| 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 | 33.9 | Very low | 28.3 | Very low | 239 Ų | 239 | 138.5 Ų | 138.5 | 100% | 1.177 | 82% | 0.821 | S | S | * | * | 0 | 114.3 | 0 | -93.3 | 157.8 | 143.9 | 0 | 0 | 107.3 | |||||
| 2 | N | 28.5 | Very low | 28.4 | Very low | 175 Ų | 175 | 142.3 Ų | 142.3 | 94% | 0.936 | 82% | 0.824 | S | S | * | * | trans | 35.3 | 133.6 | 156.2 | -60.1 | 3.4 | 0 | 0 | 0 | 119.5 | ||||
| 3 | G | 31.4 | Very low | 28.3 | Very low | 76 Ų | 76 | 143.8 Ų | 143.8 | 78% | 0.784 | 83% | 0.828 | S | S | * | * | cis | -179.3 | 161.4 | 11.3 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 4 | S | 25.5 | Very low | 28.3 | Very low | 111 Ų | 111 | 144.6 Ų | 144.6 | 78% | 0.776 | 83% | 0.828 | S | S | * | * | trans | -80.6 | 172.9 | 178 | -47.8 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 5 | L | 28.8 | Very low | 28.3 | Very low | 153 Ų | 153 | 141.7 Ų | 141.7 | 80% | 0.801 | 82% | 0.82 | S | S | * | * | trans | 89.3 | 126.9 | 159.5 | -60.4 | 152.6 | 0 | 0 | 0 | 114.5 | ||||
| 6 | D | 27.6 | Very low | 28.2 | Very low | 139 Ų | 139 | 142.9 Ų | 142.9 | 74% | 0.743 | 82% | 0.82 | S | S | * | * | cis | -155 | 160.5 | 22.2 | -94.6 | -43.5 | 0 | 0 | 0 | 113.8 | ||||
| 7 | M | 28.1 | Very low | 28.2 | Very low | 168 Ų | 168 | 140.7 Ų | 140.7 | 83% | 0.828 | 81% | 0.809 | S | S | * | * | trans | -44.6 | 150.2 | 164.7 | -74.1 | 172.1 | 112.2 | 0 | 0 | 112.8 | ||||
| 8 | D | 26.3 | Very low | 28.2 | Very low | 149 Ų | 149 | 142.9 Ų | 142.9 | 80% | 0.797 | 81% | 0.811 | S | S | * | * | -161.3 | 156.1 | 69.3 | -135.8 | -15.9 | 0 | 0 | 0 | 116 | |||||
| 9 | S | 26.1 | Very low | 28.1 | Very low | 94 Ų | 94 | 143.5 Ų | 143.5 | 66% | 0.657 | 81% | 0.81 | S | S | * | * | trans | -61.3 | 140.7 | -179.2 | 166.4 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 10 | S | 27.3 | Very low | 28.2 | Very low | 106 Ų | 106 | 144.5 Ų | 144.5 | 74% | 0.741 | 81% | 0.814 | S | S | * | * | 167.2 | 106.7 | 110.1 | -65.5 | 0 | 0 | 0 | 0 | 111.2 | |||||
| 11 | S | 28.1 | Very low | 28.4 | Very low | 113 Ų | 113 | 146.2 Ų | 146.2 | 79% | 0.79 | 82% | 0.815 | S | S | * | * | trans | -58.4 | 150.1 | 149.3 | -42.4 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 12 | E | 28.8 | Very low | 28.4 | Very low | 184 Ų | 184 | 139.7 Ų | 139.7 | 86% | 0.86 | 79% | 0.791 | S | S | * | * | -160.9 | 144.9 | 54.1 | -76.9 | 175.8 | 124 | 0 | 0 | 110.7 | |||||
| 13 | N | 28 | Very low | 29 | Very low | 163 Ų | 163 | 139.9 Ų | 139.9 | 87% | 0.872 | 79% | 0.79 | S | S | * | * | trans | -57 | 130.7 | 165.7 | -73.4 | -39.4 | 0 | 0 | 0 | 111.3 | ||||
| 14 | N | 28.2 | Very low | 29.1 | Very low | 155 Ų | 155 | 142 Ų | 142 | 83% | 0.829 | 78% | 0.783 | S | S | * | * | trans | -124.6 | 115.1 | 153 | -94.6 | -23 | 0 | 0 | 0 | 110 | ||||
| 15 | S | 28.2 | Very low | 29.5 | Very low | 101 Ų | 101 | 141.6 Ų | 141.6 | 71% | 0.706 | 78% | 0.777 | S | S | * | * | trans | -37.3 | 119.4 | 172.7 | 35.4 | 0 | 0 | 0 | 0 | 115.1 | V17 | S15-V17 PolarHBondContact O-N 3.49Š| ||
| 16 | I | 26.4 | Very low | 30 | Very low | 160 Ų | 160 | 143.8 Ų | 143.8 | 82% | 0.821 | 78% | 0.783 | S | S | * | * | trans | -76.4 | 100.8 | 163.6 | -61.2 | 172.9 | 0 | 0 | 0 | 107.2 | H18 | I16-H18 PolarHBondContact O-N 3.49Š| ||
| 17 | V | 27.9 | Very low | 30.4 | Very low | 106 Ų | 106 | 144.1 Ų | 144.1 | 64% | 0.642 | 79% | 0.785 | S | S | * | * | trans | -81.4 | 108.3 | 166.3 | -179.5 | 0 | 0 | 0 | 0 | 106.9 | S15 L19 | S15-V17 PolarHBondContact O-N 3.49Å; V17-L19 HydrophobicContact CG1-CD1 4.47Å; V17-L19 HydrophobicContact CG1-CG 4.06Å; V17-L19 PolarHBondContact O-N 3.3Å | ||
| 18 | H | 28.9 | Very low | 30.9 | Very low | 181 Ų | 181 | 142.1 Ų | 142.1 | 84% | 0.838 | 78% | 0.777 | S | S | * | * | trans | -64 | 108.7 | 162.3 | -105.1 | -83.8 | 0 | 0 | 0 | 107.6 | I16 | I16-H18 PolarHBondContact O-N 3.49Š| ||
| 19 | L | 26.8 | Very low | 31.5 | Very low | 153 Ų | 153 | 138 Ų | 138 | 80% | 0.801 | 76% | 0.757 | S | S | * | * | P | Polyproline II helix | trans | -102.1 | 127.5 | 166 | -86.3 | 160.6 | 0 | 0 | 0 | 107.7 | V17 | V17-L19 HydrophobicContact CG1-CD1 4.47Å; V17-L19 HydrophobicContact CG1-CG 4.06Å; V17-L19 PolarHBondContact O-N 3.3Å |
| 20 | D | 29.4 | Very low | 31.9 | Very low | 163 Ų | 163 | 139.3 Ų | 139.3 | 87% | 0.872 | 76% | 0.755 | S | S | * | * | P | Polyproline II helix | trans | -52.8 | 138.1 | 180 | -74.8 | -52.3 | 0 | 0 | 0 | 112.2 | P22 | D20-P22 WeakPolarHBondContact O-CD 3.13Š|
| 21 | E | 31.6 | Very low | 32.6 | Very low | 181 Ų | 181 | 136.5 Ų | 136.5 | 85% | 0.846 | 73% | 0.731 | S | S | * | * | P | Polyproline II helix | trans | -61 | 118.9 | 176.6 | -154.7 | 169.1 | -161.2 | 0 | 0 | 109.7 | I23 | E21-I23 PolarHBondContact O-N 2.98Š|
| 22 | P | 33.7 | Very low | 32.9 | Very low | 102 Ų | 102 | 142.4 Ų | 142.4 | 66% | 0.662 | 74% | 0.736 | S | S | * | * | trans | -77 | 113.7 | 172.7 | 28.9 | -28.2 | 0 | 0 | 0 | 108.5 | D20 L24 | D20-P22 WeakPolarHBondContact O-CD 3.13Å; P22-L24 PolarHBondContact O-N 3.21Å | ||
| 23 | I | 41.8 | Very low | 33.4 | Very low | 179 Ų | 179 | 136.3 Ų | 136.3 | 92% | 0.918 | 71% | 0.712 | S | S | * | * | trans | -56 | 106.3 | 167.4 | -58 | 162.9 | 0 | 0 | 0 | 107.5 | E21 | E21-I23 PolarHBondContact O-N 2.98Š| ||
| 24 | L | 34.3 | Very low | 34 | Very low | 121 Ų | 121 | 140.5 Ų | 140.5 | 63% | 0.634 | 72% | 0.715 | S | S | * | * | trans | -119.2 | 134.9 | 179 | -143.2 | 126.8 | 0 | 0 | 0 | 109 | P22 | P22-L24 PolarHBondContact O-N 3.21Š| ||
| 25 | P | 33.9 | Very low | 34.5 | Very low | 103 Ų | 103 | 140.5 Ų | 140.5 | 67% | 0.669 | 72% | 0.715 | S | S | * | * | trans | -67 | 145.9 | -171.5 | 26.2 | -32.5 | 0 | 0 | 0 | 112.2 | N27 | P25-N27 PolarHBondContact O-N 3.5Š| ||
| 26 | E | 38.1 | Very low | 35 | Very low | 198 Ų | 198 | 139.1 Ų | 139.1 | 93% | 0.925 | 72% | 0.717 | S | S | * | * | S | Bend | trans | -58.1 | 9.3 | -168.5 | -75.6 | 179 | 137.1 | 0 | 0 | 118.2 | ||
| 27 | N | 36.2 | Very low | 35.2 | Very low | 147 Ų | 147 | 135 Ų | 135 | 79% | 0.786 | 70% | 0.702 | S | S | * | * | trans | -121.5 | 30.1 | -164.9 | -72.1 | -11.7 | 0 | 0 | 0 | 116.4 | P25 | P25-N27 PolarHBondContact O-N 3.5Š| ||
| 28 | I | 39.6 | Very low | 35.8 | Very low | 125 Ų | 125 | 137.7 Ų | 137.7 | 64% | 0.641 | 71% | 0.712 | S | S | * | * | trans | -132.2 | 106.6 | 173.3 | -59.3 | 177.5 | 0 | 0 | 0 | 110.9 | I30 | I28-I30 HydrophobicContact CG2-CG1 4.19Å; I28-I30 PolarHBondContact O-N 3.4Å | ||
| 29 | T | 38.8 | Very low | 36.3 | Very low | 62 Ų | 62 | 133.9 Ų | 133.9 | 38% | 0.38 | 70% | 0.702 | S | S | . | * | trans | -70.5 | 113.4 | 169.6 | 0.5 | 0 | 0 | 0 | 0 | 110 | ||||
| 30 | I | 34.1 | Very low | 37.1 | Very low | 122 Ų | 122 | 133.8 Ų | 133.8 | 63% | 0.626 | 70% | 0.702 | S | S | * | * | trans | -100.6 | 114.1 | 178 | -59.2 | 173.7 | 0 | 0 | 0 | 109 | I28 | I28-I30 HydrophobicContact CG2-CG1 4.19Å; I28-I30 PolarHBondContact O-N 3.4Å | ||
| 31 | I | 41.5 | Very low | 38.2 | Very low | 47 Ų | 47 | 132.6 Ų | 132.6 | 24% | 0.241 | 69% | 0.691 | C | S | . | * | trans | -90.2 | 111.2 | 170.3 | -66.5 | 149.3 | 0 | 0 | 0 | 108.3 | T33 L282 | I31-T33 PolarHBondContact O-N 3.1Å; I31-L282 HydrophobicContact CD1-CB 4.28Å; I31-L282 HydrophobicContact CD1-CD2 3.32Å; I31-L282 HydrophobicContact CD1-CG 3.58Å; I31-L282 HydrophobicContact CG1-CD2 4.21Å; I31-L282 HydrophobicContact CG1-CG 3.94Å; I31-L282 HydrophobicContact CG2-CD1 4.17Å; I31-L282 HydrophobicContact CG2-CD2 4.37Å; I31-L282 HydrophobicContact CG2-CG 3.84Å | ||
| 32 | R | 34.6 | Very low | 39.6 | Very low | 238 Ų | 238 | 125.5 Ų | 125.5 | 90% | 0.898 | 66% | 0.659 | S | S | * | * | trans | -87.7 | 98.6 | 176.2 | -167.5 | 174.3 | -144.3 | 160.7 | 6.8 | 110.2 | ||||
| 33 | T | 38.8 | Very low | 41.4 | Very low | 55 Ų | 55 | 125.3 Ų | 125.3 | 34% | 0.337 | 65% | 0.648 | S | S | . | * | trans | -76.9 | 147.7 | 165.2 | 22.9 | 0 | 0 | 0 | 0 | 110.8 | I31 N35 G36 S37 | I31-T33 PolarHBondContact O-N 3.1Å; T33-N35 PolarHBondContact O-N 3.03Å; T33-G36 PolarHBondContact O-N 3.4Å; T33-G36 VanDerWaalsContact O-N 3.13Å; T33-S37 PolarHBondContact OG1-O 2.92Å | ||
| 34 | R | 42 | Very low | 42.7 | Very low | 251 Ų | 251 | 117 Ų | 117 | 95% | 0.947 | 61% | 0.605 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.9 | -13.4 | -174.5 | -161.9 | 175.8 | -165.1 | 160.3 | 4.1 | 115.2 | ||
| 35 | N | 37.3 | Very low | 44.3 | Very low | 156 Ų | 156 | 113.8 Ų | 113.8 | 83% | 0.834 | 59% | 0.588 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -110.5 | 14.2 | -178.3 | -84.9 | 4.3 | 0 | 0 | 0 | 115.2 | T33 S37 | T33-N35 PolarHBondContact O-N 3.03Å; N35-S37 PolarHBondContact O-N 3.19Å |
| 36 | G | 38.9 | Very low | 46.4 | Very low | 72 Ų | 72 | 110.8 Ų | 110.8 | 74% | 0.742 | 57% | 0.568 | S | S | * | * | trans | 66.4 | 14 | 169.4 | 0 | 0 | 0 | 0 | 0 | 115.7 | T33 L38 | T33-G36 PolarHBondContact O-N 3.4Å; T33-G36 VanDerWaalsContact O-N 3.13Å; G36-L38 PolarHBondContact O-N 2.76Å | ||
| 37 | S | 32 | Very low | 48.3 | Very low | 72 Ų | 72 | 106.7 Ų | 106.7 | 50% | 0.503 | 56% | 0.557 | S | S | . | * | trans | -81.7 | 110.7 | 168.9 | 172.8 | 0 | 0 | 0 | 0 | 109.3 | T33 N35 T39 | T33-S37 PolarHBondContact OG1-O 2.92Å; N35-S37 PolarHBondContact O-N 3.19Å; S37-T39 PolarHBondContact O-N 3.14Å; S37-T39 VanDerWaalsContact O-N 3.08Å | ||
| 38 | L | 38.8 | Very low | 50.5 | Low | 164 Ų | 164 | 104 Ų | 104 | 86% | 0.859 | 55% | 0.545 | S | S | * | . | trans | -72.1 | 89.7 | 171.4 | -125.4 | 138.6 | 0 | 0 | 0 | 107.9 | G36 | G36-L38 PolarHBondContact O-N 2.76Š| ||
| 39 | T | 39.4 | Very low | 52.5 | Low | 101 Ų | 101 | 98 Ų | 98 | 62% | 0.62 | 52% | 0.515 | S | S | * | . | trans | -95.1 | 121.5 | 172.1 | -0.1 | 0 | 0 | 0 | 0 | 108.3 | S37 | S37-T39 PolarHBondContact O-N 3.14Å; S37-T39 VanDerWaalsContact O-N 3.08Å | ||
| 40 | D | 43.7 | Very low | 54.6 | Low | 151 Ų | 151 | 97.7 Ų | 97.7 | 81% | 0.807 | 51% | 0.509 | S | S | * | . | trans | -41 | 155.9 | 171.4 | -89.7 | -38.9 | 0 | 0 | 0 | 112.8 | M42 | D40-M42 PolarHBondContact O-N 3.34Š| ||
| 41 | Q | 52.4 | Low | 57.1 | Low | 138 Ų | 138 | 94.3 Ų | 94.3 | 65% | 0.645 | 50% | 0.5 | S | S | * | . | S | Bend | trans | -23 | 129.2 | 169.5 | -71.5 | 173.2 | -38.6 | 0 | 0 | 112.7 | F43 | Q41-F43 PolarHBondContact O-N 3.32Å; Q41-F43 VanDerWaalsContact O-N 3.12Å |
| 42 | M | 61 | Low | 59.4 | Low | 32 Ų | 32 | 95.7 Ų | 95.7 | 16% | 0.158 | 51% | 0.507 | C | S | . | . | trans | -42.6 | 125.3 | 174.7 | -82.4 | -179.1 | 68.1 | 0 | 0 | 110.6 | D40 L44 N45 L282 I284 V294 | D40-M42 PolarHBondContact O-N 3.34Å; M42-L44 HydrophobicContact CE-CD1 3.93Å; M42-L44 PolarHBondContact O-N 3.2Å; M42-N45 PolarHBondContact O-N 3.49Å; M42-L282 HydrophobicContact CG-CD2 3.39Å; M42-L282 HydrophobicContact SD-CB 4.41Å; M42-L282 HydrophobicContact SD-CD2 3.25Å; M42-L282 WeakPolarHBondContact SD-CD2 3.22Å; M42-L282 HydrophobicContact SD-CG 4.42Å; M42-I284 HydrophobicContact SD-CD1 3.89Å; M42-I284 HydrophobicContact SD-CG1 4.45Å; M42-V294 HydrophobicContact CE-CB 4.14Å; M42-V294 HydrophobicContact CE-CG1 3.4Å; M42-V294 HydrophobicContact CE-CG2 3.87Å; M42-V294 HydrophobicContact SD-CG1 4.44Å; M42-V294 HydrophobicContact SD-CG2 4.12Å | ||
| 43 | F | 71.8 | Confident | 62 | Low | 98 Ų | 98 | 84.4 Ų | 84.4 | 43% | 0.43 | 46% | 0.464 | S | S | . | . | G | 310 helix | trans | -46.7 | -35.4 | -179.2 | 173.9 | -100.9 | 0 | 0 | 0 | 113.1 | Q41 N45 T46 A49 W298 F301 | Q41-F43 PolarHBondContact O-N 3.32Å; Q41-F43 VanDerWaalsContact O-N 3.12Å; F43-N45 VanDerWaalsContact C-N 3.31Å; F43-N45 PolarHBondContact O-N 3.42Å; F43-T46 WeakPolarHBondContact O-CB 3.49Å; F43-T46 PolarHBondContact O-N 3.1Å; F43-T46 VanDerWaalsContact O-N 3.15Å; F43-T46 PolarHBondContact O-OG1 3.41Å; F43-A49 HydrophobicContact CD1-CB 4.16Å; F43-A49 HydrophobicContact CE1-CB 3.88Å; F43-A49 HydrophobicContact CZ-CB 4.06Å; F43-A49 WeakPolarHBondContact O-CB 3.33Å; F43-W298 AromaticContact CD1-CH2 3.76Å; F43-W298 HydrophobicContact CD1-CH2 3.76Å; F43-W298 HydrophobicContact CD1-CZ2 4.41Å; F43-W298 HydrophobicContact CD1-CZ3 4.35Å; F43-W298 HydrophobicContact CE1-CH2 4.43Å; F43-F301 HydrophobicContact CE1-CE1 4.09Å; F43-F301 HydrophobicContact CE1-CE2 4.45Å; F43-F301 AromaticContact CE1-CZ 3.89Å; F43-F301 HydrophobicContact CE1-CZ 3.89Å; F43-F301 HydrophobicContact CZ-CZ 4.42Å |
