S | S | * | . | H | α-helix | trans | -66.8 | -45.3 | -177.1 | 0 | 0 | 0 | 0 | 0 | 111 | C210 R215 G216 | C210-A212 VanDerWaalsContact C-N 3.34Å; C210-A212 PolarHBondContact O-N 3.37Å; A212-R215 PolarHBondContact O-N 2.94Å; A212-G216 PolarHBondContact O-N 2.95Å |
| 213 | T | 96.1 | Very high | 94.7 | Very high | 33 Ų | 33 | 61.7 Ų | 61.7 | 20% | 0.202 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -64 | -47.5 | 178.6 | -43.3 | 0 | 0 | 0 | 0 | 111.4 | Q190 C210 R215 G216 L217 | Q190-T213 HydrophobicContact CB-CG2 4.38Å; Q190-T213 HydrophobicContact CG-CG2 3.92Å; C210-T213 PolarHBondContact O-N 2.88Å; T213-R215 VanDerWaalsContact C-N 3.35Å; T213-R215 PolarHBondContact O-N 2.86Å; T213-G216 PolarHBondContact O-N 3.45Å; T213-L217 PolarHBondContact O-N 3.4Å |
| 214 | Y | 96.6 | Very high | 95.3 | Very high | 32 Ų | 32 | 58.2 Ų | 58.2 | 13% | 0.125 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -61.9 | -41.1 | 176.1 | 174 | -105.3 | 0 | 0 | 0 | 112.4 | F195 C210 L217 N218 M238 T241 R242 W245 | F195-Y214 AromaticContact CZ-CD2 4Å; F195-Y214 HydrophobicContact CZ-CD2 4Å; F195-Y214 HydrophobicContact CZ-CG 4.44Å; C210-Y214 WeakPolarHBondContact O-CB 3.5Å; C210-Y214 PolarHBondContact O-N 2.9Å; Y214-L217 PolarHBondContact O-N 3.39Å; Y214-N218 PolarHBondContact O-N 2.9Å; Y214-M238 HydrophobicContact CE2-CE 4.39Å; Y214-T241 HydrophobicContact CD2-CG2 4.2Å; Y214-T241 HydrophobicContact CE2-CG2 4.13Å; Y214-R242 WeakPolarHBondContact OH-CG 3.2Å; Y214-W245 AromaticContact CD1-CD1 3.98Å; Y214-W245 AromaticContact CD1-CD2 3.58Å; Y214-W245 HydrophobicContact CD1-CD2 3.58Å; Y214-W245 AromaticContact CD1-CE2 3.46Å; Y214-W245 VanDerWaalsContact CD1-CE2 3.46Å; Y214-W245 HydrophobicContact CD1-CE3 4.11Å; Y214-W245 AromaticContact CD1-CG 3.91Å; Y214-W245 HydrophobicContact CD1-CG 3.91Å; Y214-W245 HydrophobicContact CD1-CH2 4.4Å; Y214-W245 AromaticContact CD1-CZ2 3.9Å; Y214-W245 HydrophobicContact CD1-CZ2 3.9Å; Y214-W245 HydrophobicContact CD1-CZ3 4.49Å; Y214-W245 AromaticContact CD1-NE1 3.73Å; Y214-W245 HydrophobicContact CD2-CB 4.3Å; Y214-W245 HydrophobicContact CD2-CD2 4.15Å; Y214-W245 HydrophobicContact CD2-CE3 4.27Å; Y214-W245 HydrophobicContact CD2-CG 4.19Å; Y214-W245 HydrophobicContact CE1-CB 4.37Å; Y214-W245 AromaticContact CE1-CD1 3.39Å; Y214-W245 AromaticContact CE1-CD2 3.79Å; Y214-W245 HydrophobicContact CE1-CD2 3.79Å; Y214-W245 AromaticContact CE1-CE2 3.69Å; Y214-W245 AromaticContact CE1-CG 3.6Å; Y214-W245 HydrophobicContact CE1-CG 3.6Å; Y214-W245 HydrophobicContact CE1-CZ2 4.5Å; Y214-W245 AromaticContact CE1-NE1 3.45Å; Y214-W245 HydrophobicContact CE2-CB 3.83Å; Y214-W245 HydrophobicContact CE2-CD2 4.33Å; Y214-W245 AromaticContact CE2-CG 3.9Å; Y214-W245 HydrophobicContact CE2-CG 3.9Å; Y214-W245 AromaticContact CG-CD2 3.76Å; Y214-W245 HydrophobicContact CG-CD2 3.76Å; Y214-W245 AromaticContact CG-CE3 3.87Å; Y214-W245 HydrophobicContact CG-CE3 3.87Å; Y214-W245 HydrophobicContact CG-CG 4.18Å; Y214-W245 HydrophobicContact CG-CZ2 4.48Å; Y214-W245 HydrophobicContact CG-CZ3 4.28Å; Y214-W245 AromaticContact CZ-CD1 3.61Å; Y214-W245 AromaticContact CZ-CG 3.58Å |
| 215 | R | 95.9 | Very high | 95.8 | Very high | 160 Ų | 160 | 59.3 Ų | 59.3 | 60% | 0.604 | 30% | 0.295 | S | S | * | . | H | α-helix | trans | -60.8 | -45 | 174.8 | 179.4 | 179.7 | 173.1 | -177.7 | -3.3 | 111.3 | K211 A212 T213 L217 N218 E219 | K211-R215 WeakPolarHBondContact O-CB 3.41Å; K211-R215 PolarHBondContact O-N 3.07Å; A212-R215 PolarHBondContact O-N 2.94Å; T213-R215 VanDerWaalsContact C-N 3.35Å; T213-R215 PolarHBondContact O-N 2.86Å; R215-L217 VanDerWaalsContact C-N 3.35Å; R215-L217 PolarHBondContact O-N 3.31Å; R215-N218 PolarHBondContact O-N 3.08Å; R215-E219 HydrophobicContact CG-CG 4.38Å; R215-E219 IonicContact CZ-OE1 3.33Å; R215-E219 IonicContact NE-OE1 2.75Å; R215-E219 PolarHBondContact NE-OE1 3.21Å; R215-E219 IonicContact NH2-OE1 3.04Å; R215-E219 PolarHBondContact NH2-OE1 2.69Å; R215-E219 WeakPolarHBondContact O-CB 3.25Å; R215-E219 WeakPolarHBondContact O-CG 3.48Å; R215-E219 PolarHBondContact O-N 3.4Å |
| 216 | G | 97.4 | Very high | 96.1 | Very high | 31 Ų | 31 | 65.6 Ų | 65.6 | 32% | 0.32 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -59.6 | -43.9 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | A212 T213 N218 E219 L220 | A212-G216 PolarHBondContact O-N 2.95Å; T213-G216 PolarHBondContact O-N 3.45Å; G216-N218 PolarHBondContact O-N 2.89Å; G216-E219 PolarHBondContact O-N 2.96Å; G216-L220 WeakPolarHBondContact O-CB 3.36Å; G216-L220 PolarHBondContact O-N 3.28Å |
| 217 | L | 98.2 | Very high | 96.1 | Very high | 0 Ų | 0 | 70.3 Ų | 70.3 | 0% | 0 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -59.7 | -44.9 | 173.4 | 179.5 | 64.7 | 0 | 0 | 0 | 112.1 | F184 T187 L188 T213 Y214 R215 L220 Y221 M238 T241 | F184-L217 HydrophobicContact CD2-CD1 4.02Å; F184-L217 HydrophobicContact CE2-CD1 3.57Å; F184-L217 HydrophobicContact CZ-CD1 3.96Å; T187-L217 HydrophobicContact CG2-CB 4.1Å; T187-L217 HydrophobicContact CG2-CD1 4.04Å; L188-L217 HydrophobicContact CB-CD1 4.13Å; L188-L217 HydrophobicContact CD1-CD2 3.8Å; T213-L217 PolarHBondContact O-N 3.4Å; Y214-L217 PolarHBondContact O-N 3.39Å; R215-L217 VanDerWaalsContact C-N 3.35Å; R215-L217 PolarHBondContact O-N 3.31Å; L217-L220 PolarHBondContact O-N 3.02Å; L217-Y221 PolarHBondContact O-N 2.77Å; L217-M238 HydrophobicContact CD2-SD 4.04Å; L217-M238 HydrophobicContact CG-SD 3.97Å; L217-T241 HydrophobicContact CD2-CG2 3.9Å |
| 218 | N | 97.2 | Very high | 96.1 | Very high | 48 Ų | 48 | 80.4 Ų | 80.4 | 26% | 0.257 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -68.3 | -37.4 | 179.8 | -170.4 | 74.5 | 0 | 0 | 0 | 112.5 | Y214 R215 G216 Y221 S222 M238 R242 | Y214-N218 PolarHBondContact O-N 2.9Å; R215-N218 PolarHBondContact O-N 3.08Å; G216-N218 PolarHBondContact O-N 2.89Å; N218-Y221 PolarHBondContact O-N 2.94Å; N218-S222 WeakPolarHBondContact O-CB 3.38Å; N218-S222 PolarHBondContact O-N 3.2Å; N218-S222 PolarHBondContact O-OG 2.88Å; N218-M238 HydrophobicContact CB-CE 3.71Å; N218-M238 WeakPolarHBondContact OD1-CE 3.42Å; N218-R242 PolarHBondContact OD1-NE 3.17Å; N218-R242 PolarHBondContact OD1-NH2 2.93Å |
| 219 | E | 97.4 | Very high | 96.2 | Very high | 93 Ų | 93 | 74.5 Ų | 74.5 | 44% | 0.435 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -66.4 | -38.2 | 174 | -73.9 | 176.3 | 179.5 | 0 | 0 | 111.8 | R215 G216 R223 | R215-E219 HydrophobicContact CG-CG 4.38Å; R215-E219 IonicContact CZ-OE1 3.33Å; R215-E219 IonicContact NE-OE1 2.75Å; R215-E219 PolarHBondContact NE-OE1 3.21Å; R215-E219 IonicContact NH2-OE1 3.04Å; R215-E219 PolarHBondContact NH2-OE1 2.69Å; R215-E219 WeakPolarHBondContact O-CB 3.25Å; R215-E219 WeakPolarHBondContact O-CG 3.48Å; R215-E219 PolarHBondContact O-N 3.4Å; G216-E219 PolarHBondContact O-N 2.96Å; E219-R223 PolarHBondContact O-N 3.41Å; E219-R223 VanDerWaalsContact O-N 3.09Å |
| 220 | L | 97.8 | Very high | 96.3 | Very high | 20 Ų | 20 | 70.4 Ų | 70.4 | 11% | 0.105 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -62.3 | -51 | 172.3 | 176.6 | 58.4 | 0 | 0 | 0 | 111 | Y183 F184 T187 G216 L217 S222 R223 M224 | Y183-L220 HydrophobicContact CD1-CD1 3.81Å; Y183-L220 HydrophobicContact CD1-CD2 3.57Å; Y183-L220 HydrophobicContact CD1-CG 4.35Å; Y183-L220 HydrophobicContact CE1-CD1 3.75Å; Y183-L220 HydrophobicContact CE1-CD2 3.61Å; Y183-L220 HydrophobicContact CE1-CG 4.28Å; F184-L220 HydrophobicContact CB-CD2 4.18Å; F184-L220 HydrophobicContact CD2-CD2 4.11Å; F184-L220 HydrophobicContact CD2-CG 4.31Å; T187-L220 HydrophobicContact CG2-CD2 4.38Å; G216-L220 WeakPolarHBondContact O-CB 3.36Å; G216-L220 PolarHBondContact O-N 3.28Å; L217-L220 PolarHBondContact O-N 3.02Å; L220-S222 VanDerWaalsContact C-N 3.33Å; L220-S222 PolarHBondContact O-N 2.98Å; L220-R223 WeakPolarHBondContact O-CB 3.44Å; L220-R223 PolarHBondContact O-N 3.25Å; L220-M224 HydrophobicContact CD1-CG 4.27Å; L220-M224 HydrophobicContact CD1-SD 4.24Å; L220-M224 HydrophobicContact CG-SD 4.19Å; L220-M224 WeakPolarHBondContact O-CG 3.46Å; L220-M224 PolarHBondContact O-N 2.96Å |