| 44 | L | 69.3 | Low | 64.4 | Low | 5 Ų | 5 | 82 Ų | 82 | 3% | 0.026 | 45% | 0.451 | C | S | . | . | G | 310 helix | trans | -62.5 | -31.7 | 178 | -68.5 | 171.8 | 0 | 0 | 0 | 114.2 | M42 T46 L102 W298 F301 | M42-L44 HydrophobicContact CE-CD1 3.93Å; M42-L44 PolarHBondContact O-N 3.2Å; L44-T46 VanDerWaalsContact C-N 3.35Å; L44-L102 HydrophobicContact CD2-CD2 4.45Å; L44-W298 HydrophobicContact CD1-CB 4.44Å; L44-W298 HydrophobicContact CD1-CD2 4Å; L44-W298 HydrophobicContact CD1-CG 3.76Å; L44-W298 HydrophobicContact CD2-CD2 4.19Å; L44-W298 HydrophobicContact CD2-CE3 4.29Å; L44-W298 HydrophobicContact CG-CD2 4.22Å; L44-W298 HydrophobicContact CG-CG 4.48Å; L44-W298 HydrophobicContact CG-CZ2 4.4Å; L44-F301 HydrophobicContact CD2-CB 3.64Å; L44-F301 HydrophobicContact CD2-CD2 4.37Å; L44-F301 HydrophobicContact CD2-CG 3.97Å |
| 45 | N | 67.6 | Low | 66.9 | Low | 52 Ų | 52 | 75.6 Ų | 75.6 | 28% | 0.278 | 43% | 0.434 | S | S | . | . | G | 310 helix | trans | -87.4 | -7.1 | 177.6 | -75.1 | -12.7 | 0 | 0 | 0 | 112.6 | M42 F43 I284 | M42-N45 PolarHBondContact O-N 3.49Å; F43-N45 VanDerWaalsContact C-N 3.31Å; F43-N45 PolarHBondContact O-N 3.42Å; N45-I284 WeakPolarHBondContact ND2-CG2 3.25Å |
| 46 | T | 78.5 | Confident | 69.5 | Low | 41 Ų | 41 | 70.5 Ų | 70.5 | 25% | 0.252 | 41% | 0.405 | S | S | . | . | S | Bend | trans | -70.2 | 135.7 | 176.4 | -43.4 | 0 | 0 | 0 | 0 | 109.6 | F43 L44 T48 A49 Q50 | F43-T46 WeakPolarHBondContact O-CB 3.49Å; F43-T46 PolarHBondContact O-N 3.1Å; F43-T46 VanDerWaalsContact O-N 3.15Å; F43-T46 PolarHBondContact O-OG1 3.41Å; L44-T46 VanDerWaalsContact C-N 3.35Å; T46-T48 HydrophobicContact CG2-CG2 4.29Å; T46-T48 WeakPolarHBondContact CG2-OG1 3.37Å; T46-T48 PolarHBondContact O-N 3Å; T46-A49 PolarHBondContact O-N 3.23Å; T46-Q50 PolarHBondContact O-N 3.12Å |
| 47 | V | 78.1 | Confident | 72.1 | Confident | 112 Ų | 112 | 67.1 Ų | 67.1 | 68% | 0.679 | 37% | 0.37 | S | S | * | . | H | α-helix | trans | -52.1 | -31.2 | 176 | 179.9 | 0 | 0 | 0 | 0 | 111.7 | A51 | V47-A51 WeakPolarHBondContact O-CB 3.06Å; V47-A51 PolarHBondContact O-N 2.77Å |
| 48 | T | 83.2 | Confident | 75 | Confident | 89 Ų | 89 | 70.5 Ų | 70.5 | 55% | 0.546 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -63.8 | -42.2 | 176.3 | 54 | 0 | 0 | 0 | 0 | 113.1 | T46 L52 | T46-T48 HydrophobicContact CG2-CG2 4.29Å; T46-T48 WeakPolarHBondContact CG2-OG1 3.37Å; T46-T48 PolarHBondContact O-N 3Å; T48-L52 WeakPolarHBondContact O-CB 3.03Å; T48-L52 PolarHBondContact O-N 3.44Å |
| 49 | A | 80.4 | Confident | 77.7 | Confident | 1 Ų | 1 | 64.2 Ų | 64.2 | 1% | 0.008 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -70.9 | -41.7 | 179.8 | 0 | 0 | 0 | 0 | 0 | 111.1 | F43 T46 L52 S53 F301 | F43-A49 HydrophobicContact CD1-CB 4.16Å; F43-A49 HydrophobicContact CE1-CB 3.88Å; F43-A49 HydrophobicContact CZ-CB 4.06Å; F43-A49 WeakPolarHBondContact O-CB 3.33Å; T46-A49 PolarHBondContact O-N 3.23Å; A49-L52 PolarHBondContact O-N 2.88Å; A49-S53 WeakPolarHBondContact O-CB 3.49Å; A49-S53 PolarHBondContact O-N 3.33Å; A49-S53 PolarHBondContact O-OG 3.34Å; A49-F301 HydrophobicContact CB-CE2 4.12Å |
| 50 | Q | 82.8 | Confident | 80.3 | Confident | 54 Ų | 54 | 59.4 Ų | 59.4 | 25% | 0.252 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -66.2 | -38.7 | 175.8 | -66.1 | -178.5 | -15 | 0 | 0 | 112.6 | T46 S53 G54 | T46-Q50 PolarHBondContact O-N 3.12Å; Q50-S53 PolarHBondContact O-OG 3.24Å; Q50-S53 VanDerWaalsContact O-OG 3.05Å; Q50-G54 PolarHBondContact O-N 3.19Å |
| 51 | A | 87.3 | Confident | 82.6 | Confident | 52 Ų | 52 | 53.4 Ų | 53.4 | 43% | 0.43 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -67.5 | -42.9 | 175 | 0 | 0 | 0 | 0 | 0 | 111.4 | V47 G54 I55 | V47-A51 WeakPolarHBondContact O-CB 3.06Å; V47-A51 PolarHBondContact O-N 2.77Å; A51-G54 PolarHBondContact O-N 3.03Å; A51-I55 WeakPolarHBondContact O-CG1 3.4Å; A51-I55 PolarHBondContact O-N 3.13Å |
| 52 | L | 90.2 | Very high | 84.6 | Confident | 76 Ų | 76 | 52.7 Ų | 52.7 | 40% | 0.398 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -63.4 | -48.5 | 178.4 | -175.3 | 64 | 0 | 0 | 0 | 111.5 | T48 A49 G54 I55 F56 F301 | T48-L52 WeakPolarHBondContact O-CB 3.03Å; T48-L52 PolarHBondContact O-N 3.44Å; A49-L52 PolarHBondContact O-N 2.88Å; L52-G54 VanDerWaalsContact C-N 3.3Å; L52-G54 PolarHBondContact O-N 3.31Å; L52-I55 PolarHBondContact O-N 3.24Å; L52-F56 HydrophobicContact CD1-CD2 4.13Å; L52-F56 HydrophobicContact CD1-CE2 3.56Å; L52-F56 HydrophobicContact CD1-CZ 4.45Å; L52-F56 HydrophobicContact CD2-CE2 4.41Å; L52-F56 HydrophobicContact CG-CD2 4.06Å; L52-F56 HydrophobicContact CG-CE2 3.76Å; L52-F56 WeakPolarHBondContact O-CD2 3.26Å; L52-F56 PolarHBondContact O-N 2.99Å; L52-F301 HydrophobicContact CD2-CZ 4.42Å |
| 53 | S | 88.3 | Confident | 86.1 | Confident | 0 Ų | 0 | 53.1 Ų | 53.1 | 0% | 0 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -61.6 | -40.4 | 176.5 | 64.5 | 0 | 0 | 0 | 0 | 111.3 | A49 Q50 I55 F56 V57 | A49-S53 WeakPolarHBondContact O-CB 3.49Å; A49-S53 PolarHBondContact O-N 3.33Å; A49-S53 PolarHBondContact O-OG 3.34Å; Q50-S53 PolarHBondContact O-OG 3.24Å; Q50-S53 VanDerWaalsContact O-OG 3.05Å; S53-I55 PolarHBondContact O-N 3.37Å; S53-F56 PolarHBondContact O-N 3.44Å; S53-V57 WeakPolarHBondContact O-CB 3.34Å; S53-V57 WeakPolarHBondContact O-CG2 3.49Å; S53-V57 PolarHBondContact O-N 3.32Å |
| 54 | G | 90.1 | Very high | 87.1 | Confident | 6 Ų | 6 | 48.5 Ų | 48.5 | 6% | 0.062 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -58 | -45.6 | 174 | 0 | 0 | 0 | 0 | 0 | 113.3 | Q50 A51 L52 F56 V57 W58 | Q50-G54 PolarHBondContact O-N 3.19Å; A51-G54 PolarHBondContact O-N 3.03Å; L52-G54 VanDerWaalsContact C-N 3.3Å; L52-G54 PolarHBondContact O-N 3.31Å; G54-F56 PolarHBondContact O-N 3.33Å; G54-V57 PolarHBondContact O-N 2.88Å; G54-W58 WeakPolarHBondContact O-CB 3.4Å; G54-W58 PolarHBondContact O-N 2.83Å |
| 55 | I | 93.2 | Very high | 88.1 | Confident | 115 Ų | 115 | 51.9 Ų | 51.9 | 59% | 0.59 | 29% | 0.285 | S | S | * | . | H | α-helix | trans | -60.7 | -47.2 | 177.9 | -69.1 | 163.9 | 0 | 0 | 0 | 110.9 | A51 L52 S53 V57 S59 | A51-I55 WeakPolarHBondContact O-CG1 3.4Å; A51-I55 PolarHBondContact O-N 3.13Å; L52-I55 PolarHBondContact O-N 3.24Å; S53-I55 PolarHBondContact O-N 3.37Å; I55-V57 PolarHBondContact O-N 3.3Å; I55-S59 WeakPolarHBondContact O-CB 3.16Å; I55-S59 PolarHBondContact O-N 2.9Å; I55-S59 PolarHBondContact O-OG 3.36Å |
| 56 | F | 92.9 | Very high | 89.2 | Confident | 50 Ų | 50 | 54 Ų | 54 | 22% | 0.219 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -61.3 | -44.5 | 177.5 | -77.5 | -66.1 | 0 | 0 | 0 | 111.7 | L52 S53 G54 S59 A60 I305 F308 | L52-F56 HydrophobicContact CD1-CD2 4.13Å; L52-F56 HydrophobicContact CD1-CE2 3.56Å; L52-F56 HydrophobicContact CD1-CZ 4.45Å; L52-F56 HydrophobicContact CD2-CE2 4.41Å; L52-F56 HydrophobicContact CG-CD2 4.06Å; L52-F56 HydrophobicContact CG-CE2 3.76Å; L52-F56 WeakPolarHBondContact O-CD2 3.26Å; L52-F56 PolarHBondContact O-N 2.99Å; S53-F56 PolarHBondContact O-N 3.44Å; G54-F56 PolarHBondContact O-N 3.33Å; F56-S59 PolarHBondContact O-N 3.19Å; F56-S59 PolarHBondContact O-OG 3.2Å; F56-A60 WeakPolarHBondContact O-CB 3.47Å; F56-A60 PolarHBondContact O-N 3.39Å; F56-I305 HydrophobicContact CD2-CG1 4Å; F56-I305 HydrophobicContact CE2-CG1 4.28Å; F56-I305 HydrophobicContact CG-CG1 4.5Å; F56-F308 HydrophobicContact CB-CB 4.37Å; F56-F308 HydrophobicContact CD1-CB 3.99Å; F56-F308 AromaticContact CD1-CD1 3.83Å; F56-F308 HydrophobicContact CD1-CD1 3.83Å; F56-F308 HydrophobicContact CD1-CE1 4.45Å; F56-F308 AromaticContact CD1-CG 3.86Å; F56-F308 HydrophobicContact CD1-CG 3.86Å; F56-F308 HydrophobicContact CE1-CD1 4.05Å; F56-F308 HydrophobicContact CE1-CE1 4.38Å |
| 57 | V | 93.1 | Very high | 89.7 | Confident | 0 Ų | 0 | 52.2 Ų | 52.2 | 0% | 0 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -62.1 | -50.5 | 179.1 | 168.9 | 0 | 0 | 0 | 0 | 111.2 | S53 G54 I55 S59 A60 L61 A95 W99 C304 | S53-V57 WeakPolarHBondContact O-CB 3.34Å; S53-V57 WeakPolarHBondContact O-CG2 3.49Å; S53-V57 PolarHBondContact O-N 3.32Å; G54-V57 PolarHBondContact O-N 2.88Å; I55-V57 PolarHBondContact O-N 3.3Å; V57-S59 VanDerWaalsContact C-N 3.31Å; V57-S59 PolarHBondContact O-N 2.87Å; V57-A60 WeakPolarHBondContact O-CB 3.22Å; V57-A60 PolarHBondContact O-N 3.03Å; V57-L61 HydrophobicContact CG1-CD1 4.11Å; V57-L61 HydrophobicContact CG1-CG 4.41Å; V57-L61 VanDerWaalsContact O-CG 3.28Å; V57-L61 WeakPolarHBondContact O-CG 3.41Å; V57-L61 PolarHBondContact O-N 3.46Å; V57-A95 HydrophobicContact CB-CB 4.46Å; V57-A95 HydrophobicContact CG1-CB 4.01Å; V57-A95 HydrophobicContact CG2-CB 4.24Å; V57-W99 HydrophobicContact CB-CB 4.4Å; V57-W99 HydrophobicContact CB-CG 4.49Å; V57-W99 HydrophobicContact CG1-CB 4.08Å; V57-W99 HydrophobicContact CG1-CG 4.33Å; V57-W99 HydrophobicContact CG2-CB 3.87Å; V57-W99 HydrophobicContact CG2-CG 4.28Å; V57-C304 HydrophobicContact CG2-CB 3.74Å |
| 58 | W | 93.8 | Very high | 90.1 | Very high | 143 Ų | 143 | 47.4 Ų | 47.4 | 54% | 0.542 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -61.6 | -39 | 178.3 | -82.4 | 106.3 | 0 | 0 | 0 | 112.5 | G54 L61 L62 W99 | G54-W58 WeakPolarHBondContact O-CB 3.4Å; G54-W58 PolarHBondContact O-N 2.83Å; W58-L61 HydrophobicContact CE3-CD1 4.27Å; W58-L61 PolarHBondContact O-N 3.44Å; W58-L62 VanDerWaalsContact O-CG 3.32Å; W58-L62 WeakPolarHBondContact O-CG 3.35Å; W58-L62 PolarHBondContact O-N 2.93Å; W58-W99 AromaticContact NE1-CH2 3.86Å |
| 59 | S | 94.4 | Very high | 90.3 | Very high | 33 Ų | 33 | 48.4 Ų | 48.4 | 23% | 0.231 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -65.8 | -41.4 | 175.2 | 70.5 | 0 | 0 | 0 | 0 | 112.4 | I55 F56 V57 L62 I63 F308 | I55-S59 WeakPolarHBondContact O-CB 3.16Å; I55-S59 PolarHBondContact O-N 2.9Å; I55-S59 PolarHBondContact O-OG 3.36Å; F56-S59 PolarHBondContact O-N 3.19Å; F56-S59 PolarHBondContact O-OG 3.2Å; V57-S59 VanDerWaalsContact C-N 3.31Å; V57-S59 PolarHBondContact O-N 2.87Å; S59-L62 PolarHBondContact O-N 3.18Å; S59-I63 VanDerWaalsContact O-CG1 3.28Å; S59-I63 WeakPolarHBondContact O-CG1 3.5Å; S59-I63 PolarHBondContact O-N 3.16Å; S59-F308 WeakPolarHBondContact OG-CD2 3.41Å; S59-F308 VanDerWaalsContact OG-CE2 3.22Å; S59-F308 WeakPolarHBondContact OG-CE2 3.33Å |
| 60 | A | 93.4 | Very high | 90.5 | Very high | 0 Ų | 0 | 49.5 Ų | 49.5 | 0% | 0 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -62.4 | -42.8 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | F56 V57 I63 T64 V91 F308 A311 | F56-A60 WeakPolarHBondContact O-CB 3.47Å; F56-A60 PolarHBondContact O-N 3.39Å; V57-A60 WeakPolarHBondContact O-CB 3.22Å; V57-A60 PolarHBondContact O-N 3.03Å; A60-I63 PolarHBondContact O-N 2.83Å; A60-T64 WeakPolarHBondContact O-CB 3.4Å; A60-T64 PolarHBondContact O-N 3Å; A60-T64 PolarHBondContact O-OG1 3.5Å; A60-V91 HydrophobicContact CB-CG1 4.05Å; A60-F308 HydrophobicContact CB-CB 4.32Å; A60-A311 HydrophobicContact CB-CB 4.26Å |
| 61 | L | 93.1 | Very high | 90.5 | Very high | 25 Ų | 25 | 46.9 Ų | 46.9 | 13% | 0.131 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -59.8 | -50 | 174.6 | -70.5 | 177.7 | 0 | 0 | 0 | 111.3 | V57 W58 I63 T64 C65 P92 | V57-L61 HydrophobicContact CG1-CD1 4.11Å; V57-L61 HydrophobicContact CG1-CG 4.41Å; V57-L61 VanDerWaalsContact O-CG 3.28Å; V57-L61 WeakPolarHBondContact O-CG 3.41Å; V57-L61 PolarHBondContact O-N 3.46Å; W58-L61 HydrophobicContact CE3-CD1 4.27Å; W58-L61 PolarHBondContact O-N 3.44Å; L61-I63 PolarHBondContact O-N 2.95Å; L61-T64 PolarHBondContact O-N 3.25Å; L61-C65 VanDerWaalsContact O-CB 3.27Å; L61-C65 WeakPolarHBondContact O-CB 3.27Å; L61-C65 PolarHBondContact O-N 3.02Å; L61-C65 PolarHBondContact O-SG 3.49Å; L61-P92 VanDerWaalsContact CD2-CA 3.47Å; L61-P92 HydrophobicContact CD2-CB 3.37Å |
| 62 | L | 94.3 | Very high | 90.2 | Very high | 123 Ų | 123 | 45 Ų | 45 | 64% | 0.644 | 22% | 0.224 | S | C | * | . | H | α-helix | trans | -60.5 | -44.4 | 179.7 | -72.9 | 173.3 | 0 | 0 | 0 | 112.4 | W58 S59 T64 H66 | W58-L62 VanDerWaalsContact O-CG 3.32Å; W58-L62 WeakPolarHBondContact O-CG 3.35Å; W58-L62 PolarHBondContact O-N 2.93Å; S59-L62 PolarHBondContact O-N 3.18Å; L62-T64 VanDerWaalsContact C-N 3.33Å; L62-T64 PolarHBondContact O-N 3.47Å; L62-H66 WeakPolarHBondContact O-CB 3.49Å; L62-H66 PolarHBondContact O-N 3.43Å |
| 63 | I | 92.8 | Very high | 89.8 | Confident | 40 Ų | 40 | 50.2 Ų | 50.2 | 21% | 0.205 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -60.3 | -46.2 | 177.5 | -68.9 | 167.2 | 0 | 0 | 0 | 110.4 | S59 A60 L61 H66 Q67 F308 A311 I312 | S59-I63 VanDerWaalsContact O-CG1 3.28Å; S59-I63 WeakPolarHBondContact O-CG1 3.5Å; S59-I63 PolarHBondContact O-N 3.16Å; A60-I63 PolarHBondContact O-N 2.83Å; L61-I63 PolarHBondContact O-N 2.95Å; I63-H66 PolarHBondContact O-N 3.36Å; I63-Q67 PolarHBondContact O-N 3.03Å; I63-F308 HydrophobicContact CD1-CD2 4.22Å; I63-F308 HydrophobicContact CD1-CE2 3.78Å; I63-A311 HydrophobicContact CB-CB 4.29Å; I63-A311 HydrophobicContact CG2-CB 4.02Å; I63-I312 HydrophobicContact CD1-CG1 4.05Å |
| 64 | T | 91.7 | Very high | 89.2 | Confident | 2 Ų | 2 | 50.8 Ų | 50.8 | 1% | 0.012 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -72.9 | -42.7 | -175.6 | -51 | 0 | 0 | 0 | 0 | 111.7 | A60 L61 L62 H66 Q67 I68 L88 V91 P92 | A60-T64 WeakPolarHBondContact O-CB 3.4Å; A60-T64 PolarHBondContact O-N 3Å; A60-T64 PolarHBondContact O-OG1 3.5Å; L61-T64 PolarHBondContact O-N 3.25Å; L62-T64 VanDerWaalsContact C-N 3.33Å; L62-T64 PolarHBondContact O-N 3.47Å; T64-H66 VanDerWaalsContact C-N 3.33Å; T64-H66 PolarHBondContact O-N 3.13Å; T64-Q67 WeakPolarHBondContact O-CB 3.33Å; T64-Q67 PolarHBondContact O-N 3.15Å; T64-Q67 VanDerWaalsContact O-N 3.1Å; T64-I68 HydrophobicContact CG2-CD1 3.89Å; T64-I68 HydrophobicContact CG2-CG1 4.33Å; T64-I68 WeakPolarHBondContact O-CG1 3.5Å; T64-I68 PolarHBondContact O-N 3Å; T64-L88 HydrophobicContact CG2-CB 4.37Å; T64-L88 VanDerWaalsContact CG2-O 3.31Å; T64-L88 WeakPolarHBondContact CG2-O 3.32Å; T64-V91 HydrophobicContact CG2-CB 4.39Å; T64-V91 WeakPolarHBondContact OG1-CG1 2.94Å; T64-P92 HydrophobicContact CG2-CG 4.33Å |
| 65 | C | 90.5 | Very high | 88.6 | Confident | 75 Ų | 75 | 53 Ų | 53 | 51% | 0.507 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -59.1 | -43.5 | 173.6 | -72.3 | 0 | 0 | 0 | 0 | 111.5 | L61 Q67 I68 Y69 | L61-C65 VanDerWaalsContact O-CB 3.27Å; L61-C65 WeakPolarHBondContact O-CB 3.27Å; L61-C65 PolarHBondContact O-N 3.02Å; L61-C65 PolarHBondContact O-SG 3.49Å; C65-Q67 VanDerWaalsContact C-N 3.33Å; C65-Q67 PolarHBondContact O-N 2.68Å; C65-I68 PolarHBondContact O-N 3.42Å; C65-Y69 VanDerWaalsContact O-CB 3.28Å; C65-Y69 WeakPolarHBondContact O-CB 3.28Å; C65-Y69 PolarHBondContact O-N 2.89Å |
| 66 | H | 91 | Very high | 87.8 | Confident | 97 Ų | 97 | 49.2 Ų | 49.2 | 45% | 0.449 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -60.4 | -43.1 | 173.7 | 177.6 | -70.2 | 0 | 0 | 0 | 111.6 | L62 I63 T64 T70 R315 | L62-H66 WeakPolarHBondContact O-CB 3.49Å; L62-H66 PolarHBondContact O-N 3.43Å; I63-H66 PolarHBondContact O-N 3.36Å; T64-H66 VanDerWaalsContact C-N 3.33Å; T64-H66 PolarHBondContact O-N 3.13Å; H66-T70 PolarHBondContact CE1-OG1 3.3Å; H66-T70 WeakPolarHBondContact O-CB 3.32Å; H66-T70 PolarHBondContact O-N 2.84Å; H66-T70 PolarHBondContact O-OG1 2.99Å; H66-R315 PolarHBondContact ND1-NH1 3.26Å; H66-R315 VanDerWaalsContact ND1-NH1 3.14Å |
| 67 | Q | 88.9 | Confident | 87.2 | Confident | 3 Ų | 3 | 47.9 Ų | 47.9 | 1% | 0.014 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -65.3 | -46.1 | 179.5 | -167.8 | -175.9 | -6.8 | 0 | 0 | 111.8 | I63 T64 C65 T70 H71 L88 L314 F318 | I63-Q67 PolarHBondContact O-N 3.03Å; T64-Q67 WeakPolarHBondContact O-CB 3.33Å; T64-Q67 PolarHBondContact O-N 3.15Å; T64-Q67 VanDerWaalsContact O-N 3.1Å; C65-Q67 VanDerWaalsContact C-N 3.33Å; C65-Q67 PolarHBondContact O-N 2.68Å; Q67-T70 PolarHBondContact O-N 3.46Å; Q67-H71 PolarHBondContact O-CD2 3.09Å; Q67-H71 PolarHBondContact O-N 3.24Å; Q67-L88 HydrophobicContact CB-CD2 4.03Å; Q67-L88 HydrophobicContact CG-CD2 3.53Å; Q67-L314 PolarHBondContact NE2-O 3.06Å; Q67-F318 PolarHBondContact NE2-O 2.87Å; Q67-F318 VanDerWaalsContact NE2-O 3.15Å |
| 68 | I | 87.8 | Confident | 86.4 | Confident | 11 Ų | 11 | 50.5 Ų | 50.5 | 6% | 0.056 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -60.4 | -46.7 | 175.8 | -67.8 | 168.4 | 0 | 0 | 0 | 110.3 | T64 C65 T70 H71 L72 I85 L88 F89 | T64-I68 HydrophobicContact CG2-CD1 3.89Å; T64-I68 HydrophobicContact CG2-CG1 4.33Å; T64-I68 WeakPolarHBondContact O-CG1 3.5Å; T64-I68 PolarHBondContact O-N 3Å; C65-I68 PolarHBondContact O-N 3.42Å; I68-T70 VanDerWaalsContact C-N 3.28Å; I68-T70 PolarHBondContact O-N 3.1Å; I68-H71 PolarHBondContact O-N 3.49Å; I68-L72 HydrophobicContact CG2-CD1 3.78Å; I68-L72 HydrophobicContact CG2-CG 4.27Å; I68-L72 WeakPolarHBondContact O-CG 3.47Å; I68-L72 PolarHBondContact O-N 2.79Å; I68-I85 HydrophobicContact CG2-CG2 4.17Å; I68-L88 HydrophobicContact CD1-CB 4.33Å; I68-L88 HydrophobicContact CG1-CB 4Å; I68-L88 HydrophobicContact CG1-CD2 3.92Å; I68-F89 HydrophobicContact CD1-CD1 4.04Å; I68-F89 HydrophobicContact CD1-CD2 4.21Å; I68-F89 HydrophobicContact CD1-CE1 3.84Å; I68-F89 HydrophobicContact CD1-CE2 4.02Å; I68-F89 HydrophobicContact CD1-CG 4.19Å; I68-F89 HydrophobicContact CD1-CZ 3.81Å; I68-F89 HydrophobicContact CG2-CE2 4.48Å; I68-F89 HydrophobicContact CG2-CZ 4.38Å |
| 69 | Y | 85.8 | Confident | 85.8 | Confident | 111 Ų | 111 | 48.4 Ų | 48.4 | 44% | 0.435 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -57.6 | -42.1 | 176.9 | 175.4 | -97.8 | 0 | 0 | 0 | 112.1 | C65 L72 R73 I339 | C65-Y69 VanDerWaalsContact O-CB 3.28Å; C65-Y69 WeakPolarHBondContact O-CB 3.28Å; C65-Y69 PolarHBondContact O-N 2.89Å; Y69-L72 PolarHBondContact O-N 3.47Å; Y69-R73 WeakPolarHBondContact O-CB 3.41Å; Y69-R73 PolarHBondContact O-N 3.03Å; Y69-I339 HydrophobicContact CE2-CD1 3.96Å |
| 70 | T | 84.4 | Confident | 85.3 | Confident | 23 Ų | 23 | 48.3 Ų | 48.3 | 14% | 0.141 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -66.2 | -40.3 | 179.1 | -53.3 | 0 | 0 | 0 | 0 | 111.5 | H66 Q67 I68 R73 S74 C320 Q324 | H66-T70 PolarHBondContact CE1-OG1 3.3Å; H66-T70 WeakPolarHBondContact O-CB 3.32Å; H66-T70 PolarHBondContact O-N 2.84Å; H66-T70 PolarHBondContact O-OG1 2.99Å; Q67-T70 PolarHBondContact O-N 3.46Å; I68-T70 VanDerWaalsContact C-N 3.28Å; I68-T70 PolarHBondContact O-N 3.1Å; T70-R73 PolarHBondContact O-N 3.35Å; T70-S74 PolarHBondContact O-N 2.9Å; T70-S74 VanDerWaalsContact O-N 3.13Å; T70-C320 HydrophobicContact CG2-CB 3.62Å; T70-Q324 VanDerWaalsContact CG2-NE2 3.27Å |
| 71 | H | 83.8 | Confident | 84.8 | Confident | 0 Ų | 0 | 48.3 Ų | 48.3 | 0% | 0 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -65.1 | -42.1 | 174.2 | -82.7 | -63.8 | 0 | 0 | 0 | 112.6 | Q67 I68 R73 S74 Y75 Q81 I85 F318 C320 | Q67-H71 PolarHBondContact O-CD2 3.09Å; Q67-H71 PolarHBondContact O-N 3.24Å; I68-H71 PolarHBondContact O-N 3.49Å; H71-R73 VanDerWaalsContact C-N 3.35Å; H71-S74 CarbonylContact O-C 3.29Å; H71-S74 VanDerWaalsContact O-C 3.29Å; H71-S74 PolarHBondContact O-N 3.38Å; H71-Y75 PolarHBondContact O-N 3.43Å; H71-Q81 PolarHBondContact O-NE2 3.26Å; H71-I85 HydrophobicContact CB-CD1 4.23Å; H71-I85 HydrophobicContact CB-CG1 4.03Å; H71-F318 PolarHBondContact NE2-O 3.09Å; H71-F318 VanDerWaalsContact NE2-O 3.13Å; H71-C320 PolarHBondContact CD2-SG 3.38Å; H71-C320 PolarHBondContact CE1-SG 2.79Å; H71-C320 PolarHBondContact NE2-SG 3.38Å |
| 72 | L | 81.6 | Confident | 84.5 | Confident | 12 Ų | 12 | 49.6 Ų | 49.6 | 6% | 0.063 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -66.9 | -34.6 | 176.4 | -70.2 | 170.8 | 0 | 0 | 0 | 112.6 | I68 Y69 S74 I85 I339 L343 | I68-L72 HydrophobicContact CG2-CD1 3.78Å; I68-L72 HydrophobicContact CG2-CG 4.27Å; I68-L72 WeakPolarHBondContact O-CG 3.47Å; I68-L72 PolarHBondContact O-N 2.79Å; Y69-L72 PolarHBondContact O-N 3.47Å; L72-S74 VanDerWaalsContact C-N 3.32Å; L72-I85 HydrophobicContact CD2-CD1 3.7Å; L72-I85 HydrophobicContact CG-CD1 4.13Å; L72-I339 HydrophobicContact CB-CG2 4.31Å; L72-I339 HydrophobicContact CD1-CG2 3.88Å; L72-L343 HydrophobicContact CD1-CD1 4.21Å |
| 73 | R | 80 | Confident | 84.2 | Confident | 186 Ų | 186 | 44.9 Ų | 44.9 | 70% | 0.702 | 22% | 0.216 | S | C | * | . | H | α-helix | trans | -70.1 | -31.3 | 176.2 | -174.7 | 175.8 | 176.7 | -174.8 | -0.8 | 112.1 | Y69 T70 H71 | Y69-R73 WeakPolarHBondContact O-CB 3.41Å; Y69-R73 PolarHBondContact O-N 3.03Å; T70-R73 PolarHBondContact O-N 3.35Å; H71-R73 VanDerWaalsContact C-N 3.35Å |
| 74 | S | 77.7 | Confident | 83.9 | Confident | 12 Ų | 12 | 43 Ų | 43 | 8% | 0.084 | 21% | 0.207 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -111.3 | 48.4 | -179.4 | -62.3 | 0 | 0 | 0 | 0 | 111.4 | T70 H71 L72 T76 Q81 Q324 N327 | T70-S74 PolarHBondContact O-N 2.9Å; T70-S74 VanDerWaalsContact O-N 3.13Å; H71-S74 CarbonylContact O-C 3.29Å; H71-S74 VanDerWaalsContact O-C 3.29Å; H71-S74 PolarHBondContact O-N 3.38Å; L72-S74 VanDerWaalsContact C-N 3.32Å; S74-T76 VanDerWaalsContact C-N 3.34Å; S74-T76 PolarHBondContact O-N 3.45Å; S74-Q81 PolarHBondContact O-NE2 3.5Å; S74-Q81 PolarHBondContact O-OE1 2.93Å; S74-Q324 WeakPolarHBondContact OG-CG 3.26Å; S74-N327 WeakPolarHBondContact CB-ND2 3.29Å |
| 75 | Y | 76.6 | Confident | 83.7 | Confident | 52 Ų | 52 | 42.9 Ų | 42.9 | 20% | 0.204 | 21% | 0.206 | C | C | . | . | trans | -79.5 | 76 | -175.4 | -157.2 | -113.5 | 0 | 0 | 0 | 111.8 | H71 P78 Q81 I85 M336 T346 | H71-Y75 PolarHBondContact O-N 3.43Å; Y75-P78 HydrophobicContact CD1-CB 4.23Å; Y75-P78 HydrophobicContact CE1-CB 3.44Å; Y75-P78 VanDerWaalsContact CE1-CB 3.44Å; Y75-P78 PolarHBondContact OH-O 2.92Å; Y75-Q81 VanDerWaalsContact CA-OE1 3.29Å; Y75-Q81 HydrophobicContact CD2-CB 3.91Å; Y75-Q81 HydrophobicContact CE2-CB 3.72Å; Y75-I85 HydrophobicContact CD2-CD1 4.42Å; Y75-I85 HydrophobicContact CE2-CD1 4.11Å; Y75-M336 HydrophobicContact CD1-SD 3.66Å; Y75-M336 HydrophobicContact CE1-SD 4.18Å; Y75-M336 HydrophobicContact CG-SD 4.05Å; Y75-T346 PolarHBondContact OH-OG1 3.42Å | ||
| 76 | T | 75.6 | Confident | 83.7 | Confident | 36 Ų | 36 | 39.4 Ų | 39.4 | 22% | 0.221 | 18% | 0.182 | C | C | . | . | S | Bend | trans | -95.5 | -33.8 | -176.4 | 45.4 | 0 | 0 | 0 | 0 | 113.5 | S74 P78 Y323 N327 | S74-T76 VanDerWaalsContact C-N 3.34Å; S74-T76 PolarHBondContact O-N 3.45Å; T76-P78 WeakPolarHBondContact O-CD 3.32Å; T76-Y323 PolarHBondContact OG1-O 3.48Å; T76-N327 HydrophobicContact CG2-CB 4.08Å; T76-N327 WeakPolarHBondContact CG2-ND2 3.07Å; T76-N327 WeakPolarHBondContact CG2-OD1 3.27Å |
| 77 | V | 80.1 | Confident | 83.6 | Confident | 21 Ų | 21 | 34.8 Ų | 34.8 | 13% | 0.127 | 16% | 0.161 | C | C | . | . | trans | -123.1 | 83.5 | -177.9 | -171.6 | 0 | 0 | 0 | 0 | 107.6 | N79 E80 Q81 Y323 K326 | V77-N79 PolarHBondContact O-N 3.24Å; V77-E80 HydrophobicContact CG1-CB 4.09Å; V77-E80 HydrophobicContact CG1-CG 3.83Å; V77-E80 PolarHBondContact O-N 3.41Å; V77-Q81 WeakPolarHBondContact O-CB 3.34Å; V77-Q81 WeakPolarHBondContact O-CG 3.39Å; V77-Q81 PolarHBondContact O-N 3.09Å; V77-Y323 HydrophobicContact CB-CD1 4.31Å; V77-Y323 HydrophobicContact CB-CE1 4.1Å; V77-Y323 HydrophobicContact CG2-CD1 4.17Å; V77-Y323 HydrophobicContact CG2-CE1 4.21Å; V77-K326 HydrophobicContact CG2-CD 3.86Å | ||
| 78 | P | 78.3 | Confident | 83.6 | Confident | 55 Ų | 55 | 34.7 Ų | 34.7 | 36% | 0.357 | 16% | 0.16 | S | C | . | . | H | α-helix | trans | -60.1 | -35 | -172 | 23 | -34.4 | 0 | 0 | 0 | 112.7 | Y75 T76 E80 R82 | Y75-P78 HydrophobicContact CD1-CB 4.23Å; Y75-P78 HydrophobicContact CE1-CB 3.44Å; Y75-P78 VanDerWaalsContact CE1-CB 3.44Å; Y75-P78 PolarHBondContact OH-O 2.92Å; T76-P78 WeakPolarHBondContact O-CD 3.32Å; P78-E80 PolarHBondContact O-N 3Å; P78-R82 WeakPolarHBondContact O-CB 3.4Å; P78-R82 PolarHBondContact O-N 2.89Å; P78-R82 VanDerWaalsContact O-N 3.07Å |
| 79 | N | 80.1 | Confident | 83.7 | Confident | 99 Ų | 99 | 36.4 Ų | 36.4 | 53% | 0.529 | 17% | 0.168 | S | C | . | . | H | α-helix | trans | -61.8 | -44.5 | -178.5 | -63.4 | -12.1 | 0 | 0 | 0 | 112 | V77 Y83 | V77-N79 PolarHBondContact O-N 3.24Å; N79-Y83 WeakPolarHBondContact O-CD2 3.18Å; N79-Y83 VanDerWaalsContact O-CE2 3.28Å; N79-Y83 WeakPolarHBondContact O-CE2 3.28Å |
| 80 | E | 83.8 | Confident | 83.8 | Confident | 31 Ų | 31 | 31.4 Ų | 31.4 | 15% | 0.145 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -79.9 | -47.9 | 178.7 | -63.7 | 173.9 | -167.3 | 0 | 0 | 111.9 | V77 P78 R82 Y83 I84 L132 E135 Y136 Y323 | V77-E80 HydrophobicContact CG1-CB 4.09Å; V77-E80 HydrophobicContact CG1-CG 3.83Å; V77-E80 PolarHBondContact O-N 3.41Å; P78-E80 PolarHBondContact O-N 3Å; E80-R82 VanDerWaalsContact C-N 3.26Å; E80-R82 PolarHBondContact O-N 2.64Å; E80-Y83 PolarHBondContact O-N 3.38Å; E80-I84 HydrophobicContact CB-CD1 4.49Å; E80-I84 WeakPolarHBondContact O-CG1 3.36Å; E80-I84 PolarHBondContact O-N 3.45Å; E80-I84 VanDerWaalsContact O-N 3.1Å; E80-L132 HydrophobicContact CB-CD1 4.11Å; E80-E135 HydrophobicContact CG-CB 4.46Å; E80-Y136 HydrophobicContact CB-CE1 4.28Å; E80-Y136 HydrophobicContact CG-CD1 3.99Å; E80-Y136 HydrophobicContact CG-CE1 4.01Å; E80-Y136 WeakPolarHBondContact OE2-CE1 3.11Å; E80-Y323 WeakPolarHBondContact OE2-CE1 3.25Å; E80-Y323 PolarHBondContact OE2-OH 3.12Å |
| 81 | Q | 83.1 | Confident | 84.1 | Confident | 0 Ų | 0 | 30.3 Ų | 30.3 | 0% | 0 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -65.8 | -30.3 | -171.9 | -69.1 | -177.7 | -79.9 | 0 | 0 | 112.3 | H71 S74 Y75 V77 I84 I85 Y323 | H71-Q81 PolarHBondContact O-NE2 3.26Å; S74-Q81 PolarHBondContact O-NE2 3.5Å; S74-Q81 PolarHBondContact O-OE1 2.93Å; Y75-Q81 VanDerWaalsContact CA-OE1 3.29Å; Y75-Q81 HydrophobicContact CD2-CB 3.91Å; Y75-Q81 HydrophobicContact CE2-CB 3.72Å; V77-Q81 WeakPolarHBondContact O-CB 3.34Å; V77-Q81 WeakPolarHBondContact O-CG 3.39Å; V77-Q81 PolarHBondContact O-N 3.09Å; Q81-I84 PolarHBondContact O-N 2.8Å; Q81-I85 WeakPolarHBondContact O-CB 3.47Å; Q81-I85 WeakPolarHBondContact O-CD1 3.36Å; Q81-I85 WeakPolarHBondContact O-CG1 3.07Å; Q81-I85 PolarHBondContact O-N 3.04Å; Q81-Y323 HydrophobicContact CG-CD1 3.99Å; Q81-Y323 HydrophobicContact CG-CD2 4.26Å; Q81-Y323 HydrophobicContact CG-CE1 3.95Å; Q81-Y323 HydrophobicContact CG-CE2 4.22Å; Q81-Y323 HydrophobicContact CG-CG 4.16Å |