| 221 | Y | 98.2 | Very high | 96.3 | Very high | 16 Ų | 16 | 70.5 Ų | 70.5 | 6% | 0.063 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -53.6 | -49.8 | 176.1 | -179.3 | -85.9 | 0 | 0 | 0 | 111.5 | F184 L217 N218 R223 M224 E225 L230 I234 M238 | F184-Y221 HydrophobicContact CE2-CD2 4.14Å; L217-Y221 PolarHBondContact O-N 2.77Å; N218-Y221 PolarHBondContact O-N 2.94Å; Y221-R223 PolarHBondContact O-N 2.67Å; Y221-M224 PolarHBondContact O-N 2.85Å; Y221-M224 VanDerWaalsContact O-N 3.12Å; Y221-E225 HydrophobicContact CE1-CB 4.47Å; Y221-E225 WeakPolarHBondContact O-CB 3.4Å; Y221-E225 PolarHBondContact O-N 3.05Å; Y221-L230 HydrophobicContact CD2-CD2 4.14Å; Y221-L230 HydrophobicContact CE1-CD1 4.3Å; Y221-L230 HydrophobicContact CE2-CD1 4.17Å; Y221-L230 HydrophobicContact CE2-CD2 3.94Å; Y221-I234 HydrophobicContact CD2-CG2 4Å; Y221-I234 HydrophobicContact CE2-CG2 4.08Å; Y221-M238 HydrophobicContact CD1-CG 4.34Å; Y221-M238 HydrophobicContact CD2-CB 3.53Å; Y221-M238 HydrophobicContact CD2-CG 3.46Å; Y221-M238 VanDerWaalsContact CD2-CG 3.46Å; Y221-M238 HydrophobicContact CD2-SD 4.42Å; Y221-M238 HydrophobicContact CE2-CB 3.56Å; Y221-M238 HydrophobicContact CE2-CG 3.78Å; Y221-M238 HydrophobicContact CG-CB 4.34Å; Y221-M238 HydrophobicContact CG-CG 3.75Å; Y221-M238 HydrophobicContact CG-SD 4.45Å |
| 222 | S | 97.5 | Very high | 96.5 | Very high | 37 Ų | 37 | 67.3 Ų | 67.3 | 26% | 0.259 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -64.3 | -24 | 179.4 | -71.4 | 0 | 0 | 0 | 0 | 113.7 | N218 L220 K226 | N218-S222 WeakPolarHBondContact O-CB 3.38Å; N218-S222 PolarHBondContact O-N 3.2Å; N218-S222 PolarHBondContact O-OG 2.88Å; L220-S222 VanDerWaalsContact C-N 3.33Å; L220-S222 PolarHBondContact O-N 2.98Å; S222-K226 WeakPolarHBondContact O-CG 3.31Å; S222-K226 PolarHBondContact O-N 3.39Å |
| 223 | R | 97.1 | Very high | 96.6 | Very high | 163 Ų | 163 | 63.7 Ų | 63.7 | 62% | 0.615 | 29% | 0.294 | S | S | * | . | H | α-helix | trans | -74.7 | -45.6 | 171.9 | -171.3 | -172.3 | -51.2 | -145.7 | 1.1 | 110.9 | E219 L220 Y221 E225 K226 N227 | E219-R223 PolarHBondContact O-N 3.41Å; E219-R223 VanDerWaalsContact O-N 3.09Å; L220-R223 WeakPolarHBondContact O-CB 3.44Å; L220-R223 PolarHBondContact O-N 3.25Å; Y221-R223 PolarHBondContact O-N 2.67Å; R223-E225 VanDerWaalsContact C-N 3.31Å; R223-E225 PolarHBondContact O-N 3.1Å; R223-K226 PolarHBondContact O-N 2.98Å; R223-N227 PolarHBondContact O-N 2.88Å |
| 224 | M | 96.8 | Very high | 96.7 | Very high | 5 Ų | 5 | 62.1 Ų | 62.1 | 3% | 0.025 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -63.2 | -39.2 | 177.7 | -65.2 | -179.5 | 70.1 | 0 | 0 | 111.7 | D180 F184 L220 Y221 K226 N227 R228 T229 L230 I234 | D180-M224 HydrophobicContact CB-CE 4.06Å; F184-M224 HydrophobicContact CB-CE 4.42Å; F184-M224 HydrophobicContact CB-SD 3.91Å; F184-M224 HydrophobicContact CD2-SD 3.95Å; F184-M224 HydrophobicContact CG-SD 4.23Å; L220-M224 HydrophobicContact CD1-CG 4.27Å; L220-M224 HydrophobicContact CD1-SD 4.24Å; L220-M224 HydrophobicContact CG-SD 4.19Å; L220-M224 WeakPolarHBondContact O-CG 3.46Å; L220-M224 PolarHBondContact O-N 2.96Å; Y221-M224 PolarHBondContact O-N 2.85Å; Y221-M224 VanDerWaalsContact O-N 3.12Å; M224-K226 PolarHBondContact O-N 3.19Å; M224-N227 CarbonylContact O-C 3.43Å; M224-N227 PolarHBondContact O-N 3.32Å; M224-N227 VanDerWaalsContact O-N 3.14Å; M224-R228 PolarHBondContact O-N 3.22Å; M224-T229 WeakPolarHBondContact CA-OG1 3.42Å; M224-T229 PolarHBondContact O-N 2.93Å; M224-T229 PolarHBondContact O-OG1 3.37Å; M224-L230 HydrophobicContact CB-CD2 3.68Å; M224-L230 HydrophobicContact CB-CG 4.5Å; M224-I234 HydrophobicContact CE-CD1 3.47Å; M224-I234 VanDerWaalsContact CE-CD1 3.47Å |
| 225 | E | 96.3 | Very high | 96.7 | Very high | 101 Ų | 101 | 64.6 Ų | 64.6 | 47% | 0.472 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -56.6 | -47.1 | 173 | -173.8 | 174.9 | -150.1 | 0 | 0 | 111.9 | Y221 R223 N227 R228 L230 | Y221-E225 HydrophobicContact CE1-CB 4.47Å; Y221-E225 WeakPolarHBondContact O-CB 3.4Å; Y221-E225 PolarHBondContact O-N 3.05Å; R223-E225 VanDerWaalsContact C-N 3.31Å; R223-E225 PolarHBondContact O-N 3.1Å; E225-N227 VanDerWaalsContact C-N 3.31Å; E225-N227 PolarHBondContact O-N 2.96Å; E225-R228 PolarHBondContact O-N 3.43Å; E225-R228 VanDerWaalsContact O-N 3.15Å; E225-L230 HydrophobicContact CB-CD1 3.81Å; E225-L230 HydrophobicContact CB-CG 4.49Å; E225-L230 HydrophobicContact CG-CD1 4.04Å |
| 226 | K | 96.2 | Very high | 96.8 | Very high | 174 Ų | 174 | 58.1 Ų | 58.1 | 76% | 0.757 | 27% | 0.274 | S | S | * | . | H | α-helix | trans | -64.8 | -36.3 | 176 | -71.6 | 175.1 | -174 | -175.5 | 0 | 112.6 | S222 R223 M224 R228 | S222-K226 WeakPolarHBondContact O-CG 3.31Å; S222-K226 PolarHBondContact O-N 3.39Å; R223-K226 PolarHBondContact O-N 2.98Å; M224-K226 PolarHBondContact O-N 3.19Å; K226-R228 PolarHBondContact O-N 3.4Å |
| 227 | N | 94.7 | Very high | 96.9 | Very high | 99 Ų | 99 | 57.6 Ų | 57.6 | 53% | 0.529 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -79.3 | -5 | 178.1 | -67.6 | -3.4 | 0 | 0 | 0 | 112.8 | R223 M224 E225 T229 | R223-N227 PolarHBondContact O-N 2.88Å; M224-N227 CarbonylContact O-C 3.43Å; M224-N227 PolarHBondContact O-N 3.32Å; M224-N227 VanDerWaalsContact O-N 3.14Å; E225-N227 VanDerWaalsContact C-N 3.31Å; E225-N227 PolarHBondContact O-N 2.96Å; N227-T229 HydrophobicContact CB-CG2 4.1Å; N227-T229 PolarHBondContact O-N 3.22Å |
| 228 | R | 93 | Very high | 96.8 | Very high | 219 Ų | 219 | 57.6 Ų | 57.6 | 83% | 0.826 | 27% | 0.266 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 55.4 | 36.9 | -174.8 | -56.7 | -176.9 | 177.9 | -176.2 | -1.8 | 113.2 | M224 E225 K226 | M224-R228 PolarHBondContact O-N 3.22Å; E225-R228 PolarHBondContact O-N 3.43Å; E225-R228 VanDerWaalsContact O-N 3.15Å; K226-R228 PolarHBondContact O-N 3.4Å |
| 229 | T | 93.5 | Very high | 96.8 | Very high | 32 Ų | 32 | 60.2 Ų | 60.2 | 20% | 0.196 | 28% | 0.28 | C | S | . | . | trans | -103.7 | 25.8 | 178.5 | 56.6 | 0 | 0 | 0 | 0 | 112.7 | M224 N227 | M224-T229 WeakPolarHBondContact CA-OG1 3.42Å; M224-T229 PolarHBondContact O-N 2.93Å; M224-T229 PolarHBondContact O-OG1 3.37Å; N227-T229 HydrophobicContact CB-CG2 4.1Å; N227-T229 PolarHBondContact O-N 3.22Å | ||
| 230 | L | 96.3 | Very high | 96.8 | Very high | 19 Ų | 19 | 60 Ų | 60 | 10% | 0.099 | 28% | 0.28 | C | S | . | . | trans | -87.8 | 147.7 | 177 | -60.3 | -179.8 | 0 | 0 | 0 | 110.6 | S168 Y221 M224 E225 I234 E235 | S168-L230 WeakPolarHBondContact CB-O 3.34Å; Y221-L230 HydrophobicContact CD2-CD2 4.14Å; Y221-L230 HydrophobicContact CE1-CD1 4.3Å; Y221-L230 HydrophobicContact CE2-CD1 4.17Å; Y221-L230 HydrophobicContact CE2-CD2 3.94Å; M224-L230 HydrophobicContact CB-CD2 3.68Å; M224-L230 HydrophobicContact CB-CG 4.5Å; E225-L230 HydrophobicContact CB-CD1 3.81Å; E225-L230 HydrophobicContact CB-CG 4.49Å; E225-L230 HydrophobicContact CG-CD1 4.04Å; L230-I234 HydrophobicContact CD2-CG2 3.67Å; L230-E235 HydrophobicContact CB-CG 4.32Å; L230-E235 HydrophobicContact CD1-CG 4.45Å | ||