| 82 | R | 86.1 | Confident | 84.5 | Confident | 52 Ų | 52 | 31.2 Ų | 31.2 | 20% | 0.196 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -57.3 | -49.4 | 172.9 | 176.7 | 164.7 | -170 | -143.5 | -2.9 | 112.4 | P78 E80 R86 E345 T346 N348 D351 | P78-R82 WeakPolarHBondContact O-CB 3.4Å; P78-R82 PolarHBondContact O-N 2.89Å; P78-R82 VanDerWaalsContact O-N 3.07Å; E80-R82 VanDerWaalsContact C-N 3.26Å; E80-R82 PolarHBondContact O-N 2.64Å; R82-R86 WeakPolarHBondContact O-CG 3.41Å; R82-R86 PolarHBondContact O-N 3.25Å; R82-R86 VanDerWaalsContact O-N 3.13Å; R82-E345 PolarHBondContact NE-O 2.91Å; R82-E345 VanDerWaalsContact NE-O 3.13Å; R82-E345 PolarHBondContact NH2-O 2.81Å; R82-T346 HydrophobicContact CB-CG2 4.36Å; R82-T346 HydrophobicContact CG-CG2 4.08Å; R82-N348 PolarHBondContact NH2-O 2.83Å; R82-D351 VanDerWaalsContact CZ-CG 3.42Å; R82-D351 IonicContact CZ-OD1 2.99Å; R82-D351 IonicContact CZ-OD2 2.97Å; R82-D351 IonicContact NE-OD2 2.77Å; R82-D351 IonicContact NH1-OD1 3.5Å; R82-D351 PolarHBondContact NH1-OD1 3.27Å; R82-D351 IonicContact NH1-OD2 2.83Å; R82-D351 PolarHBondContact NH1-OD2 3.07Å; R82-D351 IonicContact NH2-OD1 3.55Å; R82-D351 PolarHBondContact NH2-OD1 3.46Å; R82-D351 IonicContact NH2-OD2 2.86Å; R82-D351 PolarHBondContact NH2-OD2 3.3Å |
| 83 | Y | 87.8 | Confident | 84.8 | Confident | 24 Ų | 24 | 32.2 Ų | 32.2 | 9% | 0.094 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -68.7 | -39.1 | 178.1 | -62.9 | -67.1 | 0 | 0 | 0 | 112 | N79 E80 R86 I87 N128 S131 L132 E135 | N79-Y83 WeakPolarHBondContact O-CD2 3.18Å; N79-Y83 VanDerWaalsContact O-CE2 3.28Å; N79-Y83 WeakPolarHBondContact O-CE2 3.28Å; E80-Y83 PolarHBondContact O-N 3.38Å; Y83-R86 PolarHBondContact O-N 2.88Å; Y83-I87 VanDerWaalsContact O-CG1 3.29Å; Y83-I87 WeakPolarHBondContact O-CG1 3.47Å; Y83-I87 PolarHBondContact O-N 2.78Å; Y83-N128 HydrophobicContact CD1-CB 4.1Å; Y83-N128 VanDerWaalsContact CD1-OD1 3.24Å; Y83-N128 WeakPolarHBondContact CD1-OD1 3.44Å; Y83-S131 VanDerWaalsContact CE1-CB 3.46Å; Y83-L132 HydrophobicContact CG-CB 4.33Å; Y83-E135 HydrophobicContact CD2-CG 4.18Å; Y83-E135 HydrophobicContact CE2-CG 3.74Å |
| 84 | I | 87.6 | Confident | 85.2 | Confident | 1 Ų | 1 | 23.8 Ų | 23.8 | 1% | 0.005 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -58 | -52.3 | 175.3 | -67.4 | 164.8 | 0 | 0 | 0 | 110.1 | E80 Q81 R86 I87 L88 L132 Y136 F318 Y323 | E80-I84 HydrophobicContact CB-CD1 4.49Å; E80-I84 WeakPolarHBondContact O-CG1 3.36Å; E80-I84 PolarHBondContact O-N 3.45Å; E80-I84 VanDerWaalsContact O-N 3.1Å; Q81-I84 PolarHBondContact O-N 2.8Å; I84-R86 VanDerWaalsContact C-N 3.3Å; I84-R86 PolarHBondContact O-N 3.46Å; I84-I87 WeakPolarHBondContact O-CB 3.29Å; I84-I87 PolarHBondContact O-N 2.89Å; I84-L88 HydrophobicContact CG2-CD1 3.58Å; I84-L88 WeakPolarHBondContact O-CD1 2.99Å; I84-L88 PolarHBondContact O-N 3.22Å; I84-L132 HydrophobicContact CD1-CD1 4.32Å; I84-L132 HydrophobicContact CG1-CD1 3.92Å; I84-L132 HydrophobicContact CG1-CD2 3.66Å; I84-L132 HydrophobicContact CG1-CG 4.47Å; I84-Y136 WeakPolarHBondContact CD1-OH 2.95Å; I84-F318 HydrophobicContact CD1-CD1 4.29Å; I84-F318 HydrophobicContact CG1-CD1 3.91Å; I84-F318 HydrophobicContact CG1-CE1 4.16Å; I84-F318 HydrophobicContact CG2-CB 3.96Å; I84-F318 HydrophobicContact CG2-CD1 3.93Å; I84-F318 HydrophobicContact CG2-CG 4Å; I84-Y323 HydrophobicContact CD1-CE2 3.96Å; I84-Y323 WeakPolarHBondContact CD1-OH 3.37Å |
| 85 | I | 88.1 | Confident | 85.8 | Confident | 0 Ų | 0 | 23.2 Ų | 23.2 | 0% | 0 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -58.5 | -43.4 | -179.7 | -69.8 | 162.1 | 0 | 0 | 0 | 110.8 | I68 H71 L72 Y75 Q81 I87 L88 F89 T346 | I68-I85 HydrophobicContact CG2-CG2 4.17Å; H71-I85 HydrophobicContact CB-CD1 4.23Å; H71-I85 HydrophobicContact CB-CG1 4.03Å; L72-I85 HydrophobicContact CD2-CD1 3.7Å; L72-I85 HydrophobicContact CG-CD1 4.13Å; Y75-I85 HydrophobicContact CD2-CD1 4.42Å; Y75-I85 HydrophobicContact CE2-CD1 4.11Å; Q81-I85 WeakPolarHBondContact O-CB 3.47Å; Q81-I85 WeakPolarHBondContact O-CD1 3.36Å; Q81-I85 WeakPolarHBondContact O-CG1 3.07Å; Q81-I85 PolarHBondContact O-N 3.04Å; I85-I87 VanDerWaalsContact C-N 3.34Å; I85-I87 PolarHBondContact O-N 3.24Å; I85-L88 WeakPolarHBondContact O-CB 3.46Å; I85-L88 PolarHBondContact O-N 2.81Å; I85-F89 HydrophobicContact CG2-CD2 3.94Å; I85-F89 HydrophobicContact CG2-CE2 3.59Å; I85-F89 WeakPolarHBondContact O-CD2 3.22Å; I85-F89 PolarHBondContact O-N 3.4Å; I85-T346 HydrophobicContact CB-CG2 3.67Å; I85-T346 HydrophobicContact CD1-CG2 4.08Å; I85-T346 HydrophobicContact CG1-CG2 4.5Å; I85-T346 HydrophobicContact CG2-CG2 3.56Å |
| 86 | R | 89.6 | Confident | 86.4 | Confident | 2 Ų | 2 | 25.1 Ų | 25.1 | 1% | 0.008 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -59.3 | -42.3 | 173.8 | -71 | 173 | 178.3 | 165.8 | 3.8 | 112.3 | R82 Y83 I84 F89 Y121 F124 N128 T346 N348 D351 | R82-R86 WeakPolarHBondContact O-CG 3.41Å; R82-R86 PolarHBondContact O-N 3.25Å; R82-R86 VanDerWaalsContact O-N 3.13Å; Y83-R86 PolarHBondContact O-N 2.88Å; I84-R86 VanDerWaalsContact C-N 3.3Å; I84-R86 PolarHBondContact O-N 3.46Å; R86-F89 PolarHBondContact O-N 3.44Å; R86-Y121 PolarHBondContact O-OH 3.08Å; R86-F124 HydrophobicContact CB-CE1 4.03Å; R86-F124 HydrophobicContact CG-CE1 4.02Å; R86-F124 HydrophobicContact CG-CZ 4.14Å; R86-N128 HydrophobicContact CB-CB 4.38Å; R86-N128 WeakPolarHBondContact CD-OD1 3.32Å; R86-N128 PolarHBondContact NH1-OD1 3.34Å; R86-T346 PolarHBondContact NE-O 3.2Å; R86-T346 PolarHBondContact NH2-O 3.48Å; R86-N348 PolarHBondContact NH2-O 2.92Å; R86-D351 IonicContact CZ-OD2 3.3Å; R86-D351 VanDerWaalsContact CZ-OD2 3.3Å; R86-D351 IonicContact NH1-OD2 2.93Å; R86-D351 PolarHBondContact NH1-OD2 2.79Å; R86-D351 IonicContact NH2-OD2 2.73Å; R86-D351 PolarHBondContact NH2-OD2 3.12Å |
| 87 | I | 88.8 | Confident | 87 | Confident | 0 Ų | 0 | 24.2 Ų | 24.2 | 0% | 0 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -64.6 | -41.6 | 176.4 | -67.3 | 161.6 | 0 | 0 | 0 | 110.9 | Y83 I84 I85 F89 I90 V125 N128 F129 L132 I255 L314 F318 | Y83-I87 VanDerWaalsContact O-CG1 3.29Å; Y83-I87 WeakPolarHBondContact O-CG1 3.47Å; Y83-I87 PolarHBondContact O-N 2.78Å; I84-I87 WeakPolarHBondContact O-CB 3.29Å; I84-I87 PolarHBondContact O-N 2.89Å; I85-I87 VanDerWaalsContact C-N 3.34Å; I85-I87 PolarHBondContact O-N 3.24Å; I87-F89 PolarHBondContact O-N 3.25Å; I87-I90 WeakPolarHBondContact O-CB 3.37Å; I87-I90 WeakPolarHBondContact O-CG2 3.35Å; I87-I90 PolarHBondContact O-N 3.05Å; I87-I90 VanDerWaalsContact O-N 3.07Å; I87-V125 HydrophobicContact CG1-CG1 4.4Å; I87-V125 HydrophobicContact CG2-CG1 4.31Å; I87-N128 HydrophobicContact CG1-CB 4.07Å; I87-F129 HydrophobicContact CD1-CB 4.04Å; I87-F129 HydrophobicContact CD1-CD2 4.22Å; I87-L132 HydrophobicContact CD1-CD2 3.84Å; I87-I255 HydrophobicContact CD1-CD1 4.16Å; I87-I255 HydrophobicContact CG2-CD1 3.67Å; I87-I255 HydrophobicContact CG2-CG1 3.92Å; I87-L314 HydrophobicContact CG2-CD2 4.46Å; I87-F318 HydrophobicContact CG2-CE2 4.31Å |
| 88 | L | 89.5 | Confident | 87.3 | Confident | 0 Ų | 0 | 23.2 Ų | 23.2 | 0% | 0 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -60 | -29.9 | 179.8 | -91.4 | 66.3 | 0 | 0 | 0 | 112.5 | T64 Q67 I68 I84 I85 I90 V91 P92 F318 | T64-L88 HydrophobicContact CG2-CB 4.37Å; T64-L88 VanDerWaalsContact CG2-O 3.31Å; T64-L88 WeakPolarHBondContact CG2-O 3.32Å; Q67-L88 HydrophobicContact CB-CD2 4.03Å; Q67-L88 HydrophobicContact CG-CD2 3.53Å; I68-L88 HydrophobicContact CD1-CB 4.33Å; I68-L88 HydrophobicContact CG1-CB 4Å; I68-L88 HydrophobicContact CG1-CD2 3.92Å; I84-L88 HydrophobicContact CG2-CD1 3.58Å; I84-L88 WeakPolarHBondContact O-CD1 2.99Å; I84-L88 PolarHBondContact O-N 3.22Å; I85-L88 WeakPolarHBondContact O-CB 3.46Å; I85-L88 PolarHBondContact O-N 2.81Å; L88-I90 PolarHBondContact O-N 3.19Å; L88-V91 PolarHBondContact O-N 3.24Å; L88-P92 VanDerWaalsContact O-CD 3.29Å; L88-P92 WeakPolarHBondContact O-CD 3.22Å; L88-F318 HydrophobicContact CD1-CB 4.2Å; L88-F318 HydrophobicContact CD1-CD2 4.07Å; L88-F318 HydrophobicContact CD1-CG 4.26Å |
| 89 | F | 89.7 | Confident | 87.8 | Confident | 48 Ų | 48 | 22.9 Ų | 22.9 | 21% | 0.211 | 11% | 0.107 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -67.7 | -7.8 | 177.8 | -87.4 | -68.9 | 0 | 0 | 0 | 114.1 | I68 I85 R86 I87 V91 P92 V93 Y121 L343 I347 | I68-F89 HydrophobicContact CD1-CD1 4.04Å; I68-F89 HydrophobicContact CD1-CD2 4.21Å; I68-F89 HydrophobicContact CD1-CE1 3.84Å; I68-F89 HydrophobicContact CD1-CE2 4.02Å; I68-F89 HydrophobicContact CD1-CG 4.19Å; I68-F89 HydrophobicContact CD1-CZ 3.81Å; I68-F89 HydrophobicContact CG2-CE2 4.48Å; I68-F89 HydrophobicContact CG2-CZ 4.38Å; I85-F89 HydrophobicContact CG2-CD2 3.94Å; I85-F89 HydrophobicContact CG2-CE2 3.59Å; I85-F89 WeakPolarHBondContact O-CD2 3.22Å; I85-F89 PolarHBondContact O-N 3.4Å; R86-F89 PolarHBondContact O-N 3.44Å; I87-F89 PolarHBondContact O-N 3.25Å; F89-V91 VanDerWaalsContact C-N 3.32Å; F89-V91 PolarHBondContact O-N 3.49Å; F89-P92 HydrophobicContact CB-CG 4.47Å; F89-P92 HydrophobicContact CD1-CG 3.85Å; F89-P92 VanDerWaalsContact O-CD 3.26Å; F89-P92 WeakPolarHBondContact O-CD 3.34Å; F89-P92 VanDerWaalsContact O-CG 3.27Å; F89-P92 WeakPolarHBondContact O-CG 3.34Å; F89-V93 VanDerWaalsContact O-CG2 3.26Å; F89-V93 WeakPolarHBondContact O-CG2 3.39Å; F89-V93 PolarHBondContact O-N 2.74Å; F89-Y121 WeakPolarHBondContact CB-OH 3.4Å; F89-L343 HydrophobicContact CE2-CD1 3.81Å; F89-L343 HydrophobicContact CZ-CD1 3.8Å; F89-I347 HydrophobicContact CE2-CD1 3.82Å; F89-I347 HydrophobicContact CE2-CG1 4.13Å; F89-I347 HydrophobicContact CZ-CD1 3.99Å |
| 90 | I | 88.6 | Confident | 88 | Confident | 5 Ų | 5 | 19.8 Ų | 19.8 | 3% | 0.026 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -59.6 | -43.4 | 173.1 | -165 | 174.3 | 0 | 0 | 0 | 112 | I87 L88 V93 Y94 Y121 V125 V258 I259 L314 | I87-I90 WeakPolarHBondContact O-CB 3.37Å; I87-I90 WeakPolarHBondContact O-CG2 3.35Å; I87-I90 PolarHBondContact O-N 3.05Å; I87-I90 VanDerWaalsContact O-N 3.07Å; L88-I90 PolarHBondContact O-N 3.19Å; I90-V93 PolarHBondContact O-N 3.49Å; I90-Y94 HydrophobicContact CD1-CE2 4.19Å; I90-Y94 HydrophobicContact CG1-CD2 3.64Å; I90-Y94 HydrophobicContact CG1-CE2 3.66Å; I90-Y94 HydrophobicContact CG1-CG 4.37Å; I90-Y94 WeakPolarHBondContact O-CB 3.33Å; I90-Y94 VanDerWaalsContact O-CD2 3.26Å; I90-Y94 WeakPolarHBondContact O-CD2 3.3Å; I90-Y94 PolarHBondContact O-N 3.33Å; I90-Y121 HydrophobicContact CB-CD1 4.2Å; I90-Y121 HydrophobicContact CB-CE1 3.82Å; I90-Y121 HydrophobicContact CG1-CD1 4.1Å; I90-Y121 HydrophobicContact CG1-CE1 4.24Å; I90-V125 HydrophobicContact CB-CG2 3.92Å; I90-V125 HydrophobicContact CD1-CB 4.38Å; I90-V125 HydrophobicContact CD1-CG1 4.18Å; I90-V125 HydrophobicContact CD1-CG2 4.05Å; I90-V125 HydrophobicContact CG1-CG2 4.13Å; I90-V258 HydrophobicContact CD1-CG1 4.2Å; I90-I259 HydrophobicContact CD1-CG1 4.23Å; I90-L314 HydrophobicContact CG2-CD1 4.14Å |
| 91 | V | 90.4 | Very high | 87.9 | Confident | 0 Ų | 0 | 18.5 Ų | 18.5 | 0% | 0 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -61.3 | -54.2 | -177.8 | 173.9 | 0 | 0 | 0 | 0 | 111.7 | A60 T64 L88 F89 V93 Y94 A95 M307 A310 A311 L314 | A60-V91 HydrophobicContact CB-CG1 4.05Å; T64-V91 HydrophobicContact CG2-CB 4.39Å; T64-V91 WeakPolarHBondContact OG1-CG1 2.94Å; L88-V91 PolarHBondContact O-N 3.24Å; F89-V91 VanDerWaalsContact C-N 3.32Å; F89-V91 PolarHBondContact O-N 3.49Å; V91-V93 PolarHBondContact O-N 3.21Å; V91-Y94 PolarHBondContact O-N 2.99Å; V91-A95 WeakPolarHBondContact O-CB 3.33Å; V91-A95 PolarHBondContact O-N 3.18Å; V91-M307 HydrophobicContact CG1-CB 4.27Å; V91-M307 HydrophobicContact CG2-SD 4.48Å; V91-A310 HydrophobicContact CG2-CB 4.36Å; V91-A311 HydrophobicContact CG1-CB 3.94Å; V91-L314 HydrophobicContact CG2-CD1 3.42Å; V91-L314 VanDerWaalsContact CG2-CD1 3.42Å |
| 92 | P | 90.8 | Very high | 87.8 | Confident | 20 Ų | 20 | 18.8 Ų | 18.8 | 13% | 0.13 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -65.1 | -37.9 | -178.5 | 22.9 | -34.1 | 0 | 0 | 0 | 112.8 | L61 T64 L88 F89 F96 | L61-P92 VanDerWaalsContact CD2-CA 3.47Å; L61-P92 HydrophobicContact CD2-CB 3.37Å; T64-P92 HydrophobicContact CG2-CG 4.33Å; L88-P92 VanDerWaalsContact O-CD 3.29Å; L88-P92 WeakPolarHBondContact O-CD 3.22Å; F89-P92 HydrophobicContact CB-CG 4.47Å; F89-P92 HydrophobicContact CD1-CG 3.85Å; F89-P92 VanDerWaalsContact O-CD 3.26Å; F89-P92 WeakPolarHBondContact O-CD 3.34Å; F89-P92 VanDerWaalsContact O-CG 3.27Å; F89-P92 WeakPolarHBondContact O-CG 3.34Å; P92-F96 WeakPolarHBondContact O-CB 3.28Å; P92-F96 PolarHBondContact O-N 2.91Å |
| 93 | V | 89.2 | Confident | 87.5 | Confident | 33 Ų | 33 | 19.6 Ų | 19.6 | 20% | 0.2 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -61.7 | -53.4 | 176.2 | 172.3 | 0 | 0 | 0 | 0 | 109.8 | F89 I90 V91 D97 Y121 | F89-V93 VanDerWaalsContact O-CG2 3.26Å; F89-V93 WeakPolarHBondContact O-CG2 3.39Å; F89-V93 PolarHBondContact O-N 2.74Å; I90-V93 PolarHBondContact O-N 3.49Å; V91-V93 PolarHBondContact O-N 3.21Å; V93-D97 WeakPolarHBondContact CG1-OD2 3.41Å; V93-D97 WeakPolarHBondContact O-CB 3.48Å; V93-D97 PolarHBondContact O-N 3.36Å; V93-Y121 HydrophobicContact CB-CG 4.47Å; V93-Y121 HydrophobicContact CG1-CD2 4.4Å; V93-Y121 HydrophobicContact CG1-CG 4.11Å; V93-Y121 HydrophobicContact CG2-CD2 4.22Å; V93-Y121 HydrophobicContact CG2-CE2 4.15Å; V93-Y121 HydrophobicContact CG2-CG 4.48Å |
| 94 | Y | 88.4 | Confident | 86.9 | Confident | 8 Ų | 8 | 23.3 Ų | 23.3 | 3% | 0.031 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -67.6 | -41.7 | -177.6 | -84.9 | -118.6 | 0 | 0 | 0 | 112.9 | I90 V91 S98 R118 Y121 E122 I303 M307 | I90-Y94 HydrophobicContact CD1-CE2 4.19Å; I90-Y94 HydrophobicContact CG1-CD2 3.64Å; I90-Y94 HydrophobicContact CG1-CE2 3.66Å; I90-Y94 HydrophobicContact CG1-CG 4.37Å; I90-Y94 WeakPolarHBondContact O-CB 3.33Å; I90-Y94 VanDerWaalsContact O-CD2 3.26Å; I90-Y94 WeakPolarHBondContact O-CD2 3.3Å; I90-Y94 PolarHBondContact O-N 3.33Å; V91-Y94 PolarHBondContact O-N 2.99Å; Y94-S98 WeakPolarHBondContact O-CB 3.4Å; Y94-S98 PolarHBondContact O-N 3.34Å; Y94-S98 PolarHBondContact O-OG 3.44Å; Y94-R118 HydrophobicContact CE1-CB 4.39Å; Y94-R118 HydrophobicContact CE2-CB 4.25Å; Y94-R118 PolarHBondContact OH-O 3.33Å; Y94-Y121 HydrophobicContact CE2-CD1 4.34Å; Y94-E122 VanDerWaalsContact OH-CB 3.27Å; Y94-E122 WeakPolarHBondContact OH-CB 3.48Å; Y94-I303 HydrophobicContact CD1-CG2 4.33Å; Y94-M307 HydrophobicContact CD1-CE 4.03Å; Y94-M307 HydrophobicContact CG-CE 4.31Å; Y94-M307 HydrophobicContact CG-SD 4.35Å |
| 95 | A | 90 | Very high | 85.9 | Confident | 0 Ų | 0 | 24.2 Ų | 24.2 | 0% | 0 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -66.2 | -44.5 | -179.7 | 0 | 0 | 0 | 0 | 0 | 111.1 | V57 V91 W99 M307 | V57-A95 HydrophobicContact CB-CB 4.46Å; V57-A95 HydrophobicContact CG1-CB 4.01Å; V57-A95 HydrophobicContact CG2-CB 4.24Å; V91-A95 WeakPolarHBondContact O-CB 3.33Å; V91-A95 PolarHBondContact O-N 3.18Å; A95-W99 VanDerWaalsContact O-CB 3.23Å; A95-W99 WeakPolarHBondContact O-CB 3.4Å; A95-W99 PolarHBondContact O-N 3.17Å; A95-M307 HydrophobicContact CB-CB 3.88Å; A95-M307 HydrophobicContact CB-CG 4.21Å |
| 96 | F | 89.1 | Confident | 84.5 | Confident | 93 Ų | 93 | 27 Ų | 27 | 41% | 0.408 | 14% | 0.135 | S | C | . | . | H | α-helix | trans | -69.1 | -47.8 | 179.3 | -173.1 | -102.1 | 0 | 0 | 0 | 111.7 | P92 S98 W99 L100 | P92-F96 WeakPolarHBondContact O-CB 3.28Å; P92-F96 PolarHBondContact O-N 2.91Å; F96-S98 PolarHBondContact O-N 2.9Å; F96-W99 HydrophobicContact CD2-CE3 4.35Å; F96-W99 HydrophobicContact CE2-CE3 4.43Å; F96-W99 HydrophobicContact CE2-CZ3 4.39Å; F96-W99 PolarHBondContact O-N 3.22Å; F96-L100 HydrophobicContact CE1-CD2 3.96Å; F96-L100 HydrophobicContact CZ-CD2 4.45Å; F96-L100 VanDerWaalsContact O-CB 3.26Å; F96-L100 WeakPolarHBondContact O-CB 3.29Å; F96-L100 PolarHBondContact O-N 2.95Å |
| 97 | D | 88 | Confident | 83.2 | Confident | 17 Ų | 17 | 30.8 Ų | 30.8 | 9% | 0.091 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -63.5 | -41.2 | -179.9 | -71.3 | -15.2 | 0 | 0 | 0 | 111.5 | V93 L100 S101 R118 | V93-D97 WeakPolarHBondContact CG1-OD2 3.41Å; V93-D97 WeakPolarHBondContact O-CB 3.48Å; V93-D97 PolarHBondContact O-N 3.36Å; D97-L100 PolarHBondContact O-N 3.28Å; D97-S101 VanDerWaalsContact O-CB 3.23Å; D97-S101 WeakPolarHBondContact O-CB 3.06Å; D97-S101 PolarHBondContact O-N 3.07Å; D97-R118 HydrophobicContact CB-CG 3.81Å |
| 98 | S | 86.8 | Confident | 81.8 | Confident | 0 Ų | 0 | 33.9 Ų | 33.9 | 0% | 0 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -69.1 | -38.7 | 178.3 | -52 | 0 | 0 | 0 | 0 | 111.6 | Y94 F96 S101 L102 R118 I303 | Y94-S98 WeakPolarHBondContact O-CB 3.4Å; Y94-S98 PolarHBondContact O-N 3.34Å; Y94-S98 PolarHBondContact O-OG 3.44Å; F96-S98 PolarHBondContact O-N 2.9Å; S98-S101 PolarHBondContact O-N 2.88Å; S98-L102 VanDerWaalsContact O-CG 3.3Å; S98-L102 WeakPolarHBondContact O-CG 3.37Å; S98-L102 PolarHBondContact O-N 2.77Å; S98-R118 PolarHBondContact OG-NH1 3.45Å; S98-I303 WeakPolarHBondContact OG-CG2 3.29Å |
| 99 | W | 87.8 | Confident | 80.5 | Confident | 48 Ų | 48 | 39.4 Ų | 39.4 | 18% | 0.182 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -65.6 | -44.1 | 174.8 | -176.7 | 53.1 | 0 | 0 | 0 | 112 | V57 W58 A95 F96 S101 L102 L103 | V57-W99 HydrophobicContact CB-CB 4.4Å; V57-W99 HydrophobicContact CB-CG 4.49Å; V57-W99 HydrophobicContact CG1-CB 4.08Å; V57-W99 HydrophobicContact CG1-CG 4.33Å; V57-W99 HydrophobicContact CG2-CB 3.87Å; V57-W99 HydrophobicContact CG2-CG 4.28Å; W58-W99 AromaticContact NE1-CH2 3.86Å; A95-W99 VanDerWaalsContact O-CB 3.23Å; A95-W99 WeakPolarHBondContact O-CB 3.4Å; A95-W99 PolarHBondContact O-N 3.17Å; F96-W99 HydrophobicContact CD2-CE3 4.35Å; F96-W99 HydrophobicContact CE2-CE3 4.43Å; F96-W99 HydrophobicContact CE2-CZ3 4.39Å; F96-W99 PolarHBondContact O-N 3.22Å; W99-S101 VanDerWaalsContact C-N 3.32Å; W99-S101 PolarHBondContact O-N 2.91Å; W99-L102 WeakPolarHBondContact O-CB 3.42Å; W99-L102 PolarHBondContact O-N 2.9Å; W99-L103 HydrophobicContact CD2-CD1 4.17Å; W99-L103 HydrophobicContact CH2-CD1 4.22Å; W99-L103 HydrophobicContact CZ2-CD1 3.85Å; W99-L103 WeakPolarHBondContact O-CG 3.41Å; W99-L103 PolarHBondContact O-N 3.49Å; W99-L103 VanDerWaalsContact O-N 3.07Å |
| 100 | L | 85.7 | Confident | 79.4 | Confident | 34 Ų | 34 | 43.2 Ų | 43.2 | 18% | 0.178 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -64 | -41.6 | 177.6 | -164.8 | 62.1 | 0 | 0 | 0 | 110.9 | F96 D97 L102 L103 F104 F114 | F96-L100 HydrophobicContact CE1-CD2 3.96Å; F96-L100 HydrophobicContact CZ-CD2 4.45Å; F96-L100 VanDerWaalsContact O-CB 3.26Å; F96-L100 WeakPolarHBondContact O-CB 3.29Å; F96-L100 PolarHBondContact O-N 2.95Å; D97-L100 PolarHBondContact O-N 3.28Å; L100-L102 VanDerWaalsContact C-N 3.3Å; L100-L102 PolarHBondContact O-N 2.99Å; L100-L103 PolarHBondContact O-N 2.94Å; L100-F104 HydrophobicContact CD1-CD2 3.74Å; L100-F104 HydrophobicContact CD1-CE2 3.46Å; L100-F104 VanDerWaalsContact CD1-CE2 3.46Å; L100-F104 HydrophobicContact CG-CD2 3.97Å; L100-F104 HydrophobicContact CG-CE2 4.15Å; L100-F104 WeakPolarHBondContact O-CD2 3.31Å; L100-F104 PolarHBondContact O-N 3.34Å; L100-F114 HydrophobicContact CB-CZ 4.49Å; L100-F114 HydrophobicContact CD2-CD1 4.32Å; L100-F114 HydrophobicContact CD2-CE1 3.36Å; L100-F114 HydrophobicContact CD2-CE2 4.4Å; L100-F114 HydrophobicContact CD2-CZ 3.4Å; L100-F114 VanDerWaalsContact CD2-CZ 3.4Å; L100-F114 HydrophobicContact CG-CE1 4.08Å; L100-F114 HydrophobicContact CG-CE2 4.31Å; L100-F114 HydrophobicContact CG-CZ 3.74Å |
| 101 | S | 82 | Confident | 78.5 | Confident | 4 Ų | 4 | 44.5 Ų | 44.5 | 3% | 0.028 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -62.1 | -35.7 | 174.3 | -179.1 | 0 | 0 | 0 | 0 | 112.5 | D97 S98 W99 I105 Y111 N300 | D97-S101 VanDerWaalsContact O-CB 3.23Å; D97-S101 WeakPolarHBondContact O-CB 3.06Å; D97-S101 PolarHBondContact O-N 3.07Å; S98-S101 PolarHBondContact O-N 2.88Å; W99-S101 VanDerWaalsContact C-N 3.32Å; W99-S101 PolarHBondContact O-N 2.91Å; S101-I105 WeakPolarHBondContact O-CG1 3.38Å; S101-I105 PolarHBondContact O-N 3.25Å; S101-Y111 WeakPolarHBondContact OG-CD2 3.49Å; S101-N300 WeakPolarHBondContact CB-ND2 3.31Å; S101-N300 PolarHBondContact OG-ND2 3.14Å |
| 102 | L | 80.5 | Confident | 77.5 | Confident | 5 Ų | 5 | 44.9 Ų | 44.9 | 3% | 0.026 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -67.7 | -36.4 | 174 | -72.4 | 171.4 | 0 | 0 | 0 | 112.8 | L44 S98 W99 L100 F104 I105 G297 N300 F301 | L44-L102 HydrophobicContact CD2-CD2 4.45Å; S98-L102 VanDerWaalsContact O-CG 3.3Å; S98-L102 WeakPolarHBondContact O-CG 3.37Å; S98-L102 PolarHBondContact O-N 2.77Å; W99-L102 WeakPolarHBondContact O-CB 3.42Å; W99-L102 PolarHBondContact O-N 2.9Å; L100-L102 VanDerWaalsContact C-N 3.3Å; L100-L102 PolarHBondContact O-N 2.99Å; L102-F104 VanDerWaalsContact C-N 3.34Å; L102-I105 HydrophobicContact CD2-CD1 3.94Å; L102-I105 WeakPolarHBondContact O-CD1 3.37Å; L102-I105 WeakPolarHBondContact O-CG1 3.22Å; L102-G297 VanDerWaalsContact CD2-O 3.23Å; L102-G297 WeakPolarHBondContact CD2-O 3.41Å; L102-N300 HydrophobicContact CD2-CB 3.96Å; L102-N300 HydrophobicContact CG-CB 3.96Å; L102-F301 HydrophobicContact CD1-CB 4.25Å; L102-F301 HydrophobicContact CD1-CD2 4.36Å; L102-F301 HydrophobicContact CD2-CB 4.19Å |
| 103 | L | 79.6 | Confident | 76.8 | Confident | 69 Ų | 69 | 49.8 Ų | 49.8 | 36% | 0.361 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -71.7 | -29.9 | 178.7 | -68.6 | 177.4 | 0 | 0 | 0 | 112.5 | W99 L100 | W99-L103 HydrophobicContact CD2-CD1 4.17Å; W99-L103 HydrophobicContact CH2-CD1 4.22Å; W99-L103 HydrophobicContact CZ2-CD1 3.85Å; W99-L103 WeakPolarHBondContact O-CG 3.41Å; W99-L103 PolarHBondContact O-N 3.49Å; W99-L103 VanDerWaalsContact O-N 3.07Å; L100-L103 PolarHBondContact O-N 2.94Å |
| 104 | F | 75.4 | Confident | 76.4 | Confident | 103 Ų | 103 | 50 Ų | 50 | 45% | 0.452 | 23% | 0.234 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -106.7 | 24 | -177.2 | -69.6 | -70.6 | 0 | 0 | 0 | 114.1 | L100 L102 S106 N107 | L100-F104 HydrophobicContact CD1-CD2 3.74Å; L100-F104 HydrophobicContact CD1-CE2 3.46Å; L100-F104 VanDerWaalsContact CD1-CE2 3.46Å; L100-F104 HydrophobicContact CG-CD2 3.97Å; L100-F104 HydrophobicContact CG-CE2 4.15Å; L100-F104 WeakPolarHBondContact O-CD2 3.31Å; L100-F104 PolarHBondContact O-N 3.34Å; L102-F104 VanDerWaalsContact C-N 3.34Å; F104-S106 PolarHBondContact O-N 2.97Å; F104-S106 VanDerWaalsContact O-N 3.12Å; F104-N107 PolarHBondContact O-N 3.24Å; F104-N107 VanDerWaalsContact O-N 3.11Å |
| 105 | I | 65.8 | Low | 75.8 | Confident | 19 Ų | 19 | 51.1 Ų | 51.1 | 10% | 0.097 | 24% | 0.24 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -52.7 | -33.7 | 177.7 | -75.7 | 172.2 | 0 | 0 | 0 | 112.5 | S101 L102 N107 | S101-I105 WeakPolarHBondContact O-CG1 3.38Å; S101-I105 PolarHBondContact O-N 3.25Å; L102-I105 HydrophobicContact CD2-CD1 3.94Å; L102-I105 WeakPolarHBondContact O-CD1 3.37Å; L102-I105 WeakPolarHBondContact O-CG1 3.22Å; I105-N107 PolarHBondContact O-N 3.33Å |
| 106 | S | 57.9 | Low | 75.3 | Confident | 58 Ų | 58 | 51.8 Ų | 51.8 | 41% | 0.406 | 25% | 0.245 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -67.5 | -15.2 | -177.4 | -56.9 | 0 | 0 | 0 | 0 | 114.4 | F104 E285 | F104-S106 PolarHBondContact O-N 2.97Å; F104-S106 VanDerWaalsContact O-N 3.12Å; S106-E285 PolarHBondContact OG-OE2 3.02Å |
| 107 | N | 64.2 | Low | 75 | Confident | 83 Ų | 83 | 51 Ų | 51 | 44% | 0.444 | 25% | 0.248 | S | C | . | . | trans | -108.2 | 95.2 | 178.2 | -69.7 | -24.8 | 0 | 0 | 0 | 110.7 | F104 I105 Q109 Y110 | F104-N107 PolarHBondContact O-N 3.24Å; F104-N107 VanDerWaalsContact O-N 3.11Å; I105-N107 PolarHBondContact O-N 3.33Å; N107-Q109 PolarHBondContact O-N 3.33Å; N107-Y110 HydrophobicContact CB-CD2 3.53Å; N107-Y110 HydrophobicContact CB-CE2 4.02Å; N107-Y110 PolarHBondContact O-N 3.13Å; N107-Y110 VanDerWaalsContact O-N 3.14Å | ||
| 108 | D | 59 | Low | 74.8 | Confident | 65 Ų | 65 | 50.7 Ų | 50.7 | 35% | 0.348 | 25% | 0.246 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -49.8 | -20.1 | -175.6 | -85.6 | -27.9 | 0 | 0 | 0 | 115.9 | T293 | D108-T293 PolarHBondContact OD1-OG1 3.37Š|
| 109 | Q | 61.3 | Low | 74.5 | Confident | 115 Ų | 115 | 53.5 Ų | 53.5 | 54% | 0.537 | 26% | 0.26 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -90.1 | -23.5 | -175.6 | -59.3 | -59.7 | -63.9 | 0 | 0 | 114.2 | N107 Y113 | N107-Q109 PolarHBondContact O-N 3.33Å; Q109-Y113 WeakPolarHBondContact O-CD2 2.99Å; Q109-Y113 VanDerWaalsContact O-CE2 3.28Å; Q109-Y113 WeakPolarHBondContact O-CE2 3.28Å |
| 110 | Y | 67.1 | Low | 74.3 | Confident | 129 Ų | 129 | 53.5 Ų | 53.5 | 51% | 0.506 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -81.7 | -28.6 | -172.7 | -72.5 | -78.5 | 0 | 0 | 0 | 113.7 | N107 V112 Y113 F114 | N107-Y110 HydrophobicContact CB-CD2 3.53Å; N107-Y110 HydrophobicContact CB-CE2 4.02Å; N107-Y110 PolarHBondContact O-N 3.13Å; N107-Y110 VanDerWaalsContact O-N 3.14Å; Y110-V112 VanDerWaalsContact C-N 3.32Å; Y110-V112 PolarHBondContact O-N 3.18Å; Y110-Y113 PolarHBondContact O-N 3.45Å; Y110-F114 WeakPolarHBondContact O-CD2 3.08Å; Y110-F114 PolarHBondContact O-N 3.21Å |