| 231 | C | 97.3 | Very high | 96.8 | Very high | 1 Ų | 1 | 59.3 Ų | 59.3 | 1% | 0.007 | 28% | 0.276 | C | S | . | . | trans | -131.6 | 168.4 | 164.2 | 67.1 | 0 | 0 | 0 | 0 | 109.2 | E165 C169 D233 I234 E235 | E165-C231 VanDerWaalsContact O-CB 3.31Å; E165-C231 WeakPolarHBondContact O-CB 3.48Å; C169-C231 HydrophobicContact CB-CB 3.75Å; C169-C231 WeakPolarHBondContact CB-SG 3.4Å; C169-C231 WeakPolarHBondContact SG-CB 3.45Å; C169-C231 CovalentContact SG-SG 2.01Å; C169-C231 PolarHBondContact SG-SG 2.93Å; C231-D233 PolarHBondContact O-N 3.13Å; C231-D233 VanDerWaalsContact O-N 3.11Å; C231-I234 WeakPolarHBondContact O-CB 3.24Å; C231-I234 PolarHBondContact O-N 3.4Å; C231-E235 PolarHBondContact O-N 3.45Å; C231-E235 VanDerWaalsContact O-N 3.07Å | ||
| 232 | I | 97.6 | Very high | 96.7 | Very high | 54 Ų | 54 | 62.3 Ų | 62.3 | 28% | 0.277 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -55.5 | -34.5 | -175 | -165.6 | 63.9 | 0 | 0 | 0 | 113.8 | V105 V107 S164 I234 E235 D236 | V105-I232 HydrophobicContact CG1-CG1 4.02Å; V105-I232 HydrophobicContact CG1-CG2 3.91Å; V107-I232 HydrophobicContact CG2-CG2 3.59Å; S164-I232 PolarHBondContact O-N 3.48Å; I232-I234 VanDerWaalsContact C-N 3.33Å; I232-I234 PolarHBondContact O-N 2.79Å; I232-E235 PolarHBondContact O-N 2.91Å; I232-D236 WeakPolarHBondContact O-CB 3.41Å; I232-D236 PolarHBondContact O-N 3.34Å |
| 233 | D | 97.6 | Very high | 96.6 | Very high | 0 Ų | 0 | 67.8 Ų | 67.8 | 0% | 0 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -62.2 | -39.9 | 177.3 | -71.1 | 13.2 | 0 | 0 | 0 | 112.2 | K106 V107 C108 Q109 C231 S237 | K106-D233 VanDerWaalsContact C-OD2 3.28Å; K106-D233 WeakPolarHBondContact CA-OD1 3.32Å; K106-D233 WeakPolarHBondContact CA-OD2 3.35Å; V107-D233 PolarHBondContact N-OD1 3.03Å; C108-D233 PolarHBondContact N-OD1 3.22Å; C108-D233 PolarHBondContact N-OD2 3.37Å; Q109-D233 WeakPolarHBondContact CB-OD2 3.2Å; Q109-D233 VanDerWaalsContact CG-OD2 3.24Å; Q109-D233 WeakPolarHBondContact CG-OD2 3.36Å; Q109-D233 PolarHBondContact N-OD2 2.96Å; Q109-D233 PolarHBondContact NE2-OD2 2.94Å; C231-D233 PolarHBondContact O-N 3.13Å; C231-D233 VanDerWaalsContact O-N 3.11Å; D233-S237 VanDerWaalsContact O-CB 3.26Å; D233-S237 WeakPolarHBondContact O-CB 3.28Å; D233-S237 PolarHBondContact O-N 2.87Å; D233-S237 PolarHBondContact O-OG 3.25Å |
| 234 | I | 97.9 | Very high | 96.5 | Very high | 0 Ų | 0 | 62.4 Ų | 62.4 | 0% | 0 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -73.3 | -42 | 178.5 | -65.7 | -178.5 | 0 | 0 | 0 | 110 | C169 T181 F184 M185 Y221 M224 L230 C231 I232 S237 M238 | C169-I234 VanDerWaalsContact SG-CD1 3.55Å; T181-I234 HydrophobicContact CG2-CD1 4.41Å; F184-I234 HydrophobicContact CD1-CB 4.44Å; F184-I234 HydrophobicContact CD1-CD1 4.4Å; F184-I234 HydrophobicContact CD1-CG1 3.98Å; F184-I234 HydrophobicContact CD1-CG2 4.03Å; F184-I234 HydrophobicContact CD2-CG2 4.12Å; F184-I234 HydrophobicContact CE1-CB 4.26Å; F184-I234 HydrophobicContact CE1-CG1 4.24Å; F184-I234 HydrophobicContact CE1-CG2 3.77Å; F184-I234 HydrophobicContact CE2-CG2 3.86Å; F184-I234 HydrophobicContact CG-CD1 4.46Å; F184-I234 HydrophobicContact CG-CG1 4.48Å; F184-I234 HydrophobicContact CG-CG2 4.2Å; F184-I234 HydrophobicContact CZ-CG2 3.69Å; M185-I234 HydrophobicContact CE-CG1 3.98Å; Y221-I234 HydrophobicContact CD2-CG2 4Å; Y221-I234 HydrophobicContact CE2-CG2 4.08Å; M224-I234 HydrophobicContact CE-CD1 3.47Å; M224-I234 VanDerWaalsContact CE-CD1 3.47Å; L230-I234 HydrophobicContact CD2-CG2 3.67Å; C231-I234 WeakPolarHBondContact O-CB 3.24Å; C231-I234 PolarHBondContact O-N 3.4Å; I232-I234 VanDerWaalsContact C-N 3.33Å; I232-I234 PolarHBondContact O-N 2.79Å; I234-S237 WeakPolarHBondContact CA-OG 3.33Å; I234-S237 PolarHBondContact O-OG 2.04Å; I234-M238 VanDerWaalsContact O-CB 3.31Å; I234-M238 WeakPolarHBondContact O-CB 3.47Å; I234-M238 PolarHBondContact O-N 3.04Å |
| 235 | E | 97.8 | Very high | 96.4 | Very high | 85 Ų | 85 | 63 Ų | 63 | 40% | 0.397 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -63.7 | -48.7 | 178.9 | -65.5 | -171.5 | 154.9 | 0 | 0 | 112.1 | L230 C231 I232 M238 N239 | L230-E235 HydrophobicContact CB-CG 4.32Å; L230-E235 HydrophobicContact CD1-CG 4.45Å; C231-E235 PolarHBondContact O-N 3.45Å; C231-E235 VanDerWaalsContact O-N 3.07Å; I232-E235 PolarHBondContact O-N 2.91Å; E235-M238 PolarHBondContact O-N 3.49Å; E235-N239 VanDerWaalsContact O-CB 3.22Å; E235-N239 WeakPolarHBondContact O-CB 3.48Å; E235-N239 PolarHBondContact O-N 2.83Å |
| 236 | D | 97.9 | Very high | 96.3 | Very high | 23 Ų | 23 | 59.8 Ų | 59.8 | 12% | 0.123 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -62.9 | -47.8 | 178.9 | -174.5 | 66.1 | 0 | 0 | 0 | 110.9 | V105 I232 M238 N239 M240 | V105-D236 HydrophobicContact CB-CB 3.71Å; V105-D236 HydrophobicContact CG2-CB 3.88Å; V105-D236 VanDerWaalsContact CG2-CG 3.49Å; V105-D236 PolarHBondContact N-OD2 3.39Å; I232-D236 WeakPolarHBondContact O-CB 3.41Å; I232-D236 PolarHBondContact O-N 3.34Å; D236-M238 PolarHBondContact O-N 3.45Å; D236-N239 PolarHBondContact O-N 3.5Å; D236-M240 WeakPolarHBondContact O-CB 3.42Å; D236-M240 VanDerWaalsContact O-CG 3.32Å; D236-M240 WeakPolarHBondContact O-CG 3.42Å; D236-M240 PolarHBondContact O-N 3.47Å |
| 237 | S | 97.6 | Very high | 96.1 | Very high | 20 Ų | 20 | 58.7 Ų | 58.7 | 14% | 0.14 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -62.8 | -40.1 | 179.6 | 60.6 | 0 | 0 | 0 | 0 | 112.5 | F184 D233 I234 T241 | F184-S237 WeakPolarHBondContact CE1-OG 3.41Å; D233-S237 VanDerWaalsContact O-CB 3.26Å; D233-S237 WeakPolarHBondContact O-CB 3.28Å; D233-S237 PolarHBondContact O-N 2.87Å; D233-S237 PolarHBondContact O-OG 3.25Å; I234-S237 WeakPolarHBondContact CA-OG 3.33Å; I234-S237 PolarHBondContact O-OG 2.04Å; S237-T241 VanDerWaalsContact O-CB 3.32Å; S237-T241 WeakPolarHBondContact O-CB 3.46Å; S237-T241 PolarHBondContact O-N 3.11Å; S237-T241 PolarHBondContact O-OG1 3.17Å |
| 238 | M | 97.8 | Very high | 96 | Very high | 0 Ų | 0 | 58.2 Ų | 58.2 | 0% | 0 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -68.4 | -40.5 | 174.2 | -170.5 | 60.3 | -172.3 | 0 | 0 | 112.1 | F184 Y214 L217 N218 Y221 I234 E235 D236 T241 R242 | F184-M238 HydrophobicContact CZ-CB 4.29Å; Y214-M238 HydrophobicContact CE2-CE 4.39Å; L217-M238 HydrophobicContact CD2-SD 4.04Å; L217-M238 HydrophobicContact CG-SD 3.97Å; N218-M238 HydrophobicContact CB-CE 3.71Å; N218-M238 WeakPolarHBondContact OD1-CE 3.42Å; Y221-M238 HydrophobicContact CD1-CG 4.34Å; Y221-M238 HydrophobicContact CD2-CB 3.53Å; Y221-M238 HydrophobicContact CD2-CG 3.46Å; Y221-M238 VanDerWaalsContact CD2-CG 3.46Å; Y221-M238 HydrophobicContact CD2-SD 4.42Å; Y221-M238 HydrophobicContact CE2-CB 3.56Å; Y221-M238 HydrophobicContact CE2-CG 3.78Å; Y221-M238 HydrophobicContact CG-CB 4.34Å; Y221-M238 HydrophobicContact CG-CG 3.75Å; Y221-M238 HydrophobicContact CG-SD 4.45Å; I234-M238 VanDerWaalsContact O-CB 3.31Å; I234-M238 WeakPolarHBondContact O-CB 3.47Å; I234-M238 PolarHBondContact O-N 3.04Å; E235-M238 PolarHBondContact O-N 3.49Å; D236-M238 PolarHBondContact O-N 3.45Å; M238-T241 PolarHBondContact O-N 3.05Å; M238-R242 HydrophobicContact CE-CG 3.91Å; M238-R242 HydrophobicContact CG-CG 4.44Å; M238-R242 WeakPolarHBondContact O-CB 3.12Å; M238-R242 VanDerWaalsContact O-CG 3.31Å; M238-R242 WeakPolarHBondContact O-CG 3.42Å; M238-R242 PolarHBondContact O-N 3.22Å |
| 239 | N | 97.5 | Very high | 96 | Very high | 104 Ų | 104 | 48.5 Ų | 48.5 | 56% | 0.556 | 23% | 0.233 | S | C | * | . | H | α-helix | trans | -63.2 | -45.7 | 178.1 | -168.6 | 9.4 | 0 | 0 | 0 | 111.2 | E235 D236 T241 R242 R243 | E235-N239 VanDerWaalsContact O-CB 3.22Å; E235-N239 WeakPolarHBondContact O-CB 3.48Å; E235-N239 PolarHBondContact O-N 2.83Å; D236-N239 PolarHBondContact O-N 3.5Å; N239-T241 VanDerWaalsContact C-N 3.34Å; N239-T241 PolarHBondContact O-N 3.37Å; N239-R242 PolarHBondContact O-N 3.06Å; N239-R243 PolarHBondContact O-N 3.31Å |