| 111 | Y | 69.9 | Low | 74.4 | Confident | 32 Ų | 32 | 53.7 Ų | 53.7 | 13% | 0.125 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -52.8 | -47.4 | 179.6 | 166.4 | -109.7 | 0 | 0 | 0 | 112.3 | S101 Y113 F114 D115 A296 | S101-Y111 WeakPolarHBondContact OG-CD2 3.49Å; Y111-Y113 VanDerWaalsContact C-N 3.27Å; Y111-Y113 PolarHBondContact O-N 3.02Å; Y111-F114 PolarHBondContact O-N 2.87Å; Y111-F114 VanDerWaalsContact O-N 3.12Å; Y111-D115 WeakPolarHBondContact CD2-OD1 3.2Å; Y111-D115 WeakPolarHBondContact CE2-OD1 3.17Å; Y111-D115 VanDerWaalsContact CE2-OD2 3.31Å; Y111-D115 WeakPolarHBondContact CE2-OD2 3.41Å; Y111-D115 VanDerWaalsContact CZ-CG 3.41Å; Y111-D115 PolarHBondContact O-N 3.36Å; Y111-D115 PolarHBondContact OH-OD2 3.1Å; Y111-A296 HydrophobicContact CD1-CB 4.43Å; Y111-A296 HydrophobicContact CD2-CB 4.17Å; Y111-A296 HydrophobicContact CE1-CB 3.73Å; Y111-A296 HydrophobicContact CE2-CB 3.44Å; Y111-A296 VanDerWaalsContact CE2-CB 3.44Å; Y111-A296 VanDerWaalsContact OH-CB 3.28Å; Y111-A296 WeakPolarHBondContact OH-CB 3.28Å |
| 112 | V | 69.9 | Low | 74.5 | Confident | 8 Ų | 8 | 53.9 Ų | 53.9 | 5% | 0.048 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -64.4 | -30.8 | -176.7 | -176.5 | 0 | 0 | 0 | 0 | 113 | Y110 S116 T194 Q198 | Y110-V112 VanDerWaalsContact C-N 3.32Å; Y110-V112 PolarHBondContact O-N 3.18Å; V112-S116 WeakPolarHBondContact O-CB 3.32Å; V112-S116 PolarHBondContact O-N 3.02Å; V112-S116 PolarHBondContact O-OG 3.07Å; V112-T194 HydrophobicContact CG1-CG2 4.31Å; V112-Q198 VanDerWaalsContact CG1-OE1 3.28Å |
| 113 | Y | 75.5 | Confident | 74.8 | Confident | 123 Ų | 123 | 53.7 Ų | 53.7 | 48% | 0.482 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -69.6 | -42.6 | 175.6 | -66.4 | -80.1 | 0 | 0 | 0 | 111.7 | Q109 Y110 Y111 D115 S116 V117 | Q109-Y113 WeakPolarHBondContact O-CD2 2.99Å; Q109-Y113 VanDerWaalsContact O-CE2 3.28Å; Q109-Y113 WeakPolarHBondContact O-CE2 3.28Å; Y110-Y113 PolarHBondContact O-N 3.45Å; Y111-Y113 VanDerWaalsContact C-N 3.27Å; Y111-Y113 PolarHBondContact O-N 3.02Å; Y113-D115 VanDerWaalsContact C-N 3.32Å; Y113-S116 PolarHBondContact O-N 3.15Å; Y113-V117 WeakPolarHBondContact O-CG2 3.4Å; Y113-V117 PolarHBondContact O-N 3.38Å; Y113-V117 VanDerWaalsContact O-N 3.16Å |
| 114 | F | 79.6 | Confident | 75.1 | Confident | 38 Ų | 38 | 51.7 Ų | 51.7 | 17% | 0.167 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -64.8 | -39.6 | 176.7 | -65.2 | -58 | 0 | 0 | 0 | 111.3 | L100 Y110 Y111 S116 V117 R118 | L100-F114 HydrophobicContact CB-CZ 4.49Å; L100-F114 HydrophobicContact CD2-CD1 4.32Å; L100-F114 HydrophobicContact CD2-CE1 3.36Å; L100-F114 HydrophobicContact CD2-CE2 4.4Å; L100-F114 HydrophobicContact CD2-CZ 3.4Å; L100-F114 VanDerWaalsContact CD2-CZ 3.4Å; L100-F114 HydrophobicContact CG-CE1 4.08Å; L100-F114 HydrophobicContact CG-CE2 4.31Å; L100-F114 HydrophobicContact CG-CZ 3.74Å; Y110-F114 WeakPolarHBondContact O-CD2 3.08Å; Y110-F114 PolarHBondContact O-N 3.21Å; Y111-F114 PolarHBondContact O-N 2.87Å; Y111-F114 VanDerWaalsContact O-N 3.12Å; F114-S116 PolarHBondContact O-N 3.28Å; F114-V117 PolarHBondContact O-N 3.47Å; F114-R118 WeakPolarHBondContact O-CG 3.47Å; F114-R118 PolarHBondContact O-N 2.67Å; F114-R118 VanDerWaalsContact O-N 3.09Å |
| 115 | D | 76.2 | Confident | 75.6 | Confident | 30 Ų | 30 | 46.8 Ų | 46.8 | 16% | 0.16 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -61.1 | -45.3 | 174.7 | -79.2 | 36.5 | 0 | 0 | 0 | 111.8 | Y111 Y113 V117 R118 D119 | Y111-D115 WeakPolarHBondContact CD2-OD1 3.2Å; Y111-D115 WeakPolarHBondContact CE2-OD1 3.17Å; Y111-D115 VanDerWaalsContact CE2-OD2 3.31Å; Y111-D115 WeakPolarHBondContact CE2-OD2 3.41Å; Y111-D115 VanDerWaalsContact CZ-CG 3.41Å; Y111-D115 PolarHBondContact O-N 3.36Å; Y111-D115 PolarHBondContact OH-OD2 3.1Å; Y113-D115 VanDerWaalsContact C-N 3.32Å; D115-V117 VanDerWaalsContact C-N 3.28Å; D115-V117 PolarHBondContact O-N 2.89Å; D115-R118 VanDerWaalsContact CG-NH2 3.29Å; D115-R118 PolarHBondContact O-N 3.31Å; D115-R118 IonicContact OD1-CZ 2.89Å; D115-R118 IonicContact OD1-NE 3.17Å; D115-R118 IonicContact OD1-NH2 3.6Å; D115-R118 PolarHBondContact OD1-NH2 3.47Å; D115-R118 IonicContact OD2-NH2 2.94Å; D115-D119 VanDerWaalsContact O-CB 3.29Å; D115-D119 WeakPolarHBondContact O-CB 3.46Å; D115-D119 PolarHBondContact O-N 3.45Å |
| 116 | S | 80.3 | Confident | 76.6 | Confident | 15 Ų | 15 | 46 Ų | 46 | 11% | 0.105 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -59.2 | -38.3 | 178 | -62.5 | 0 | 0 | 0 | 0 | 112.5 | V112 Y113 F114 C120 | V112-S116 WeakPolarHBondContact O-CB 3.32Å; V112-S116 PolarHBondContact O-N 3.02Å; V112-S116 PolarHBondContact O-OG 3.07Å; Y113-S116 PolarHBondContact O-N 3.15Å; F114-S116 PolarHBondContact O-N 3.28Å; S116-C120 PolarHBondContact O-N 2.79Å; S116-C120 VanDerWaalsContact O-N 3.09Å; S116-C120 PolarHBondContact O-SG 3.3Å |
| 117 | V | 82.5 | Confident | 78 | Confident | 77 Ų | 77 | 43.3 Ų | 43.3 | 47% | 0.467 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -67.6 | -49 | 177.2 | 172.2 | 0 | 0 | 0 | 0 | 110.9 | Y113 F114 D115 D119 C120 Y121 | Y113-V117 WeakPolarHBondContact O-CG2 3.4Å; Y113-V117 PolarHBondContact O-N 3.38Å; Y113-V117 VanDerWaalsContact O-N 3.16Å; F114-V117 PolarHBondContact O-N 3.47Å; D115-V117 VanDerWaalsContact C-N 3.28Å; D115-V117 PolarHBondContact O-N 2.89Å; V117-D119 VanDerWaalsContact C-N 3.27Å; V117-D119 PolarHBondContact O-N 2.78Å; V117-C120 PolarHBondContact O-N 2.91Å; V117-Y121 PolarHBondContact O-N 2.93Å |
| 118 | R | 83 | Confident | 79.1 | Confident | 10 Ų | 10 | 39.3 Ų | 39.3 | 4% | 0.038 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -57.3 | -44.1 | 176.8 | -67.8 | -174.1 | -66.4 | 170.6 | 3.1 | 111.1 | Y94 D97 S98 F114 D115 C120 Y121 E122 N300 | Y94-R118 HydrophobicContact CE1-CB 4.39Å; Y94-R118 HydrophobicContact CE2-CB 4.25Å; Y94-R118 PolarHBondContact OH-O 3.33Å; D97-R118 HydrophobicContact CB-CG 3.81Å; S98-R118 PolarHBondContact OG-NH1 3.45Å; F114-R118 WeakPolarHBondContact O-CG 3.47Å; F114-R118 PolarHBondContact O-N 2.67Å; F114-R118 VanDerWaalsContact O-N 3.09Å; D115-R118 VanDerWaalsContact CG-NH2 3.29Å; D115-R118 PolarHBondContact O-N 3.31Å; D115-R118 IonicContact OD1-CZ 2.89Å; D115-R118 IonicContact OD1-NE 3.17Å; D115-R118 IonicContact OD1-NH2 3.6Å; D115-R118 PolarHBondContact OD1-NH2 3.47Å; D115-R118 IonicContact OD2-NH2 2.94Å; R118-C120 PolarHBondContact O-N 2.86Å; R118-Y121 WeakPolarHBondContact O-CB 3.11Å; R118-Y121 PolarHBondContact O-N 3.41Å; R118-Y121 VanDerWaalsContact O-N 3.14Å; R118-E122 PolarHBondContact O-N 3.06Å; R118-N300 VanDerWaalsContact CZ-OD1 3.24Å; R118-N300 PolarHBondContact NH1-OD1 3.44Å; R118-N300 PolarHBondContact NH2-OD1 2.85Å |
| 119 | D | 80.8 | Confident | 80.4 | Confident | 58 Ų | 58 | 36.8 Ų | 36.8 | 31% | 0.31 | 17% | 0.174 | S | C | . | . | H | α-helix | trans | -60 | -47.9 | 178.5 | -89.8 | -20.9 | 0 | 0 | 0 | 112.9 | D115 V117 Y121 E122 A123 K187 | D115-D119 VanDerWaalsContact O-CB 3.29Å; D115-D119 WeakPolarHBondContact O-CB 3.46Å; D115-D119 PolarHBondContact O-N 3.45Å; V117-D119 VanDerWaalsContact C-N 3.27Å; V117-D119 PolarHBondContact O-N 2.78Å; D119-Y121 PolarHBondContact O-N 3.49Å; D119-E122 WeakPolarHBondContact O-CB 3.26Å; D119-E122 PolarHBondContact O-N 3.37Å; D119-A123 PolarHBondContact O-N 3.17Å; D119-K187 VanDerWaalsContact CA-CE 3.49Å; D119-K187 HydrophobicContact CB-CD 4.42Å; D119-K187 VanDerWaalsContact CB-CE 3.47Å; D119-K187 HydrophobicContact CB-CG 4.24Å; D119-K187 WeakPolarHBondContact O-CD 3.21Å; D119-K187 WeakPolarHBondContact O-CE 3.46Å; D119-K187 WeakPolarHBondContact O-CG 3.02Å; D119-K187 PolarHBondContact O-NZ 2.96Å; D119-K187 VanDerWaalsContact OD1-CE 3.22Å; D119-K187 WeakPolarHBondContact OD1-CE 3.03Å; D119-K187 IonicContact OD1-NZ 2.84Å; D119-K187 PolarHBondContact OD1-NZ 3.2Å; D119-K187 VanDerWaalsContact OD1-NZ 3.17Å |
| 120 | C | 84.1 | Confident | 81.6 | Confident | 49 Ų | 49 | 31.3 Ų | 31.3 | 33% | 0.331 | 15% | 0.149 | S | C | . | . | H | α-helix | trans | -61.4 | -37.7 | 176.4 | -68 | 0 | 0 | 0 | 0 | 111.6 | S116 V117 R118 A123 F124 | S116-C120 PolarHBondContact O-N 2.79Å; S116-C120 VanDerWaalsContact O-N 3.09Å; S116-C120 PolarHBondContact O-SG 3.3Å; V117-C120 PolarHBondContact O-N 2.91Å; R118-C120 PolarHBondContact O-N 2.86Å; C120-A123 PolarHBondContact O-N 3Å; C120-F124 PolarHBondContact O-N 2.71Å |
| 121 | Y | 87.1 | Confident | 82.5 | Confident | 38 Ų | 38 | 25.5 Ų | 25.5 | 15% | 0.149 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -68.7 | -37.6 | -179.9 | -157.4 | -90.9 | 0 | 0 | 0 | 112.8 | R86 F89 I90 V93 Y94 V117 R118 D119 A123 F124 V125 | R86-Y121 PolarHBondContact O-OH 3.08Å; F89-Y121 WeakPolarHBondContact CB-OH 3.4Å; I90-Y121 HydrophobicContact CB-CD1 4.2Å; I90-Y121 HydrophobicContact CB-CE1 3.82Å; I90-Y121 HydrophobicContact CG1-CD1 4.1Å; I90-Y121 HydrophobicContact CG1-CE1 4.24Å; V93-Y121 HydrophobicContact CB-CG 4.47Å; V93-Y121 HydrophobicContact CG1-CD2 4.4Å; V93-Y121 HydrophobicContact CG1-CG 4.11Å; V93-Y121 HydrophobicContact CG2-CD2 4.22Å; V93-Y121 HydrophobicContact CG2-CE2 4.15Å; V93-Y121 HydrophobicContact CG2-CG 4.48Å; Y94-Y121 HydrophobicContact CE2-CD1 4.34Å; V117-Y121 PolarHBondContact O-N 2.93Å; R118-Y121 WeakPolarHBondContact O-CB 3.11Å; R118-Y121 PolarHBondContact O-N 3.41Å; R118-Y121 VanDerWaalsContact O-N 3.14Å; D119-Y121 PolarHBondContact O-N 3.49Å; Y121-A123 VanDerWaalsContact C-N 3.3Å; Y121-A123 PolarHBondContact O-N 2.93Å; Y121-F124 HydrophobicContact CE2-CD1 4.04Å; Y121-F124 WeakPolarHBondContact O-CB 3.46Å; Y121-F124 PolarHBondContact O-N 3.22Å; Y121-F124 VanDerWaalsContact O-N 3.16Å; Y121-V125 HydrophobicContact CD1-CG2 3.56Å; Y121-V125 HydrophobicContact CE1-CG2 3.27Å; Y121-V125 WeakPolarHBondContact O-CG2 3.48Å; Y121-V125 PolarHBondContact O-N 3.4Å |
| 122 | E | 84.3 | Confident | 83.2 | Confident | 7 Ų | 7 | 24 Ų | 24 | 3% | 0.033 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -55.4 | -47.7 | 174.6 | -159.5 | -173.8 | 110.3 | 0 | 0 | 111.7 | Y94 R118 D119 F124 V125 I126 K187 Y221 I259 | Y94-E122 VanDerWaalsContact OH-CB 3.27Å; Y94-E122 WeakPolarHBondContact OH-CB 3.48Å; R118-E122 PolarHBondContact O-N 3.06Å; D119-E122 WeakPolarHBondContact O-CB 3.26Å; D119-E122 PolarHBondContact O-N 3.37Å; E122-F124 VanDerWaalsContact C-N 3.32Å; E122-F124 PolarHBondContact O-N 3.3Å; E122-V125 PolarHBondContact O-N 2.92Å; E122-I126 WeakPolarHBondContact O-CG1 3.4Å; E122-I126 PolarHBondContact O-N 3.44Å; E122-I126 VanDerWaalsContact O-N 3.09Å; E122-K187 VanDerWaalsContact CB-NZ 3.34Å; E122-K187 IonicContact OE1-NZ 3.32Å; E122-K187 PolarHBondContact OE1-NZ 2.97Å; E122-K187 IonicContact OE2-NZ 3.17Å; E122-K187 PolarHBondContact OE2-NZ 2.93Å; E122-Y221 PolarHBondContact OE1-OH 3.33Å; E122-I259 HydrophobicContact CG-CG1 4.36Å; E122-I259 HydrophobicContact CG-CG2 3.72Å |
| 123 | A | 86.5 | Confident | 83.8 | Confident | 2 Ų | 2 | 24 Ų | 24 | 2% | 0.017 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -58.3 | -48.2 | 177.1 | 0 | 0 | 0 | 0 | 0 | 110.6 | D119 C120 Y121 V125 I126 Y127 F183 C184 K187 | D119-A123 PolarHBondContact O-N 3.17Å; C120-A123 PolarHBondContact O-N 3Å; Y121-A123 VanDerWaalsContact C-N 3.3Å; Y121-A123 PolarHBondContact O-N 2.93Å; A123-V125 VanDerWaalsContact C-N 3.3Å; A123-V125 PolarHBondContact O-N 3.26Å; A123-I126 PolarHBondContact O-N 3.18Å; A123-Y127 PolarHBondContact O-N 3.21Å; A123-Y127 VanDerWaalsContact O-N 3.14Å; A123-F183 HydrophobicContact CB-CD1 4.01Å; A123-F183 HydrophobicContact CB-CE1 3.9Å; A123-C184 HydrophobicContact CB-CB 4.39Å; A123-C184 PolarHBondContact O-SG 2.94Å; A123-K187 HydrophobicContact CB-CB 3.97Å; A123-K187 HydrophobicContact CB-CD 4.01Å; A123-K187 HydrophobicContact CB-CG 4.4Å |
| 124 | F | 87 | Confident | 84.1 | Confident | 26 Ų | 26 | 18.6 Ų | 18.6 | 11% | 0.114 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -58 | -41.8 | 177.4 | -174.3 | -117 | 0 | 0 | 0 | 112.2 | R86 C120 Y121 E122 Y127 N128 P349 M352 | R86-F124 HydrophobicContact CB-CE1 4.03Å; R86-F124 HydrophobicContact CG-CE1 4.02Å; R86-F124 HydrophobicContact CG-CZ 4.14Å; C120-F124 PolarHBondContact O-N 2.71Å; Y121-F124 HydrophobicContact CE2-CD1 4.04Å; Y121-F124 WeakPolarHBondContact O-CB 3.46Å; Y121-F124 PolarHBondContact O-N 3.22Å; Y121-F124 VanDerWaalsContact O-N 3.16Å; E122-F124 VanDerWaalsContact C-N 3.32Å; E122-F124 PolarHBondContact O-N 3.3Å; F124-Y127 PolarHBondContact O-N 3.24Å; F124-N128 VanDerWaalsContact CD1-ND2 3.26Å; F124-N128 WeakPolarHBondContact CD1-ND2 3.02Å; F124-N128 WeakPolarHBondContact CD2-ND2 3.09Å; F124-N128 WeakPolarHBondContact CE1-ND2 3.44Å; F124-N128 VanDerWaalsContact CE2-ND2 3.28Å; F124-N128 WeakPolarHBondContact CE2-ND2 3.21Å; F124-N128 WeakPolarHBondContact CG-ND2 3.25Å; F124-N128 WeakPolarHBondContact CZ-ND2 3.2Å; F124-N128 PolarHBondContact O-N 2.88Å; F124-N128 PolarHBondContact O-ND2 2.8Å; F124-P349 HydrophobicContact CE2-CB 4.21Å; F124-M352 HydrophobicContact CD2-CE 4.44Å; F124-M352 HydrophobicContact CD2-SD 4.01Å |