| 240 | M | 96.6 | Very high | 95.9 | Very high | 89 Ų | 89 | 52.4 Ų | 52.4 | 44% | 0.438 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -60.7 | -42.9 | 173.8 | -72.1 | -58.5 | -64.4 | 0 | 0 | 111.7 | D236 R242 R243 L244 | D236-M240 WeakPolarHBondContact O-CB 3.42Å; D236-M240 VanDerWaalsContact O-CG 3.32Å; D236-M240 WeakPolarHBondContact O-CG 3.42Å; D236-M240 PolarHBondContact O-N 3.47Å; M240-R242 PolarHBondContact O-N 3.32Å; M240-R243 PolarHBondContact O-N 2.92Å; M240-L244 WeakPolarHBondContact O-CG 3.26Å; M240-L244 PolarHBondContact O-N 2.85Å |
| 241 | T | 97.1 | Very high | 95.7 | Very high | 4 Ų | 4 | 51.7 Ų | 51.7 | 3% | 0.025 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -64.3 | -41 | 176.8 | -56.7 | 0 | 0 | 0 | 0 | 112 | L188 F195 Y214 L217 S237 M238 N239 L244 W245 | L188-T241 HydrophobicContact CD1-CG2 4.4Å; L188-T241 VanDerWaalsContact CD1-OG1 3.24Å; L188-T241 WeakPolarHBondContact CD1-OG1 3.4Å; F195-T241 HydrophobicContact CE2-CG2 3.87Å; F195-T241 HydrophobicContact CZ-CG2 4.32Å; Y214-T241 HydrophobicContact CD2-CG2 4.2Å; Y214-T241 HydrophobicContact CE2-CG2 4.13Å; L217-T241 HydrophobicContact CD2-CG2 3.9Å; S237-T241 VanDerWaalsContact O-CB 3.32Å; S237-T241 WeakPolarHBondContact O-CB 3.46Å; S237-T241 PolarHBondContact O-N 3.11Å; S237-T241 PolarHBondContact O-OG1 3.17Å; M238-T241 PolarHBondContact O-N 3.05Å; N239-T241 VanDerWaalsContact C-N 3.34Å; N239-T241 PolarHBondContact O-N 3.37Å; T241-L244 PolarHBondContact O-N 3.5Å; T241-W245 WeakPolarHBondContact O-CB 3.38Å; T241-W245 PolarHBondContact O-N 3.3Å |
| 242 | R | 96.9 | Very high | 95.1 | Very high | 79 Ų | 79 | 55 Ų | 55 | 30% | 0.298 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -63.3 | -41.1 | 173.8 | -76.3 | 173.5 | 172 | 160.4 | 2.6 | 111.4 | Y214 N218 M238 N239 M240 W245 S246 | Y214-R242 WeakPolarHBondContact OH-CG 3.2Å; N218-R242 PolarHBondContact OD1-NE 3.17Å; N218-R242 PolarHBondContact OD1-NH2 2.93Å; M238-R242 HydrophobicContact CE-CG 3.91Å; M238-R242 HydrophobicContact CG-CG 4.44Å; M238-R242 WeakPolarHBondContact O-CB 3.12Å; M238-R242 VanDerWaalsContact O-CG 3.31Å; M238-R242 WeakPolarHBondContact O-CG 3.42Å; M238-R242 PolarHBondContact O-N 3.22Å; N239-R242 PolarHBondContact O-N 3.06Å; M240-R242 PolarHBondContact O-N 3.32Å; R242-W245 PolarHBondContact O-N 3.44Å; R242-S246 VanDerWaalsContact O-CB 3.26Å; R242-S246 WeakPolarHBondContact O-CB 3.35Å; R242-S246 PolarHBondContact O-N 3.22Å; R242-S246 PolarHBondContact O-OG 3.44Å |
| 243 | R | 95.6 | Very high | 94 | Very high | 153 Ų | 153 | 59 Ų | 59 | 58% | 0.577 | 29% | 0.288 | S | S | * | . | H | α-helix | trans | -64.3 | -44.9 | 175.7 | -173.4 | 176.3 | 179.5 | 173.6 | 1 | 111.2 | N239 M240 S246 K247 N248 | N239-R243 PolarHBondContact O-N 3.31Å; M240-R243 PolarHBondContact O-N 2.92Å; R243-S246 PolarHBondContact O-N 3.47Å; R243-K247 HydrophobicContact CG-CB 4.32Å; R243-K247 HydrophobicContact CG-CG 4.39Å; R243-K247 WeakPolarHBondContact O-CA 3.02Å; R243-K247 WeakPolarHBondContact O-CB 3.15Å; R243-K247 PolarHBondContact O-N 2.93Å; R243-N248 PolarHBondContact O-N 3.04Å |
| 244 | L | 94.8 | Very high | 92.6 | Very high | 50 Ų | 50 | 64.4 Ų | 64.4 | 26% | 0.262 | 32% | 0.323 | S | S | . | . | I | π-helix | trans | -56.8 | -52.8 | 174.2 | -76.2 | 174.6 | 0 | 0 | 0 | 111.2 | L192 M240 T241 S246 N248 F249 | L192-L244 HydrophobicContact CD2-CD1 4.36Å; M240-L244 WeakPolarHBondContact O-CG 3.26Å; M240-L244 PolarHBondContact O-N 2.85Å; T241-L244 PolarHBondContact O-N 3.5Å; L244-S246 PolarHBondContact O-N 3.1Å; L244-N248 HydrophobicContact CD2-CB 4.24Å; L244-N248 WeakPolarHBondContact O-CB 3.32Å; L244-N248 PolarHBondContact O-N 2.83Å; L244-F249 HydrophobicContact CB-CE2 4.15Å; L244-F249 VanDerWaalsContact O-CD2 3.25Å; L244-F249 WeakPolarHBondContact O-CD2 3.29Å; L244-F249 WeakPolarHBondContact O-CG 3.35Å; L244-F249 PolarHBondContact O-N 3.13Å |
| 245 | W | 95.2 | Very high | 91 | Very high | 17 Ų | 17 | 73.9 Ų | 73.9 | 6% | 0.064 | 36% | 0.359 | C | S | . | . | I | π-helix | trans | -59.7 | -47.2 | 179.8 | -178.2 | -97.3 | 0 | 0 | 0 | 112.8 | F195 L206 C210 K211 Y214 T241 R242 N250 C251 | F195-W245 AromaticContact CE1-CE3 3.62Å; F195-W245 HydrophobicContact CE1-CE3 3.62Å; F195-W245 AromaticContact CE1-CZ3 3.76Å; F195-W245 HydrophobicContact CE1-CZ3 3.76Å; F195-W245 AromaticContact CZ-CE3 3.59Å; F195-W245 HydrophobicContact CZ-CE3 3.59Å; F195-W245 HydrophobicContact CZ-CZ3 4.2Å; L206-W245 HydrophobicContact CD2-CE3 4.45Å; L206-W245 HydrophobicContact CD2-CZ3 4.11Å; C210-W245 HydrophobicContact CB-CZ3 4.2Å; K211-W245 HydrophobicContact CB-CH2 4.28Å; Y214-W245 AromaticContact CD1-CD1 3.98Å; Y214-W245 AromaticContact CD1-CD2 3.58Å; Y214-W245 HydrophobicContact CD1-CD2 3.58Å; Y214-W245 AromaticContact CD1-CE2 3.46Å; Y214-W245 VanDerWaalsContact CD1-CE2 3.46Å; Y214-W245 HydrophobicContact CD1-CE3 4.11Å; Y214-W245 AromaticContact CD1-CG 3.91Å; Y214-W245 HydrophobicContact CD1-CG 3.91Å; Y214-W245 HydrophobicContact CD1-CH2 4.4Å; Y214-W245 AromaticContact CD1-CZ2 3.9Å; Y214-W245 HydrophobicContact CD1-CZ2 3.9Å; Y214-W245 HydrophobicContact CD1-CZ3 4.49Å; Y214-W245 AromaticContact CD1-NE1 3.73Å; Y214-W245 HydrophobicContact CD2-CB 4.3Å; Y214-W245 HydrophobicContact CD2-CD2 4.15Å; Y214-W245 HydrophobicContact CD2-CE3 4.27Å; Y214-W245 HydrophobicContact CD2-CG 4.19Å; Y214-W245 HydrophobicContact CE1-CB 4.37Å; Y214-W245 AromaticContact CE1-CD1 3.39Å; Y214-W245 AromaticContact CE1-CD2 3.79Å; Y214-W245 HydrophobicContact CE1-CD2 3.79Å; Y214-W245 AromaticContact CE1-CE2 3.69Å; Y214-W245 AromaticContact CE1-CG 3.6Å; Y214-W245 HydrophobicContact CE1-CG 3.6Å; Y214-W245 HydrophobicContact CE1-CZ2 4.5Å; Y214-W245 AromaticContact CE1-NE1 3.45Å; Y214-W245 HydrophobicContact CE2-CB 3.83Å; Y214-W245 HydrophobicContact CE2-CD2 4.33Å; Y214-W245 AromaticContact CE2-CG 3.9Å; Y214-W245 HydrophobicContact CE2-CG 3.9Å; Y214-W245 AromaticContact CG-CD2 3.76Å; Y214-W245 HydrophobicContact CG-CD2 3.76Å; Y214-W245 AromaticContact CG-CE3 3.87Å; Y214-W245 HydrophobicContact CG-CE3 3.87Å; Y214-W245 HydrophobicContact CG-CG 4.18Å; Y214-W245 HydrophobicContact CG-CZ2 4.48Å; Y214-W245 HydrophobicContact CG-CZ3 4.28Å; Y214-W245 AromaticContact CZ-CD1 3.61Å; Y214-W245 AromaticContact CZ-CG 3.58Å; T241-W245 WeakPolarHBondContact O-CB 3.38Å; T241-W245 PolarHBondContact O-N 3.3Å; R242-W245 PolarHBondContact O-N 3.44Å; W245-N250 PolarHBondContact O-N 2.97Å; W245-C251 HydrophobicContact CD2-CB 3.59Å; W245-C251 HydrophobicContact CE3-CB 4.02Å; W245-C251 HydrophobicContact CG-CB 4.1Å; W245-C251 HydrophobicContact CH2-CB 3.9Å; W245-C251 HydrophobicContact CZ2-CB 3.44Å; W245-C251 VanDerWaalsContact CZ2-CB 3.44Å; W245-C251 HydrophobicContact CZ3-CB 4.17Å; W245-C251 PolarHBondContact NE1-O 3.15Å; W245-C251 WeakPolarHBondContact O-CB 3.27Å; W245-C251 PolarHBondContact O-N 3.38Å |
| 246 | S | 93.8 | Very high | 89.4 | Confident | 34 Ų | 34 | 74.1 Ų | 74.1 | 24% | 0.238 | 38% | 0.375 | C | S | . | . | I | π-helix | trans | -88.1 | -41.4 | -169.2 | 62 | 0 | 0 | 0 | 0 | 114.7 | R242 R243 L244 N250 S252 | R242-S246 VanDerWaalsContact O-CB 3.26Å; R242-S246 WeakPolarHBondContact O-CB 3.35Å; R242-S246 PolarHBondContact O-N 3.22Å; R242-S246 PolarHBondContact O-OG 3.44Å; R243-S246 PolarHBondContact O-N 3.47Å; L244-S246 PolarHBondContact O-N 3.1Å; S246-N250 WeakPolarHBondContact O-CA 3.07Å; S246-N250 PolarHBondContact O-OD1 2.86Å; S246-S252 WeakPolarHBondContact CA-OG 3.47Å; S246-S252 WeakPolarHBondContact CB-OG 3.23Å; S246-S252 PolarHBondContact O-OG 3.05Å |
| 247 | K | 92.7 | Very high | 88.1 | Confident | 151 Ų | 151 | 77.9 Ų | 77.9 | 66% | 0.657 | 39% | 0.392 | S | S | * | . | I | π-helix | trans | -102.1 | -40.1 | -172.5 | -64 | -63.4 | -174.7 | 179.4 | 0 | 112.7 | R243 N250 | R243-K247 HydrophobicContact CG-CB 4.32Å; R243-K247 HydrophobicContact CG-CG 4.39Å; R243-K247 WeakPolarHBondContact O-CA 3.02Å; R243-K247 WeakPolarHBondContact O-CB 3.15Å; R243-K247 PolarHBondContact O-N 2.93Å; K247-N250 PolarHBondContact O-OD1 3.47Å |
| 248 | N | 92.5 | Very high | 87.1 | Confident | 88 Ų | 88 | 81.7 Ų | 81.7 | 47% | 0.471 | 41% | 0.411 | S | S | . | . | I | π-helix | trans | -81.6 | -45.4 | -177.9 | -64.6 | 36.6 | 0 | 0 | 0 | 110.6 | R243 L244 | R243-N248 PolarHBondContact O-N 3.04Å; L244-N248 HydrophobicContact CD2-CB 4.24Å; L244-N248 WeakPolarHBondContact O-CB 3.32Å; L244-N248 PolarHBondContact O-N 2.83Å |
| 249 | F | 92.6 | Very high | 86.6 | Confident | 15 Ų | 15 | 87 Ų | 87 | 7% | 0.066 | 44% | 0.443 | C | S | . | . | S | Bend | trans | -94.9 | -11.4 | -179.3 | -53.7 | -41.2 | 0 | 0 | 0 | 114.1 | F195 Q199 L206 L244 C251 | F195-F249 HydrophobicContact CB-CE2 4.02Å; F195-F249 HydrophobicContact CB-CZ 4.36Å; F195-F249 AromaticContact CD2-CE2 3.78Å; F195-F249 HydrophobicContact CD2-CE2 3.78Å; F195-F249 HydrophobicContact CE2-CE2 4.38Å; F195-F249 AromaticContact CG-CE2 3.92Å; F195-F249 HydrophobicContact CG-CE2 3.92Å; Q199-F249 HydrophobicContact CG-CE1 4.4Å; L206-F249 HydrophobicContact CD1-CD1 4.16Å; L206-F249 HydrophobicContact CD1-CD2 4.1Å; L206-F249 HydrophobicContact CD1-CE1 4.13Å; L206-F249 HydrophobicContact CD1-CE2 4.07Å; L206-F249 HydrophobicContact CD1-CG 4.16Å; L206-F249 HydrophobicContact CD1-CZ 4.09Å; L206-F249 HydrophobicContact CD2-CB 4.24Å; L206-F249 HydrophobicContact CD2-CD2 3.76Å; L206-F249 HydrophobicContact CD2-CE2 4.33Å; L206-F249 HydrophobicContact CD2-CG 4.04Å; L244-F249 HydrophobicContact CB-CE2 4.15Å; L244-F249 VanDerWaalsContact O-CD2 3.25Å; L244-F249 WeakPolarHBondContact O-CD2 3.29Å; L244-F249 WeakPolarHBondContact O-CG 3.35Å; L244-F249 PolarHBondContact O-N 3.13Å; F249-C251 VanDerWaalsContact CB-SG 3.54Å; F249-C251 PolarHBondContact O-N 3.18Å |
| 250 | N | 91.7 | Very high | 86.2 | Confident | 115 Ų | 115 | 85.1 Ų | 85.1 | 62% | 0.615 | 44% | 0.436 | S | S | * | . | trans | 54.3 | 34.2 | -177.8 | -68.8 | -27.8 | 0 | 0 | 0 | 114.1 | W245 S246 K247 S252 | W245-N250 PolarHBondContact O-N 2.97Å; S246-N250 WeakPolarHBondContact O-CA 3.07Å; S246-N250 PolarHBondContact O-OD1 2.86Å; K247-N250 PolarHBondContact O-OD1 3.47Å; N250-S252 PolarHBondContact O-N 3.48Å | ||
| 251 | C | 91.3 | Very high | 85.9 | Confident | 3 Ų | 3 | 85.1 Ų | 85.1 | 2% | 0.02 | 44% | 0.441 | C | S | . | . | trans | -80.7 | 9.7 | -180 | -59.5 | 0 | 0 | 0 | 0 | 114 | C207 W245 F249 F253 | C207-C251 WeakPolarHBondContact CA-SG 3.43Å; C207-C251 HydrophobicContact CB-CB 3.64Å; C207-C251 WeakPolarHBondContact CB-SG 3.47Å; C207-C251 WeakPolarHBondContact SG-CA 3.34Å; C207-C251 WeakPolarHBondContact SG-CB 3.39Å; C207-C251 CovalentContact SG-SG 2.03Å; C207-C251 PolarHBondContact SG-SG 3.4Å; W245-C251 HydrophobicContact CD2-CB 3.59Å; W245-C251 HydrophobicContact CE3-CB 4.02Å; W245-C251 HydrophobicContact CG-CB 4.1Å; W245-C251 HydrophobicContact CH2-CB 3.9Å; W245-C251 HydrophobicContact CZ2-CB 3.44Å; W245-C251 VanDerWaalsContact CZ2-CB 3.44Å; W245-C251 HydrophobicContact CZ3-CB 4.17Å; W245-C251 PolarHBondContact NE1-O 3.15Å; W245-C251 WeakPolarHBondContact O-CB 3.27Å; W245-C251 PolarHBondContact O-N 3.38Å; F249-C251 VanDerWaalsContact CB-SG 3.54Å; F249-C251 PolarHBondContact O-N 3.18Å; C251-F253 VanDerWaalsContact O-CD2 3.28Å; C251-F253 WeakPolarHBondContact O-CD2 3.33Å; C251-F253 WeakPolarHBondContact O-CE2 3.26Å; C251-F253 PolarHBondContact O-N 3.47Å | ||
| 252 | S | 84.7 | Confident | 85.6 | Confident | 71 Ų | 71 | 90.4 Ų | 90.4 | 50% | 0.497 | 47% | 0.468 | S | S | . | . | trans | -82 | 102.8 | 178.5 | -37.8 | 0 | 0 | 0 | 0 | 109.6 | S246 N250 | S246-S252 WeakPolarHBondContact CA-OG 3.47Å; S246-S252 WeakPolarHBondContact CB-OG 3.23Å; S246-S252 PolarHBondContact O-OG 3.05Å; N250-S252 PolarHBondContact O-N 3.48Å | ||
| 253 | F | 75.1 | Confident | 85.4 | Confident | 138 Ų | 138 | 89.4 Ų | 89.4 | 61% | 0.605 | 48% | 0.477 | S | S | * | . | P | Polyproline II helix | trans | -94.5 | 126.2 | 174.5 | -60.2 | -79 | 0 | 0 | 0 | 110 | C207 C251 R255 | C207-F253 HydrophobicContact CB-CE2 4.2Å; C207-F253 HydrophobicContact CB-CZ 4.39Å; C251-F253 VanDerWaalsContact O-CD2 3.28Å; C251-F253 WeakPolarHBondContact O-CD2 3.33Å; C251-F253 WeakPolarHBondContact O-CE2 3.26Å; C251-F253 PolarHBondContact O-N 3.47Å; F253-R255 PolarHBondContact O-N 3.18Å |
| 254 | P | 66.9 | Low | 85.4 | Confident | 113 Ų | 113 | 86.3 Ų | 86.3 | 73% | 0.734 | 48% | 0.475 | S | S | * | . | P | Polyproline II helix | trans | -59.9 | 134.4 | 172.6 | 23.5 | -30.3 | 0 | 0 | 0 | 109.4 | A256 | P254-A256 PolarHBondContact O-N 3.43Š|
| 255 | R | 66.2 | Low | 85.4 | Confident | 200 Ų | 200 | 86.9 Ų | 86.9 | 76% | 0.755 | 48% | 0.483 | S | S | * | . | P | Polyproline II helix | trans | -64.7 | 134.6 | 178.8 | -148.9 | 178.6 | -159.6 | 153.9 | 6.2 | 108.7 | F253 E257 | F253-R255 PolarHBondContact O-N 3.18Å; R255-E257 HydrophobicContact CB-CG 4.26Å; R255-E257 HydrophobicContact CG-CG 3.89Å; R255-E257 PolarHBondContact O-N 2.84Å |
| 256 | A | 63.5 | Low | 85.4 | Confident | 89 Ų | 89 | 88.4 Ų | 88.4 | 74% | 0.736 | 50% | 0.496 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.2 | 34.5 | -179.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | P254 | P254-A256 PolarHBondContact O-N 3.43Š|
| 257 | E | 69.3 | Low | 85.6 | Confident | 103 Ų | 103 | 92.8 Ų | 92.8 | 48% | 0.481 | 51% | 0.511 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -85.9 | 0.9 | 175.6 | -57.7 | -63.4 | 164.4 | 0 | 0 | 111.9 | R255 V259 P260 V261 | R255-E257 HydrophobicContact CB-CG 4.26Å; R255-E257 HydrophobicContact CG-CG 3.89Å; R255-E257 PolarHBondContact O-N 2.84Å; E257-V259 VanDerWaalsContact C-N 3.27Å; E257-V259 PolarHBondContact O-N 3.4Å; E257-P260 VanDerWaalsContact O-CD 3.28Å; E257-P260 WeakPolarHBondContact O-CD 3.34Å; E257-P260 WeakPolarHBondContact O-CG 3.2Å; E257-V261 WeakPolarHBondContact O-CB 3.32Å; E257-V261 WeakPolarHBondContact O-CG2 3.25Å; E257-V261 PolarHBondContact O-N 3.04Å |
| 258 | N | 78.6 | Confident | 85.7 | Confident | 99 Ų | 99 | 91 Ų | 91 | 53% | 0.529 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -61.7 | -38.2 | -178.4 | -61.4 | -12.6 | 0 | 0 | 0 | 111.3 | I262 | N258-I262 HydrophobicContact CB-CD1 4.3Å; N258-I262 VanDerWaalsContact O-CB 3.26Å; N258-I262 WeakPolarHBondContact O-CB 3.45Å; N258-I262 VanDerWaalsContact O-CD1 3.31Å; N258-I262 WeakPolarHBondContact O-CD1 3.45Å; N258-I262 WeakPolarHBondContact O-CG1 3.41Å; N258-I262 PolarHBondContact O-N 3.24Å |
| 259 | V | 85.6 | Confident | 85.9 | Confident | 113 Ų | 113 | 92 Ų | 92 | 69% | 0.685 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -63.6 | -55.7 | -176.9 | -178.9 | 0 | 0 | 0 | 0 | 112.4 | E257 V261 I262 A263 | E257-V259 VanDerWaalsContact C-N 3.27Å; E257-V259 PolarHBondContact O-N 3.4Å; V259-V261 VanDerWaalsContact C-N 3.33Å; V259-V261 PolarHBondContact O-N 2.85Å; V259-I262 PolarHBondContact O-N 3.15Å; V259-A263 WeakPolarHBondContact O-CB 3.24Å; V259-A263 PolarHBondContact O-N 3.2Å |