| 125 | V | 86.3 | Confident | 84.4 | Confident | 1 Ų | 1 | 19.7 Ų | 19.7 | 1% | 0.006 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -65.6 | -43 | 179.7 | 172.4 | 0 | 0 | 0 | 0 | 111.9 | I87 I90 Y121 E122 A123 Y127 N128 F129 I255 I259 | I87-V125 HydrophobicContact CG1-CG1 4.4Å; I87-V125 HydrophobicContact CG2-CG1 4.31Å; I90-V125 HydrophobicContact CB-CG2 3.92Å; I90-V125 HydrophobicContact CD1-CB 4.38Å; I90-V125 HydrophobicContact CD1-CG1 4.18Å; I90-V125 HydrophobicContact CD1-CG2 4.05Å; I90-V125 HydrophobicContact CG1-CG2 4.13Å; Y121-V125 HydrophobicContact CD1-CG2 3.56Å; Y121-V125 HydrophobicContact CE1-CG2 3.27Å; Y121-V125 WeakPolarHBondContact O-CG2 3.48Å; Y121-V125 PolarHBondContact O-N 3.4Å; E122-V125 PolarHBondContact O-N 2.92Å; A123-V125 VanDerWaalsContact C-N 3.3Å; A123-V125 PolarHBondContact O-N 3.26Å; V125-Y127 VanDerWaalsContact C-N 3.3Å; V125-Y127 PolarHBondContact O-N 3.44Å; V125-N128 PolarHBondContact O-N 3.17Å; V125-F129 WeakPolarHBondContact O-CB 3.39Å; V125-F129 PolarHBondContact O-N 3.02Å; V125-I255 HydrophobicContact CG1-CG2 4.15Å; V125-I259 HydrophobicContact CG1-CD1 4.16Å |
| 126 | I | 85.9 | Confident | 84.5 | Confident | 2 Ų | 2 | 19.3 Ų | 19.3 | 1% | 0.01 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -60.6 | -43.2 | 177.6 | -62 | -178.4 | 0 | 0 | 0 | 110.4 | E122 A123 F129 L130 T180 F183 L229 I259 | E122-I126 WeakPolarHBondContact O-CG1 3.4Å; E122-I126 PolarHBondContact O-N 3.44Å; E122-I126 VanDerWaalsContact O-N 3.09Å; A123-I126 PolarHBondContact O-N 3.18Å; I126-F129 PolarHBondContact O-N 3.31Å; I126-L130 PolarHBondContact O-N 2.92Å; I126-T180 HydrophobicContact CG2-CG2 3.81Å; I126-F183 HydrophobicContact CD1-CD1 4.03Å; I126-F183 HydrophobicContact CD1-CE1 3.57Å; I126-F183 HydrophobicContact CD1-CZ 4.41Å; I126-L229 HydrophobicContact CD1-CD2 3.96Å; I126-L229 HydrophobicContact CD1-CG 4.5Å; I126-I259 HydrophobicContact CD1-CD1 4.44Å; I126-I259 HydrophobicContact CG1-CD1 3.78Å |
| 127 | Y | 88.3 | Confident | 84.3 | Confident | 1 Ų | 1 | 19.6 Ų | 19.6 | 0% | 0.004 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -60 | -51.7 | 174.4 | 166.1 | -96.7 | 0 | 0 | 0 | 112.3 | A123 F124 V125 F129 L130 S131 L181 C184 D351 M352 D355 | A123-Y127 PolarHBondContact O-N 3.21Å; A123-Y127 VanDerWaalsContact O-N 3.14Å; F124-Y127 PolarHBondContact O-N 3.24Å; V125-Y127 VanDerWaalsContact C-N 3.3Å; V125-Y127 PolarHBondContact O-N 3.44Å; Y127-F129 PolarHBondContact O-N 3.03Å; Y127-L130 PolarHBondContact O-N 2.87Å; Y127-L130 VanDerWaalsContact O-N 3.12Å; Y127-S131 WeakPolarHBondContact CE2-OG 3.36Å; Y127-S131 PolarHBondContact O-N 3.36Å; Y127-S131 PolarHBondContact O-OG 3.06Å; Y127-L181 HydrophobicContact CD2-CD2 3.74Å; Y127-L181 HydrophobicContact CD2-CG 4.41Å; Y127-L181 HydrophobicContact CE2-CD2 3.74Å; Y127-C184 VanDerWaalsContact CB-SG 3.52Å; Y127-D351 PolarHBondContact OH-O 3.47Å; Y127-M352 HydrophobicContact CD1-CB 3.97Å; Y127-M352 HydrophobicContact CD1-CG 3.82Å; Y127-M352 HydrophobicContact CD1-SD 4.07Å; Y127-M352 HydrophobicContact CD2-CG 4.1Å; Y127-M352 HydrophobicContact CE1-CB 3.52Å; Y127-M352 HydrophobicContact CE1-CG 3.81Å; Y127-M352 HydrophobicContact CE2-CB 4.38Å; Y127-M352 HydrophobicContact CE2-CG 4.08Å; Y127-M352 HydrophobicContact CG-CG 3.98Å; Y127-M352 HydrophobicContact CG-SD 4.2Å; Y127-M352 VanDerWaalsContact CZ-CA 3.5Å; Y127-M352 VanDerWaalsContact OH-CA 3.32Å; Y127-M352 WeakPolarHBondContact OH-CA 3.44Å; Y127-M352 PolarHBondContact OH-N 3.27Å; Y127-D355 HydrophobicContact CE2-CB 4.29Å; Y127-D355 PolarHBondContact OH-OD2 3.23Å |
| 128 | N | 87.6 | Confident | 84 | Confident | 0 Ų | 0 | 18.6 Ų | 18.6 | 0% | 0 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -62.1 | -33.1 | -179 | -74.1 | -70.7 | 0 | 0 | 0 | 112 | Y83 R86 I87 F124 V125 L132 | Y83-N128 HydrophobicContact CD1-CB 4.1Å; Y83-N128 VanDerWaalsContact CD1-OD1 3.24Å; Y83-N128 WeakPolarHBondContact CD1-OD1 3.44Å; R86-N128 HydrophobicContact CB-CB 4.38Å; R86-N128 WeakPolarHBondContact CD-OD1 3.32Å; R86-N128 PolarHBondContact NH1-OD1 3.34Å; I87-N128 HydrophobicContact CG1-CB 4.07Å; F124-N128 VanDerWaalsContact CD1-ND2 3.26Å; F124-N128 WeakPolarHBondContact CD1-ND2 3.02Å; F124-N128 WeakPolarHBondContact CD2-ND2 3.09Å; F124-N128 WeakPolarHBondContact CE1-ND2 3.44Å; F124-N128 VanDerWaalsContact CE2-ND2 3.28Å; F124-N128 WeakPolarHBondContact CE2-ND2 3.21Å; F124-N128 WeakPolarHBondContact CG-ND2 3.25Å; F124-N128 WeakPolarHBondContact CZ-ND2 3.2Å; F124-N128 PolarHBondContact O-N 2.88Å; F124-N128 PolarHBondContact O-ND2 2.8Å; V125-N128 PolarHBondContact O-N 3.17Å; N128-L132 VanDerWaalsContact O-CB 3.22Å; N128-L132 WeakPolarHBondContact O-CB 3.19Å; N128-L132 PolarHBondContact O-N 3.05Å |
| 129 | F | 85.6 | Confident | 83.8 | Confident | 12 Ų | 12 | 18.7 Ų | 18.7 | 5% | 0.053 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -68.7 | -41.7 | 175.1 | 179.2 | -106.1 | 0 | 0 | 0 | 112.8 | I87 V125 I126 Y127 S133 L232 F252 I255 | I87-F129 HydrophobicContact CD1-CB 4.04Å; I87-F129 HydrophobicContact CD1-CD2 4.22Å; V125-F129 WeakPolarHBondContact O-CB 3.39Å; V125-F129 PolarHBondContact O-N 3.02Å; I126-F129 PolarHBondContact O-N 3.31Å; Y127-F129 PolarHBondContact O-N 3.03Å; F129-S133 PolarHBondContact O-N 2.82Å; F129-S133 VanDerWaalsContact O-N 3.09Å; F129-S133 PolarHBondContact O-OG 3.43Å; F129-L232 HydrophobicContact CD1-CD1 3.67Å; F129-L232 HydrophobicContact CD1-CD2 3.74Å; F129-L232 HydrophobicContact CD1-CG 4.17Å; F129-L232 HydrophobicContact CE1-CD1 3.96Å; F129-L232 HydrophobicContact CE1-CD2 3.89Å; F129-L232 HydrophobicContact CE1-CG 4.17Å; F129-F252 AromaticContact CE1-CD2 3.33Å; F129-F252 HydrophobicContact CE1-CD2 3.33Å; F129-F252 AromaticContact CE1-CE2 3.78Å; F129-F252 HydrophobicContact CE1-CE2 3.78Å; F129-F252 HydrophobicContact CE1-CG 4.26Å; F129-F252 HydrophobicContact CZ-CB 3.88Å; F129-F252 AromaticContact CZ-CD2 3.43Å; F129-F252 HydrophobicContact CZ-CD2 3.43Å; F129-F252 VanDerWaalsContact CZ-CD2 3.43Å; F129-F252 HydrophobicContact CZ-CE2 4.33Å; F129-F252 HydrophobicContact CZ-CG 4.04Å; F129-I255 HydrophobicContact CB-CD1 4.42Å; F129-I255 HydrophobicContact CD2-CD1 3.18Å; F129-I255 HydrophobicContact CE2-CD1 3.6Å; F129-I255 HydrophobicContact CG-CD1 3.94Å |
| 130 | L | 85.4 | Confident | 83.4 | Confident | 0 Ų | 0 | 18.5 Ų | 18.5 | 0% | 0 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -60.9 | -51.1 | 172.5 | -179.5 | 67.2 | 0 | 0 | 0 | 110.4 | I126 Y127 L132 S133 F134 K177 T180 L232 F235 | I126-L130 PolarHBondContact O-N 2.92Å; Y127-L130 PolarHBondContact O-N 2.87Å; Y127-L130 VanDerWaalsContact O-N 3.12Å; L130-L132 VanDerWaalsContact C-N 3.34Å; L130-L132 PolarHBondContact O-N 2.99Å; L130-S133 WeakPolarHBondContact O-CA 3.16Å; L130-S133 WeakPolarHBondContact O-CB 3.16Å; L130-S133 PolarHBondContact O-N 3.43Å; L130-F134 HydrophobicContact CD1-CD2 4.11Å; L130-F134 HydrophobicContact CD1-CE2 3.68Å; L130-F134 HydrophobicContact CD2-CE2 4.13Å; L130-F134 HydrophobicContact CG-CD2 3.95Å; L130-F134 HydrophobicContact CG-CE2 3.71Å; L130-F134 WeakPolarHBondContact O-CD2 3.48Å; L130-F134 PolarHBondContact O-N 2.98Å; L130-K177 HydrophobicContact CD2-CB 4.31Å; L130-K177 HydrophobicContact CD2-CG 4.39Å; L130-T180 HydrophobicContact CB-CG2 4.39Å; L130-T180 HydrophobicContact CD2-CG2 4.09Å; L130-T180 WeakPolarHBondContact CD2-OG1 3.25Å; L130-L232 HydrophobicContact CB-CD1 3.9Å; L130-L232 HydrophobicContact CD1-CD1 3.91Å; L130-L232 HydrophobicContact CG-CD1 4.48Å; L130-F235 HydrophobicContact CD1-CB 4.32Å; L130-F235 HydrophobicContact CD1-CD1 3.96Å; L130-F235 HydrophobicContact CD1-CD2 4.28Å; L130-F235 HydrophobicContact CD1-CE1 4.4Å; L130-F235 HydrophobicContact CD1-CG 3.9Å |
| 131 | S | 86 | Confident | 82.8 | Confident | 7 Ų | 7 | 21.1 Ų | 21.1 | 5% | 0.049 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -60.5 | -40.9 | 179.9 | -59.9 | 0 | 0 | 0 | 0 | 112.6 | Y83 Y127 S133 F134 E135 | Y83-S131 VanDerWaalsContact CE1-CB 3.46Å; Y127-S131 WeakPolarHBondContact CE2-OG 3.36Å; Y127-S131 PolarHBondContact O-N 3.36Å; Y127-S131 PolarHBondContact O-OG 3.06Å; S131-S133 VanDerWaalsContact C-N 3.25Å; S131-S133 PolarHBondContact O-N 3.45Å; S131-F134 WeakPolarHBondContact O-CB 3.11Å; S131-F134 PolarHBondContact O-N 2.92Å; S131-F134 VanDerWaalsContact O-N 3.12Å; S131-E135 PolarHBondContact O-N 3.07Å |
| 132 | L | 85.5 | Confident | 82.1 | Confident | 0 Ų | 0 | 21 Ų | 21 | 0% | 0 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -58.2 | -40.3 | 172.9 | 178.8 | 59.7 | 0 | 0 | 0 | 111.9 | E80 Y83 I84 I87 N128 L130 F134 E135 Y136 F318 | E80-L132 HydrophobicContact CB-CD1 4.11Å; Y83-L132 HydrophobicContact CG-CB 4.33Å; I84-L132 HydrophobicContact CD1-CD1 4.32Å; I84-L132 HydrophobicContact CG1-CD1 3.92Å; I84-L132 HydrophobicContact CG1-CD2 3.66Å; I84-L132 HydrophobicContact CG1-CG 4.47Å; I87-L132 HydrophobicContact CD1-CD2 3.84Å; N128-L132 VanDerWaalsContact O-CB 3.22Å; N128-L132 WeakPolarHBondContact O-CB 3.19Å; N128-L132 PolarHBondContact O-N 3.05Å; L130-L132 VanDerWaalsContact C-N 3.34Å; L130-L132 PolarHBondContact O-N 2.99Å; L132-F134 VanDerWaalsContact C-N 3.31Å; L132-F134 PolarHBondContact O-N 3.47Å; L132-E135 PolarHBondContact O-N 3.32Å; L132-Y136 HydrophobicContact CD1-CD1 4.38Å; L132-Y136 HydrophobicContact CD1-CD2 4.28Å; L132-Y136 HydrophobicContact CD1-CE1 3.94Å; L132-Y136 HydrophobicContact CD1-CE2 3.82Å; L132-Y136 HydrophobicContact CD2-CE2 3.84Å; L132-Y136 HydrophobicContact CG-CD2 4Å; L132-Y136 HydrophobicContact CG-CE2 3.54Å; L132-Y136 PolarHBondContact O-N 2.92Å; L132-F318 HydrophobicContact CD2-CE1 3.83Å; L132-F318 HydrophobicContact CD2-CZ 4.37Å |
| 133 | S | 81.6 | Confident | 81.5 | Confident | 9 Ų | 9 | 20.6 Ų | 20.6 | 6% | 0.063 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -69.5 | -31 | 179.2 | -51 | 0 | 0 | 0 | 0 | 112.1 | F129 L130 S131 L137 F235 | F129-S133 PolarHBondContact O-N 2.82Å; F129-S133 VanDerWaalsContact O-N 3.09Å; F129-S133 PolarHBondContact O-OG 3.43Å; L130-S133 WeakPolarHBondContact O-CA 3.16Å; L130-S133 WeakPolarHBondContact O-CB 3.16Å; L130-S133 PolarHBondContact O-N 3.43Å; S131-S133 VanDerWaalsContact C-N 3.25Å; S131-S133 PolarHBondContact O-N 3.45Å; S133-L137 WeakPolarHBondContact O-CD1 3.48Å; S133-L137 WeakPolarHBondContact O-CG 3.26Å; S133-F235 VanDerWaalsContact CB-CE1 3.48Å |
| 134 | F | 82.7 | Confident | 80.7 | Confident | 8 Ų | 8 | 23 Ų | 23 | 4% | 0.035 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -65.6 | -45 | 169.4 | -85.4 | -85.9 | 0 | 0 | 0 | 111.8 | L130 S131 L132 L137 G139 E140 I143 L173 F235 | L130-F134 HydrophobicContact CD1-CD2 4.11Å; L130-F134 HydrophobicContact CD1-CE2 3.68Å; L130-F134 HydrophobicContact CD2-CE2 4.13Å; L130-F134 HydrophobicContact CG-CD2 3.95Å; L130-F134 HydrophobicContact CG-CE2 3.71Å; L130-F134 WeakPolarHBondContact O-CD2 3.48Å; L130-F134 PolarHBondContact O-N 2.98Å; S131-F134 WeakPolarHBondContact O-CB 3.11Å; S131-F134 PolarHBondContact O-N 2.92Å; S131-F134 VanDerWaalsContact O-N 3.12Å; L132-F134 VanDerWaalsContact C-N 3.31Å; L132-F134 PolarHBondContact O-N 3.47Å; F134-L137 PolarHBondContact O-N 3.39Å; F134-G139 WeakPolarHBondContact O-CA 3.4Å; F134-G139 PolarHBondContact O-N 3.49Å; F134-E140 HydrophobicContact CD1-CG 3.96Å; F134-E140 HydrophobicContact CE1-CG 4.08Å; F134-I143 HydrophobicContact CB-CD1 4.37Å; F134-I143 HydrophobicContact CD1-CD1 3.34Å; F134-I143 HydrophobicContact CE1-CD1 3.89Å; F134-I143 HydrophobicContact CG-CD1 4.13Å; F134-L173 HydrophobicContact CE1-CB 4.24Å; F134-L173 HydrophobicContact CE1-CD2 4Å; F134-L173 HydrophobicContact CE1-CG 4.49Å; F134-L173 HydrophobicContact CZ-CB 4.23Å; F134-L173 HydrophobicContact CZ-CD2 4.1Å; F134-F235 HydrophobicContact CD1-CE2 4.26Å; F134-F235 HydrophobicContact CD1-CZ 4.47Å; F134-F235 HydrophobicContact CD2-CE2 4.13Å; F134-F235 HydrophobicContact CD2-CZ 4.12Å; F134-F235 AromaticContact CE1-CE2 3.83Å; F134-F235 HydrophobicContact CE1-CE2 3.83Å; F134-F235 HydrophobicContact CE1-CZ 4.47Å; F134-F235 HydrophobicContact CE2-CD2 4.18Å; F134-F235 AromaticContact CE2-CE2 3.7Å; F134-F235 HydrophobicContact CE2-CE2 3.7Å; F134-F235 HydrophobicContact CE2-CZ 4.14Å; F134-F235 HydrophobicContact CG-CE2 4.38Å; F134-F235 HydrophobicContact CG-CZ 4.27Å; F134-F235 HydrophobicContact CZ-CD2 4.04Å; F134-F235 AromaticContact CZ-CE2 3.52Å; F134-F235 HydrophobicContact CZ-CE2 3.52Å; F134-F235 HydrophobicContact CZ-CZ 4.31Å |