| 260 | P | 88.9 | Confident | 86 | Confident | 63 Ų | 63 | 96.6 Ų | 96.6 | 41% | 0.409 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -63.4 | -37.8 | 178.2 | 22.6 | -32.6 | 0 | 0 | 0 | 112.4 | E257 A263 V264 | E257-P260 VanDerWaalsContact O-CD 3.28Å; E257-P260 WeakPolarHBondContact O-CD 3.34Å; E257-P260 WeakPolarHBondContact O-CG 3.2Å; P260-A263 PolarHBondContact O-N 2.96Å; P260-V264 WeakPolarHBondContact O-CG2 3.05Å; P260-V264 PolarHBondContact O-N 3.28Å |
| 261 | V | 90.4 | Very high | 86.2 | Confident | 89 Ų | 89 | 94.7 Ų | 94.7 | 54% | 0.539 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -63.9 | -45.8 | 178.4 | 173 | 0 | 0 | 0 | 0 | 111.5 | E257 V259 S265 | E257-V261 WeakPolarHBondContact O-CB 3.32Å; E257-V261 WeakPolarHBondContact O-CG2 3.25Å; E257-V261 PolarHBondContact O-N 3.04Å; V259-V261 VanDerWaalsContact C-N 3.33Å; V259-V261 PolarHBondContact O-N 2.85Å; V261-S265 VanDerWaalsContact O-CB 3.26Å; V261-S265 WeakPolarHBondContact O-CB 3.25Å; V261-S265 PolarHBondContact O-N 3.03Å; V261-S265 PolarHBondContact O-OG 3.43Å |
| 262 | I | 90.5 | Very high | 86.3 | Confident | 115 Ų | 115 | 97.7 Ų | 97.7 | 59% | 0.59 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -63.3 | -43.2 | 177 | -69.7 | 165 | 0 | 0 | 0 | 110.4 | N258 V259 S265 S266 | N258-I262 HydrophobicContact CB-CD1 4.3Å; N258-I262 VanDerWaalsContact O-CB 3.26Å; N258-I262 WeakPolarHBondContact O-CB 3.45Å; N258-I262 VanDerWaalsContact O-CD1 3.31Å; N258-I262 WeakPolarHBondContact O-CD1 3.45Å; N258-I262 WeakPolarHBondContact O-CG1 3.41Å; N258-I262 PolarHBondContact O-N 3.24Å; V259-I262 PolarHBondContact O-N 3.15Å; I262-S265 PolarHBondContact O-N 2.92Å; I262-S266 WeakPolarHBondContact O-CB 3.43Å; I262-S266 PolarHBondContact O-N 2.95Å |
| 263 | A | 93.6 | Very high | 86.8 | Confident | 58 Ų | 58 | 97.6 Ų | 97.6 | 48% | 0.479 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -62.4 | -48.1 | -179.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | V259 P260 S266 F267 | V259-A263 WeakPolarHBondContact O-CB 3.24Å; V259-A263 PolarHBondContact O-N 3.2Å; P260-A263 PolarHBondContact O-N 2.96Å; A263-S266 PolarHBondContact O-N 2.94Å; A263-F267 WeakPolarHBondContact O-CB 3.48Å; A263-F267 PolarHBondContact O-N 3.32Å |
| 264 | V | 95.9 | Very high | 87.7 | Confident | 89 Ų | 89 | 95.9 Ų | 95.9 | 54% | 0.539 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -65.2 | -44.1 | 178.8 | 173.5 | 0 | 0 | 0 | 0 | 111 | P260 S266 F267 M268 | P260-V264 WeakPolarHBondContact O-CG2 3.05Å; P260-V264 PolarHBondContact O-N 3.28Å; V264-S266 PolarHBondContact O-N 3.37Å; V264-F267 PolarHBondContact O-N 3.34Å; V264-M268 WeakPolarHBondContact O-CG 3.45Å; V264-M268 PolarHBondContact O-N 2.86Å |
| 265 | S | 95.3 | Very high | 89 | Confident | 61 Ų | 61 | 96.5 Ų | 96.5 | 43% | 0.427 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -62.7 | -43.5 | 178.8 | -56.1 | 0 | 0 | 0 | 0 | 111.5 | V261 I262 M268 L269 | V261-S265 VanDerWaalsContact O-CB 3.26Å; V261-S265 WeakPolarHBondContact O-CB 3.25Å; V261-S265 PolarHBondContact O-N 3.03Å; V261-S265 PolarHBondContact O-OG 3.43Å; I262-S265 PolarHBondContact O-N 2.92Å; S265-M268 PolarHBondContact O-N 3.37Å; S265-L269 WeakPolarHBondContact O-CG 3.05Å; S265-L269 PolarHBondContact O-N 3.06Å |
| 266 | S | 95.1 | Very high | 90.3 | Very high | 49 Ų | 49 | 94.9 Ų | 94.9 | 34% | 0.343 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -61.3 | -48.5 | 176.5 | -179.2 | 0 | 0 | 0 | 0 | 111.6 | I262 A263 V264 M268 L269 F270 | I262-S266 WeakPolarHBondContact O-CB 3.43Å; I262-S266 PolarHBondContact O-N 2.95Å; A263-S266 PolarHBondContact O-N 2.94Å; V264-S266 PolarHBondContact O-N 3.37Å; S266-M268 VanDerWaalsContact C-N 3.34Å; S266-M268 PolarHBondContact O-N 3.2Å; S266-L269 WeakPolarHBondContact O-CB 3.37Å; S266-L269 PolarHBondContact O-N 3.4Å; S266-L269 VanDerWaalsContact O-N 3.11Å; S266-F270 WeakPolarHBondContact O-CD2 3.44Å; S266-F270 PolarHBondContact O-N 3.32Å; S266-F270 VanDerWaalsContact O-N 3.16Å; S266-F270 WeakPolarHBondContact OG-CE2 3.36Å |
| 267 | F | 96.4 | Very high | 91.7 | Very high | 126 Ų | 126 | 94.9 Ų | 94.9 | 55% | 0.553 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -57.1 | -46.5 | 177.8 | 179.4 | -103.5 | 0 | 0 | 0 | 112.2 | A263 V264 L269 F270 L271 | A263-F267 WeakPolarHBondContact O-CB 3.48Å; A263-F267 PolarHBondContact O-N 3.32Å; V264-F267 PolarHBondContact O-N 3.34Å; F267-L269 VanDerWaalsContact C-N 3.27Å; F267-L269 PolarHBondContact O-N 3.34Å; F267-F270 PolarHBondContact O-N 2.82Å; F267-F270 VanDerWaalsContact O-N 3.14Å; F267-L271 HydrophobicContact CD1-CD1 4.18Å; F267-L271 HydrophobicContact CD1-CG 4.45Å; F267-L271 HydrophobicContact CE1-CD1 3.8Å; F267-L271 HydrophobicContact CE1-CD2 4.1Å; F267-L271 HydrophobicContact CE1-CG 4.12Å; F267-L271 HydrophobicContact CE2-CD2 4.33Å; F267-L271 HydrophobicContact CZ-CD1 4.38Å; F267-L271 HydrophobicContact CZ-CD2 3.83Å; F267-L271 HydrophobicContact CZ-CG 4.3Å; F267-L271 WeakPolarHBondContact O-CG 3.25Å; F267-L271 PolarHBondContact O-N 3.26Å |
| 268 | M | 96.4 | Very high | 92.7 | Very high | 114 Ų | 114 | 92.6 Ų | 92.6 | 56% | 0.562 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -61.5 | -33.2 | 178.1 | -70.9 | -64.2 | 177.7 | 0 | 0 | 113 | V264 S265 S266 L271 P272 | V264-M268 WeakPolarHBondContact O-CG 3.45Å; V264-M268 PolarHBondContact O-N 2.86Å; S265-M268 PolarHBondContact O-N 3.37Å; S266-M268 VanDerWaalsContact C-N 3.34Å; S266-M268 PolarHBondContact O-N 3.2Å; M268-L271 HydrophobicContact SD-CD1 3.88Å; M268-P272 VanDerWaalsContact O-CD 3.27Å; M268-P272 WeakPolarHBondContact O-CD 3.45Å |
| 269 | L | 96.1 | Very high | 93.2 | Very high | 108 Ų | 108 | 90.5 Ų | 90.5 | 57% | 0.565 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -72.8 | -29.2 | 176.2 | -71.6 | 170.5 | 0 | 0 | 0 | 113.5 | S265 S266 F267 P272 | S265-L269 WeakPolarHBondContact O-CG 3.05Å; S265-L269 PolarHBondContact O-N 3.06Å; S266-L269 WeakPolarHBondContact O-CB 3.37Å; S266-L269 PolarHBondContact O-N 3.4Å; S266-L269 VanDerWaalsContact O-N 3.11Å; F267-L269 VanDerWaalsContact C-N 3.27Å; F267-L269 PolarHBondContact O-N 3.34Å; L269-P272 WeakPolarHBondContact O-CD 3.48Å |
| 270 | F | 95.1 | Very high | 93.2 | Very high | 112 Ų | 112 | 91.9 Ų | 91.9 | 49% | 0.491 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -81.2 | -24 | 179 | -76.6 | -67.8 | 0 | 0 | 0 | 113.7 | S266 F267 I273 I274 | S266-F270 WeakPolarHBondContact O-CD2 3.44Å; S266-F270 PolarHBondContact O-N 3.32Å; S266-F270 VanDerWaalsContact O-N 3.16Å; S266-F270 WeakPolarHBondContact OG-CE2 3.36Å; F267-F270 PolarHBondContact O-N 2.82Å; F267-F270 VanDerWaalsContact O-N 3.14Å; F270-I273 HydrophobicContact CD1-CD1 4.08Å; F270-I273 HydrophobicContact CE1-CD1 4.47Å; F270-I273 PolarHBondContact O-N 2.93Å; F270-I273 VanDerWaalsContact O-N 3.16Å; F270-I274 HydrophobicContact CB-CD1 4.37Å; F270-I274 WeakPolarHBondContact O-CG1 3.36Å; F270-I274 PolarHBondContact O-N 2.92Å |
| 271 | L | 94.9 | Very high | 93 | Very high | 75 Ų | 75 | 95.3 Ų | 95.3 | 39% | 0.393 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -56.3 | -47.3 | -179.6 | -71.9 | 174.1 | 0 | 0 | 0 | 113.7 | F267 M268 I273 I274 F275 | F267-L271 HydrophobicContact CD1-CD1 4.18Å; F267-L271 HydrophobicContact CD1-CG 4.45Å; F267-L271 HydrophobicContact CE1-CD1 3.8Å; F267-L271 HydrophobicContact CE1-CD2 4.1Å; F267-L271 HydrophobicContact CE1-CG 4.12Å; F267-L271 HydrophobicContact CE2-CD2 4.33Å; F267-L271 HydrophobicContact CZ-CD1 4.38Å; F267-L271 HydrophobicContact CZ-CD2 3.83Å; F267-L271 HydrophobicContact CZ-CG 4.3Å; F267-L271 WeakPolarHBondContact O-CG 3.25Å; F267-L271 PolarHBondContact O-N 3.26Å; M268-L271 HydrophobicContact SD-CD1 3.88Å; L271-I273 VanDerWaalsContact C-N 3.34Å; L271-I273 PolarHBondContact O-N 2.74Å; L271-I274 PolarHBondContact O-N 2.04Å; L271-F275 WeakPolarHBondContact O-CB 3.41Å; L271-F275 PolarHBondContact O-N 2.75Å |
| 272 | P | 94.4 | Very high | 92.6 | Very high | 66 Ų | 66 | 99.4 Ų | 99.4 | 43% | 0.429 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -61.9 | -39.8 | 175.6 | -23.2 | 33.4 | 0 | 0 | 0 | 112.9 | M268 L269 F275 Y276 | M268-P272 VanDerWaalsContact O-CD 3.27Å; M268-P272 WeakPolarHBondContact O-CD 3.45Å; L269-P272 WeakPolarHBondContact O-CD 3.48Å; P272-F275 PolarHBondContact O-N 2.85Å; P272-Y276 WeakPolarHBondContact O-CD2 3.44Å; P272-Y276 PolarHBondContact O-N 3.48Å |
| 273 | I | 94.3 | Very high | 91.8 | Very high | 70 Ų | 70 | 98.2 Ų | 98.2 | 36% | 0.359 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -62.1 | -48.6 | 179.8 | -59.5 | 174.6 | 0 | 0 | 0 | 109.6 | F270 L271 F275 Y276 L277 | F270-I273 HydrophobicContact CD1-CD1 4.08Å; F270-I273 HydrophobicContact CE1-CD1 4.47Å; F270-I273 PolarHBondContact O-N 2.93Å; F270-I273 VanDerWaalsContact O-N 3.16Å; L271-I273 VanDerWaalsContact C-N 3.34Å; L271-I273 PolarHBondContact O-N 2.74Å; I273-F275 VanDerWaalsContact C-N 3.32Å; I273-F275 PolarHBondContact O-N 3.33Å; I273-Y276 PolarHBondContact O-N 3.37Å; I273-L277 HydrophobicContact CG2-CD1 3.88Å; I273-L277 HydrophobicContact CG2-CG 4.42Å; I273-L277 WeakPolarHBondContact O-CB 3.06Å; I273-L277 VanDerWaalsContact O-CG 3.27Å; I273-L277 WeakPolarHBondContact O-CG 3.5Å; I273-L277 PolarHBondContact O-N 3.22Å |
| 274 | I | 93.9 | Very high | 90.3 | Very high | 101 Ų | 101 | 103 Ų | 103 | 52% | 0.518 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -61.8 | -42.6 | 177.7 | -64.9 | 166.3 | 0 | 0 | 0 | 110.4 | F270 L271 L277 S278 | F270-I274 HydrophobicContact CB-CD1 4.37Å; F270-I274 WeakPolarHBondContact O-CG1 3.36Å; F270-I274 PolarHBondContact O-N 2.92Å; L271-I274 PolarHBondContact O-N 2.04Å; I274-L277 PolarHBondContact O-N 3Å; I274-S278 VanDerWaalsContact O-CB 3.27Å; I274-S278 WeakPolarHBondContact O-CB 3.43Å; I274-S278 PolarHBondContact O-N 3.46Å; I274-S278 PolarHBondContact O-OG 3.31Å; I274-S278 VanDerWaalsContact O-OG 3.08Å |
| 275 | F | 95 | Very high | 88.5 | Confident | 127 Ų | 127 | 107.6 Ų | 107.6 | 56% | 0.557 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -61.4 | -44.5 | 177.9 | 175.5 | -97.4 | 0 | 0 | 0 | 113 | L271 P272 I273 S278 S279 | L271-F275 WeakPolarHBondContact O-CB 3.41Å; L271-F275 PolarHBondContact O-N 2.75Å; P272-F275 PolarHBondContact O-N 2.85Å; I273-F275 VanDerWaalsContact C-N 3.32Å; I273-F275 PolarHBondContact O-N 3.33Å; F275-S278 PolarHBondContact O-OG 3.08Å; F275-S279 VanDerWaalsContact O-CB 3.29Å; F275-S279 WeakPolarHBondContact O-CB 3.35Å; F275-S279 PolarHBondContact O-N 3.35Å; F275-S279 PolarHBondContact O-OG 3.44Å |
| 276 | Y | 93.8 | Very high | 86.7 | Confident | 166 Ų | 166 | 114.1 Ų | 114.1 | 65% | 0.651 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -69.9 | -40.3 | 178.1 | -81.7 | -68.9 | 0 | 0 | 0 | 112.1 | P272 I273 S279 F280 | P272-Y276 WeakPolarHBondContact O-CD2 3.44Å; P272-Y276 PolarHBondContact O-N 3.48Å; I273-Y276 PolarHBondContact O-N 3.37Å; Y276-S279 PolarHBondContact O-N 3.02Å; Y276-F280 WeakPolarHBondContact O-CB 3.41Å; Y276-F280 PolarHBondContact O-N 3.04Å |
| 277 | L | 91.7 | Very high | 84.8 | Confident | 89 Ų | 89 | 121.1 Ų | 121.1 | 47% | 0.466 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -65.4 | -42.9 | 176.3 | -71.4 | 174.3 | 0 | 0 | 0 | 112 | I273 I274 F280 L281 | I273-L277 HydrophobicContact CG2-CD1 3.88Å; I273-L277 HydrophobicContact CG2-CG 4.42Å; I273-L277 WeakPolarHBondContact O-CB 3.06Å; I273-L277 VanDerWaalsContact O-CG 3.27Å; I273-L277 WeakPolarHBondContact O-CG 3.5Å; I273-L277 PolarHBondContact O-N 3.22Å; I274-L277 PolarHBondContact O-N 3Å; L277-F280 PolarHBondContact O-N 3.05Å; L277-L281 WeakPolarHBondContact O-CG 3.41Å; L277-L281 PolarHBondContact O-N 3.49Å |
| 278 | S | 90.3 | Very high | 83.1 | Confident | 55 Ų | 55 | 126.2 Ų | 126.2 | 39% | 0.385 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -64.7 | -43.2 | 177.7 | 67.5 | 0 | 0 | 0 | 0 | 111.1 | I274 F275 F280 L281 H282 | I274-S278 VanDerWaalsContact O-CB 3.27Å; I274-S278 WeakPolarHBondContact O-CB 3.43Å; I274-S278 PolarHBondContact O-N 3.46Å; I274-S278 PolarHBondContact O-OG 3.31Å; I274-S278 VanDerWaalsContact O-OG 3.08Å; F275-S278 PolarHBondContact O-OG 3.08Å; S278-F280 PolarHBondContact O-N 3.34Å; S278-L281 PolarHBondContact O-N 3.09Å; S278-H282 WeakPolarHBondContact O-CB 3.37Å; S278-H282 PolarHBondContact O-N 3.39Å |
| 279 | S | 89.1 | Confident | 81.2 | Confident | 54 Ų | 54 | 130.2 Ų | 130.2 | 38% | 0.378 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -61.7 | -41.8 | 175.1 | -61.4 | 0 | 0 | 0 | 0 | 112.2 | F275 Y276 H282 S283 | F275-S279 VanDerWaalsContact O-CB 3.29Å; F275-S279 WeakPolarHBondContact O-CB 3.35Å; F275-S279 PolarHBondContact O-N 3.35Å; F275-S279 PolarHBondContact O-OG 3.44Å; Y276-S279 PolarHBondContact O-N 3.02Å; S279-H282 PolarHBondContact O-N 3.29Å; S279-S283 WeakPolarHBondContact O-CB 3.46Å; S279-S283 PolarHBondContact O-N 2.82Å; S279-S283 VanDerWaalsContact O-N 3.11Å |
| 280 | F | 85.7 | Confident | 79.5 | Confident | 143 Ų | 143 | 132.8 Ų | 132.8 | 63% | 0.627 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -63.3 | -49 | 176.9 | 177.1 | -101.6 | 0 | 0 | 0 | 112 | Y276 L277 S278 H282 S283 | Y276-F280 WeakPolarHBondContact O-CB 3.41Å; Y276-F280 PolarHBondContact O-N 3.04Å; L277-F280 PolarHBondContact O-N 3.05Å; S278-F280 PolarHBondContact O-N 3.34Å; F280-H282 VanDerWaalsContact C-N 3.3Å; F280-H282 PolarHBondContact O-N 3.48Å; F280-S283 WeakPolarHBondContact O-CB 3.37Å; F280-S283 PolarHBondContact O-N 3.04Å; F280-S283 VanDerWaalsContact O-N 3.12Å |
| 281 | L | 84.7 | Confident | 78 | Confident | 134 Ų | 134 | 135 Ų | 135 | 70% | 0.702 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -63.1 | -35.6 | 177.9 | -69.9 | 173.2 | 0 | 0 | 0 | 112.4 | L277 S278 S283 | L277-L281 WeakPolarHBondContact O-CG 3.41Å; L277-L281 PolarHBondContact O-N 3.49Å; S278-L281 PolarHBondContact O-N 3.09Å; L281-S283 VanDerWaalsContact C-N 3.31Å; L281-S283 PolarHBondContact O-N 3.02Å |
| 282 | H | 82.5 | Confident | 76.5 | Confident | 175 Ų | 175 | 139.4 Ų | 139.4 | 81% | 0.81 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -75.2 | -15.7 | 176.2 | -119.3 | 90.1 | 0 | 0 | 0 | 114 | S278 S279 F280 | S278-H282 WeakPolarHBondContact O-CB 3.37Å; S278-H282 PolarHBondContact O-N 3.39Å; S279-H282 PolarHBondContact O-N 3.29Å; F280-H282 VanDerWaalsContact C-N 3.3Å; F280-H282 PolarHBondContact O-N 3.48Å |
| 283 | S | 73.6 | Confident | 75 | Confident | 91 Ų | 91 | 141.6 Ų | 141.6 | 64% | 0.636 | 68% | 0.682 | S | S | * | * | H | α-helix | trans | -78.7 | -25.8 | -175.8 | -154.5 | 0 | 0 | 0 | 0 | 113.4 | S279 F280 L281 Q285 | S279-S283 WeakPolarHBondContact O-CB 3.46Å; S279-S283 PolarHBondContact O-N 2.82Å; S279-S283 VanDerWaalsContact O-N 3.11Å; F280-S283 WeakPolarHBondContact O-CB 3.37Å; F280-S283 PolarHBondContact O-N 3.04Å; F280-S283 VanDerWaalsContact O-N 3.12Å; L281-S283 VanDerWaalsContact C-N 3.31Å; L281-S283 PolarHBondContact O-N 3.02Å; S283-Q285 PolarHBondContact O-N 2.9Å |
| 284 | E | 63.3 | Low | 73.2 | Confident | 157 Ų | 157 | 148.3 Ų | 148.3 | 73% | 0.734 | 71% | 0.708 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.8 | 32.5 | -166.3 | -92.4 | -89.9 | 140.7 | 0 | 0 | 115.5 | ||
| 285 | Q | 57.9 | Low | 71.8 | Confident | 186 Ų | 186 | 155 Ų | 155 | 87% | 0.869 | 73% | 0.727 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -127.2 | 17.2 | 166.7 | -72.1 | -158.4 | -6.8 | 0 | 0 | 116 | S283 K287 | S283-Q285 PolarHBondContact O-N 2.9Å; Q285-K287 VanDerWaalsContact C-N 3.34Å; Q285-K287 PolarHBondContact O-N 3.32Å |
| 286 | K | 56.2 | Low | 70 | Confident | 198 Ų | 198 | 153.3 Ų | 153.3 | 86% | 0.861 | 74% | 0.736 | S | S | * | * | trans | -93.7 | 68.7 | 156 | -86.9 | -177.8 | 178.7 | 174 | 0 | 109.8 | R288 | K286-R288 PolarHBondContact O-N 3.29Š| ||
| 287 | K | 56.5 | Low | 68.3 | Low | 196 Ų | 196 | 154.8 Ų | 154.8 | 85% | 0.852 | 75% | 0.746 | S | S | * | * | trans | -57.3 | 101.6 | 151.8 | -74.5 | -171.7 | -179.4 | -177.5 | 0 | 105.2 | Q285 K289 | Q285-K287 VanDerWaalsContact C-N 3.34Å; Q285-K287 PolarHBondContact O-N 3.32Å; K287-K289 PolarHBondContact O-N 3.13Å | ||
| 288 | R | 60.3 | Low | 66.5 | Low | 233 Ų | 233 | 155.8 Ų | 155.8 | 88% | 0.879 | 76% | 0.761 | S | S | * | * | trans | -53 | 109.4 | 170 | -66.1 | -170.9 | -160 | -174.2 | 6.4 | 104.8 | K286 L290 | K286-R288 PolarHBondContact O-N 3.29Å; R288-L290 VanDerWaalsContact C-N 3.33Å; R288-L290 PolarHBondContact O-N 2.97Å | ||
| 289 | K | 56.3 | Low | 64.6 | Low | 199 Ų | 199 | 160.4 Ų | 160.4 | 87% | 0.865 | 78% | 0.781 | S | S | * | * | trans | -57.3 | 109.2 | 166.1 | -74 | -169.9 | 179.1 | -177.9 | 0 | 104.3 | K287 I291 | K287-K289 PolarHBondContact O-N 3.13Å; K289-I291 VanDerWaalsContact C-N 3.26Å; K289-I291 PolarHBondContact O-N 3.03Å | ||
| 290 | L | 60 | Low | 62.8 | Low | 161 Ų | 161 | 164.4 Ų | 164.4 | 84% | 0.843 | 80% | 0.803 | S | S | * | * | trans | -59 | 99.6 | 168.7 | -77.9 | 156.5 | 0 | 0 | 0 | 105.2 | R288 H292 | R288-L290 VanDerWaalsContact C-N 3.33Å; R288-L290 PolarHBondContact O-N 2.97Å; L290-H292 VanDerWaalsContact C-N 3.27Å; L290-H292 PolarHBondContact O-N 2.98Å | ||
| 291 | I | 64.8 | Low | 61.3 | Low | 158 Ų | 158 | 162.1 Ų | 162.1 | 81% | 0.81 | 81% | 0.805 | S | S | * | * | trans | -67.3 | 99.1 | 167.8 | -60.4 | 172.5 | 0 | 0 | 0 | 103.9 | K289 P293 | K289-I291 VanDerWaalsContact C-N 3.26Å; K289-I291 PolarHBondContact O-N 3.03Å; I291-P293 VanDerWaalsContact O-CD 3.25Å; I291-P293 WeakPolarHBondContact O-CD 3.4Å | ||
| 292 | H | 63.2 | Low | 59.9 | Low | 169 Ų | 169 | 163.3 Ų | 163.3 | 78% | 0.782 | 81% | 0.811 | S | S | * | * | trans | -60 | 118.2 | 169.3 | -115.8 | -68.8 | 0 | 0 | 0 | 107 | L290 K294 | L290-H292 VanDerWaalsContact C-N 3.27Å; L290-H292 PolarHBondContact O-N 2.98Å; H292-K294 PolarHBondContact O-N 3.15Å; H292-K294 VanDerWaalsContact O-N 3.12Å | ||
| 293 | P | 62.5 | Low | 58.5 | Low | 112 Ų | 112 | 160.3 Ų | 160.3 | 73% | 0.727 | 81% | 0.805 | S | S | * | * | trans | -62.6 | 119.9 | 174.7 | 23.8 | -30.4 | 0 | 0 | 0 | 108.2 | I291 R295 | I291-P293 VanDerWaalsContact O-CD 3.25Å; I291-P293 WeakPolarHBondContact O-CD 3.4Å; P293-R295 PolarHBondContact O-N 3.47Å; P293-R295 VanDerWaalsContact O-N 3.1Å | ||
| 294 | K | 56.8 | Low | 57.2 | Low | 211 Ų | 211 | 162.4 Ų | 162.4 | 92% | 0.917 | 81% | 0.809 | S | S | * | * | trans | -63.5 | 111.7 | 168.7 | -82.5 | -175.7 | 176.5 | 178.8 | 0 | 107.5 | H292 A296 | H292-K294 PolarHBondContact O-N 3.15Å; H292-K294 VanDerWaalsContact O-N 3.12Å; K294-A296 PolarHBondContact O-N 3.36Å | ||
| 295 | R | 63.8 | Low | 56.6 | Low | 240 Ų | 240 | 162.6 Ų | 162.6 | 91% | 0.906 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -54.8 | 124.3 | 172.7 | -166.9 | -179.2 | -127.2 | 176.2 | 0.4 | 109.1 | P293 K297 | P293-R295 PolarHBondContact O-N 3.47Å; P293-R295 VanDerWaalsContact O-N 3.1Å; R295-K297 PolarHBondContact O-N 3.27Å |
| 296 | A | 57.8 | Low | 56.3 | Low | 92 Ų | 92 | 160.9 Ų | 160.9 | 76% | 0.76 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -62.8 | 132.9 | 172.4 | 0 | 0 | 0 | 0 | 0 | 109.6 | K294 S298 | K294-A296 PolarHBondContact O-N 3.36Å; A296-S298 PolarHBondContact O-N 3.09Å |
| 297 | K | 58.4 | Low | 55.7 | Low | 198 Ų | 198 | 157 Ų | 157 | 86% | 0.861 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -68.9 | 118.8 | 170.1 | -75.2 | -176.8 | 176.4 | -177.8 | 0 | 108 | R295 N299 | R295-K297 PolarHBondContact O-N 3.27Å; K297-N299 PolarHBondContact O-N 3.01Å |
| 298 | S | 53.6 | Low | 54.8 | Low | 110 Ų | 110 | 159.4 Ų | 159.4 | 77% | 0.769 | 80% | 0.798 | S | S | * | * | trans | -70.2 | 111.3 | 169 | 51.5 | 0 | 0 | 0 | 0 | 109 | A296 T300 | A296-S298 PolarHBondContact O-N 3.09Å; S298-T300 PolarHBondContact O-N 3.11Å | ||
| 299 | N | 49.3 | Very low | 54 | Low | 151 Ų | 151 | 156 Ų | 156 | 81% | 0.807 | 80% | 0.796 | S | S | * | * | trans | -76.4 | 106.3 | 165.2 | -75.2 | -30 | 0 | 0 | 0 | 108 | K297 S301 | K297-N299 PolarHBondContact O-N 3.01Å; N299-S301 VanDerWaalsContact C-N 3.27Å; N299-S301 PolarHBondContact O-N 3.23Å | ||
| 300 | T | 51.8 | Low | 53.1 | Low | 139 Ų | 139 | 155.6 Ų | 155.6 | 85% | 0.853 | 82% | 0.818 | S | S | * | * | trans | -73.5 | 86.2 | 160.8 | 30.2 | 0 | 0 | 0 | 0 | 108.3 | S298 L302 | S298-T300 PolarHBondContact O-N 3.11Å; T300-L302 PolarHBondContact O-N 3.16Å | ||
| 301 | S | 54.8 | Low | 52.7 | Low | 94 Ų | 94 | 155.4 Ų | 155.4 | 66% | 0.657 | 82% | 0.817 | S | S | * | * | trans | -72.7 | 114.4 | 160.2 | 55 | 0 | 0 | 0 | 0 | 108.3 | N299 V303 | N299-S301 VanDerWaalsContact C-N 3.27Å; N299-S301 PolarHBondContact O-N 3.23Å; S301-V303 PolarHBondContact O-N 3.33Å | ||
| 302 | L | 54.3 | Low | 52.1 | Low | 160 Ų | 160 | 155.2 Ų | 155.2 | 84% | 0.838 | 82% | 0.818 | S | S | * | * | trans | -58.4 | 107.6 | 171.6 | -156.6 | 164.3 | 0 | 0 | 0 | 108.7 | T300 N304 | T300-L302 PolarHBondContact O-N 3.16Å; L302-N304 HydrophobicContact CD2-CB 4.46Å | ||
| 303 | V | 52.6 | Low | 51.5 | Low | 112 Ų | 112 | 154.4 Ų | 154.4 | 68% | 0.679 | 82% | 0.82 | S | S | * | * | trans | -112.5 | 106.8 | 168.7 | 178.1 | 0 | 0 | 0 | 0 | 107.4 | S301 I305 | S301-V303 PolarHBondContact O-N 3.33Å; V303-I305 HydrophobicContact CG1-CD1 4.4Å; V303-I305 HydrophobicContact CG1-CG1 4.15Å | ||
| 304 | N | 46.7 | Very low | 50.8 | Low | 135 Ų | 135 | 156.9 Ų | 156.9 | 72% | 0.722 | 83% | 0.825 | S | S | * | * | trans | -74.8 | 118.9 | 175.9 | -165.8 | 17.8 | 0 | 0 | 0 | 108.7 | L302 | L302-N304 HydrophobicContact CD2-CB 4.46Š| ||
| 305 | I | 52.1 | Low | 50.4 | Low | 160 Ų | 160 | 153.6 Ų | 153.6 | 82% | 0.821 | 82% | 0.819 | S | S | * | * | trans | -128.8 | 95.2 | 168 | -57.2 | 177.4 | 0 | 0 | 0 | 107.6 | V303 | V303-I305 HydrophobicContact CG1-CD1 4.4Å; V303-I305 HydrophobicContact CG1-CG1 4.15Å | ||
| 306 | Q | 50.3 | Low | 49.5 | Very low | 151 Ų | 151 | 147.8 Ų | 147.8 | 71% | 0.706 | 81% | 0.813 | S | S | * | * | trans | -145.9 | 123.8 | 165.3 | -173.1 | 153.2 | -8.4 | 0 | 0 | 103 | ||||
| 307 | D | 43.5 | Very low | 48.9 | Very low | 115 Ų | 115 | 151.8 Ų | 151.8 | 62% | 0.615 | 82% | 0.817 | S | S | * | * | cis | -156.4 | 161.6 | 25.9 | -98.1 | -46.5 | 0 | 0 | 0 | 107.4 | ||||
| 308 | R | 37.9 | Very low | 48.2 | Very low | 248 Ų | 248 | 148.2 Ų | 148.2 | 94% | 0.936 | 81% | 0.814 | S | S | * | * | -170.2 | 107.8 | 128.9 | -87.6 | -116.3 | -169.9 | -119 | -0.6 | 110.6 | |||||
| 309 | L | 44.1 | Very low | 47.8 | Very low | 161 Ų | 161 | 151.4 Ų | 151.4 | 84% | 0.843 | 82% | 0.818 | S | S | * | * | trans | -68.4 | 140.9 | 162.8 | -76.4 | 130.4 | 0 | 0 | 0 | 111.7 | ||||
| 310 | S | 35.8 | Very low | 47.6 | Very low | 191 Ų | 191 | 151.5 Ų | 151.5 | 100% | 1.336 | 82% | 0.819 | S | S | * | * | trans | -163.2 | 0 | 136.2 | 63.6 | 0 | 0 | 0 | 0 | 109.3 |
Retrieved 310 of 310 residues in 1202.9 ms
(Link to these results)