| 135 | E | 84.8 | Confident | 79.9 | Confident | 62 Ų | 62 | 26 Ų | 26 | 29% | 0.29 | 17% | 0.169 | S | C | . | . | H | α-helix | trans | -65.4 | -41.4 | 179.5 | -70.8 | -56.9 | 131.4 | 0 | 0 | 112.7 | E80 Y83 S131 L132 L137 G138 | E80-E135 HydrophobicContact CG-CB 4.46Å; Y83-E135 HydrophobicContact CD2-CG 4.18Å; Y83-E135 HydrophobicContact CE2-CG 3.74Å; S131-E135 PolarHBondContact O-N 3.07Å; L132-E135 PolarHBondContact O-N 3.32Å; E135-L137 PolarHBondContact O-N 2.89Å; E135-G138 PolarHBondContact O-N 3.21Å |
| 136 | Y | 79.3 | Confident | 79.1 | Confident | 21 Ų | 21 | 30.8 Ų | 30.8 | 8% | 0.082 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -59 | -23.3 | 176.2 | -76.7 | -34.2 | 0 | 0 | 0 | 114 | E80 I84 L132 L243 | E80-Y136 HydrophobicContact CB-CE1 4.28Å; E80-Y136 HydrophobicContact CG-CD1 3.99Å; E80-Y136 HydrophobicContact CG-CE1 4.01Å; E80-Y136 WeakPolarHBondContact OE2-CE1 3.11Å; I84-Y136 WeakPolarHBondContact CD1-OH 2.95Å; L132-Y136 HydrophobicContact CD1-CD1 4.38Å; L132-Y136 HydrophobicContact CD1-CD2 4.28Å; L132-Y136 HydrophobicContact CD1-CE1 3.94Å; L132-Y136 HydrophobicContact CD1-CE2 3.82Å; L132-Y136 HydrophobicContact CD2-CE2 3.84Å; L132-Y136 HydrophobicContact CG-CD2 4Å; L132-Y136 HydrophobicContact CG-CE2 3.54Å; L132-Y136 PolarHBondContact O-N 2.92Å; Y136-L243 HydrophobicContact CD2-CD2 4.41Å |
| 137 | L | 76.8 | Confident | 78.2 | Confident | 22 Ų | 22 | 31 Ų | 31 | 12% | 0.115 | 19% | 0.192 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -93.3 | 3.7 | 178 | -65 | 168.3 | 0 | 0 | 0 | 113.1 | S133 F134 E135 A142 I143 F235 T239 L242 L243 | S133-L137 WeakPolarHBondContact O-CD1 3.48Å; S133-L137 WeakPolarHBondContact O-CG 3.26Å; F134-L137 PolarHBondContact O-N 3.39Å; E135-L137 PolarHBondContact O-N 2.89Å; L137-A142 WeakPolarHBondContact O-CB 3.1Å; L137-I143 HydrophobicContact CB-CD1 3.69Å; L137-I143 HydrophobicContact CB-CG1 3.3Å; L137-I143 HydrophobicContact CD1-CD1 3.7Å; L137-I143 HydrophobicContact CD1-CG1 3.72Å; L137-I143 HydrophobicContact CG-CD1 4.35Å; L137-I143 HydrophobicContact CG-CG1 4.12Å; L137-F235 HydrophobicContact CD1-CE1 4.37Å; L137-F235 HydrophobicContact CD1-CZ 3.81Å; L137-T239 HydrophobicContact CD1-CG2 3.56Å; L137-L242 HydrophobicContact CD2-CB 3.37Å; L137-L242 HydrophobicContact CD2-CD2 3.84Å; L137-L242 HydrophobicContact CD2-CG 4.29Å; L137-L243 HydrophobicContact CD1-CG 4.45Å; L137-L243 HydrophobicContact CD2-CD2 4.01Å; L137-L243 HydrophobicContact CD2-CG 3.88Å; L137-L243 HydrophobicContact CG-CD2 4.01Å; L137-L243 HydrophobicContact CG-CG 4.22Å |
| 138 | G | 74.6 | Confident | 76.9 | Confident | 55 Ų | 55 | 40.5 Ų | 40.5 | 57% | 0.567 | 23% | 0.228 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 82.8 | 21.5 | -177.3 | 0 | 0 | 0 | 0 | 0 | 114.2 | E135 A142 | E135-G138 PolarHBondContact O-N 3.21Å; G138-A142 WeakPolarHBondContact O-CB 3.34Å |
| 139 | G | 79.3 | Confident | 75.4 | Confident | 12 Ų | 12 | 43.7 Ų | 43.7 | 12% | 0.124 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | 84.4 | 178.7 | 176.3 | 0 | 0 | 0 | 0 | 0 | 114.8 | F134 S141 A142 I143 | F134-G139 WeakPolarHBondContact O-CA 3.4Å; F134-G139 PolarHBondContact O-N 3.49Å; G139-S141 VanDerWaalsContact C-N 3.27Å; G139-S141 PolarHBondContact O-N 3.25Å; G139-A142 PolarHBondContact O-N 3.02Å; G139-I143 WeakPolarHBondContact O-CD1 3.47Å; G139-I143 WeakPolarHBondContact O-CG1 3.4Å; G139-I143 PolarHBondContact O-N 3.41Å |
| 140 | E | 72.9 | Confident | 74.2 | Confident | 54 Ų | 54 | 47.4 Ų | 47.4 | 25% | 0.252 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -58 | -36.2 | -171.8 | -64.6 | -174 | -176.5 | 0 | 0 | 113.1 | F134 M144 K177 | F134-E140 HydrophobicContact CD1-CG 3.96Å; F134-E140 HydrophobicContact CE1-CG 4.08Å; E140-M144 VanDerWaalsContact O-CB 3.3Å; E140-M144 WeakPolarHBondContact O-CB 3.36Å; E140-M144 PolarHBondContact O-N 2.86Å; E140-K177 IonicContact OE1-NZ 2.9Å; E140-K177 PolarHBondContact OE1-NZ 2.93Å |
| 141 | S | 70.5 | Confident | 72.9 | Confident | 104 Ų | 104 | 52.4 Ų | 52.4 | 73% | 0.727 | 31% | 0.31 | S | S | * | . | H | α-helix | trans | -72.7 | -41.9 | -177.5 | -53.8 | 0 | 0 | 0 | 0 | 113.5 | G139 M144 S145 | G139-S141 VanDerWaalsContact C-N 3.27Å; G139-S141 PolarHBondContact O-N 3.25Å; S141-M144 PolarHBondContact O-N 2.9Å; S141-S145 PolarHBondContact O-N 3.04Å |
| 142 | A | 72.9 | Confident | 71.5 | Confident | 35 Ų | 35 | 53.2 Ų | 53.2 | 29% | 0.289 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -70.6 | -41.3 | -179.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | L137 G138 G139 M144 S145 E146 | L137-A142 WeakPolarHBondContact O-CB 3.1Å; G138-A142 WeakPolarHBondContact O-CB 3.34Å; G139-A142 PolarHBondContact O-N 3.02Å; A142-M144 VanDerWaalsContact C-N 3.3Å; A142-M144 PolarHBondContact O-N 3.09Å; A142-S145 PolarHBondContact O-N 3.33Å; A142-S145 PolarHBondContact O-OG 3.2Å; A142-E146 WeakPolarHBondContact O-CB 3.33Å; A142-E146 PolarHBondContact O-N 3.24Å |
| 143 | I | 72.5 | Confident | 69.9 | Low | 0 Ų | 0 | 60.2 Ų | 60.2 | 0% | 0 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -55.7 | -49.5 | 170.1 | -65.2 | 168.4 | 0 | 0 | 0 | 109.3 | F134 L137 G139 S145 E146 I147 L173 | F134-I143 HydrophobicContact CB-CD1 4.37Å; F134-I143 HydrophobicContact CD1-CD1 3.34Å; F134-I143 HydrophobicContact CE1-CD1 3.89Å; F134-I143 HydrophobicContact CG-CD1 4.13Å; L137-I143 HydrophobicContact CB-CD1 3.69Å; L137-I143 HydrophobicContact CB-CG1 3.3Å; L137-I143 HydrophobicContact CD1-CD1 3.7Å; L137-I143 HydrophobicContact CD1-CG1 3.72Å; L137-I143 HydrophobicContact CG-CD1 4.35Å; L137-I143 HydrophobicContact CG-CG1 4.12Å; G139-I143 WeakPolarHBondContact O-CD1 3.47Å; G139-I143 WeakPolarHBondContact O-CG1 3.4Å; G139-I143 PolarHBondContact O-N 3.41Å; I143-S145 VanDerWaalsContact C-N 3.31Å; I143-S145 PolarHBondContact O-N 3.12Å; I143-E146 PolarHBondContact O-N 2.98Å; I143-I147 HydrophobicContact CG2-CD1 3.34Å; I143-I147 HydrophobicContact CG2-CG1 4.12Å; I143-I147 WeakPolarHBondContact O-CB 3.4Å; I143-I147 VanDerWaalsContact O-CG1 3.25Å; I143-I147 WeakPolarHBondContact O-CG1 3.3Å; I143-I147 PolarHBondContact O-N 3.35Å; I143-L173 HydrophobicContact CB-CD1 4.35Å; I143-L173 HydrophobicContact CG2-CD1 3.55Å; I143-L173 HydrophobicContact CG2-CD2 3.89Å; I143-L173 HydrophobicContact CG2-CG 4.36Å |
| 144 | M | 69.4 | Low | 68.3 | Low | 51 Ų | 51 | 62.8 Ų | 62.8 | 25% | 0.251 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -60.3 | -39.5 | -179.4 | -174.2 | 65.3 | -170.3 | 0 | 0 | 112.2 | E140 S141 A142 R148 I170 | E140-M144 VanDerWaalsContact O-CB 3.3Å; E140-M144 WeakPolarHBondContact O-CB 3.36Å; E140-M144 PolarHBondContact O-N 2.86Å; S141-M144 PolarHBondContact O-N 2.9Å; A142-M144 VanDerWaalsContact C-N 3.3Å; A142-M144 PolarHBondContact O-N 3.09Å; M144-R148 WeakPolarHBondContact O-CB 3.29Å; M144-R148 PolarHBondContact O-N 2.94Å; M144-R148 VanDerWaalsContact O-N 3.17Å; M144-I170 HydrophobicContact CE-CB 4.48Å; M144-I170 HydrophobicContact SD-CB 4.21Å |
| 145 | S | 70.1 | Confident | 66.9 | Low | 90 Ų | 90 | 64.6 Ų | 64.6 | 63% | 0.629 | 38% | 0.378 | S | S | * | . | H | α-helix | trans | -68.1 | -38.4 | 177.2 | 55.6 | 0 | 0 | 0 | 0 | 113.4 | S141 A142 I143 | S141-S145 PolarHBondContact O-N 3.04Å; A142-S145 PolarHBondContact O-N 3.33Å; A142-S145 PolarHBondContact O-OG 3.2Å; I143-S145 VanDerWaalsContact C-N 3.31Å; I143-S145 PolarHBondContact O-N 3.12Å |
| 146 | E | 70.4 | Confident | 65 | Low | 101 Ų | 101 | 67 Ų | 67 | 47% | 0.472 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -82 | -24.6 | -174.6 | -173.3 | 54.3 | -138.9 | 0 | 0 | 112.9 | A142 I143 K150 L242 | A142-E146 WeakPolarHBondContact O-CB 3.33Å; A142-E146 PolarHBondContact O-N 3.24Å; I143-E146 PolarHBondContact O-N 2.98Å; E146-K150 IonicContact OE1-NZ 3.09Å; E146-K150 PolarHBondContact OE1-NZ 2.7Å; E146-K150 VanDerWaalsContact OE1-NZ 3.09Å; E146-L242 HydrophobicContact CB-CD2 3.86Å; E146-L242 HydrophobicContact CG-CD1 4.11Å; E146-L242 HydrophobicContact CG-CD2 3.39Å; E146-L242 HydrophobicContact CG-CG 3.73Å |
| 147 | I | 66.6 | Low | 63.4 | Low | 7 Ų | 7 | 73.8 Ų | 73.8 | 4% | 0.036 | 44% | 0.437 | C | S | . | . | H | α-helix | trans | -97.3 | -21.2 | -175.1 | -69.3 | -169.7 | 0 | 0 | 0 | 112.3 | I143 G149 K150 Y168 T239 L242 | I143-I147 HydrophobicContact CG2-CD1 3.34Å; I143-I147 HydrophobicContact CG2-CG1 4.12Å; I143-I147 WeakPolarHBondContact O-CB 3.4Å; I143-I147 VanDerWaalsContact O-CG1 3.25Å; I143-I147 WeakPolarHBondContact O-CG1 3.3Å; I143-I147 PolarHBondContact O-N 3.35Å; I147-G149 PolarHBondContact O-N 2.7Å; I147-K150 PolarHBondContact O-N 3.04Å; I147-Y168 HydrophobicContact CG2-CD1 4.18Å; I147-Y168 HydrophobicContact CG2-CD2 3.76Å; I147-Y168 HydrophobicContact CG2-CG 3.4Å; I147-Y168 VanDerWaalsContact CG2-CG 3.4Å; I147-T239 HydrophobicContact CD1-CG2 3.76Å; I147-L242 HydrophobicContact CG1-CD2 4.21Å |
| 148 | R | 61.4 | Low | 62.2 | Low | 201 Ų | 201 | 79 Ų | 79 | 76% | 0.758 | 46% | 0.456 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.9 | 106.1 | 178.7 | -171.2 | 177.6 | -168.1 | -156.4 | 2.8 | 110.9 | M144 | M144-R148 WeakPolarHBondContact O-CB 3.29Å; M144-R148 PolarHBondContact O-N 2.94Å; M144-R148 VanDerWaalsContact O-N 3.17Å |
| 149 | G | 55.7 | Low | 61.1 | Low | 67 Ų | 67 | 78.1 Ų | 78.1 | 69% | 0.691 | 45% | 0.446 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 115.8 | -9 | 173.4 | 0 | 0 | 0 | 0 | 0 | 115.4 | I147 | I147-G149 PolarHBondContact O-N 2.7Š|
| 150 | K | 60.5 | Low | 59.9 | Low | 89 Ų | 89 | 77.9 Ų | 77.9 | 39% | 0.387 | 44% | 0.443 | S | S | . | . | P | Polyproline II helix | trans | -81.9 | 123.9 | 171.9 | -68 | 177.2 | -174.3 | 158.8 | 0 | 109.5 | E146 I147 Y168 | E146-K150 IonicContact OE1-NZ 3.09Å; E146-K150 PolarHBondContact OE1-NZ 2.7Å; E146-K150 VanDerWaalsContact OE1-NZ 3.09Å; I147-K150 PolarHBondContact O-N 3.04Å; K150-Y168 HydrophobicContact CB-CD2 4.12Å; K150-Y168 HydrophobicContact CB-CE2 4.3Å; K150-Y168 VanDerWaalsContact O-CD2 3.23Å; K150-Y168 WeakPolarHBondContact O-CD2 3.08Å |
| 151 | P | 56.6 | Low | 58.9 | Low | 105 Ų | 105 | 78.8 Ų | 78.8 | 68% | 0.682 | 45% | 0.454 | S | S | * | . | B | Isolated β-bridge | trans | -71.2 | 143.7 | 174.5 | 28.3 | -32.6 | 0 | 0 | 0 | 110.6 | Q153 | P151-Q153 PolarHBondContact O-N 3.17Å |
| 152 | I | 58.4 | Low | 57.9 | Low | 24 Ų | 24 | 79.5 Ų | 79.5 | 12% | 0.123 | 46% | 0.458 | C | S | . | . | P | Polyproline II helix | trans | -64.2 | 120.5 | 171.9 | -61.9 | 174.3 | 0 | 0 | 0 | 107.9 | S154 M166 Y168 | I152-S154 PolarHBondContact O-N 3.22Å; I152-M166 HydrophobicContact CD1-CB 3.68Å; I152-M166 WeakPolarHBondContact CD1-O 3.27Å; I152-M166 WeakPolarHBondContact CG1-O 3.26Å; I152-Y168 HydrophobicContact CG1-CD1 4.05Å; I152-Y168 HydrophobicContact CG1-CD2 4.46Å; I152-Y168 HydrophobicContact CG1-CE1 3.85Å; I152-Y168 HydrophobicContact CG1-CE2 4.34Å; I152-Y168 HydrophobicContact CG1-CG 4.3Å |
| 153 | Q | 51.6 | Low | 56.8 | Low | 148 Ų | 148 | 79.4 Ų | 79.4 | 69% | 0.692 | 45% | 0.452 | S | S | * | . | trans | -68.6 | 99.5 | 167.9 | -67.6 | -115.8 | -35.6 | 0 | 0 | 107.4 | P151 | P151-Q153 PolarHBondContact O-N 3.17Š| ||
| 154 | S | 47.5 | Very low | 55.3 | Low | 63 Ų | 63 | 84 Ų | 84 | 44% | 0.441 | 48% | 0.48 | S | S | . | . | trans | -72 | 136.9 | 178.9 | 57.1 | 0 | 0 | 0 | 0 | 109.7 | I152 | I152-S154 PolarHBondContact O-N 3.22Š| ||
| 155 | S | 53.1 | Low | 54.3 | Low | 46 Ų | 46 | 85.3 Ų | 85.3 | 32% | 0.322 | 51% | 0.507 | S | S | . | . | trans | -145.1 | 115.6 | 176.5 | -79.9 | 0 | 0 | 0 | 0 | 109.5 | L157 Y158 T160 | S155-L157 PolarHBondContact O-N 3.4Å; S155-Y158 VanDerWaalsContact CB-CD2 3.47Å; S155-Y158 PolarHBondContact O-N 2.94Å; S155-T160 PolarHBondContact N-OG1 2.89Å; S155-T160 PolarHBondContact O-OG1 2.94Å | ||
| 156 | C | 45.4 | Very low | 53.4 | Low | 111 Ų | 111 | 85.6 Ų | 85.6 | 75% | 0.75 | 50% | 0.499 | S | S | * | . | G | 310 helix | trans | -57 | -32.6 | -177 | -169.6 | 0 | 0 | 0 | 0 | 112.7 | Y158 | C156-Y158 PolarHBondContact O-N 3.46Š|
| 157 | L | 46.2 | Very low | 52.6 | Low | 164 Ų | 164 | 84.3 Ų | 84.3 | 86% | 0.859 | 50% | 0.502 | S | S | * | . | G | 310 helix | trans | -63.9 | -21 | 176.7 | -107.1 | 151.9 | 0 | 0 | 0 | 114.4 | S155 | S155-L157 PolarHBondContact O-N 3.4Š|
| 158 | Y | 50.6 | Low | 52.4 | Low | 132 Ų | 132 | 85.2 Ų | 85.2 | 52% | 0.518 | 51% | 0.505 | S | S | . | . | G | 310 helix | trans | -110.1 | 14.1 | -173.8 | -61.2 | -68.1 | 0 | 0 | 0 | 113.6 | S155 C156 T160 F233 | S155-Y158 VanDerWaalsContact CB-CD2 3.47Å; S155-Y158 PolarHBondContact O-N 2.94Å; C156-Y158 PolarHBondContact O-N 3.46Å; Y158-T160 PolarHBondContact O-N 3.19Å; Y158-F233 HydrophobicContact CD1-CE1 4.48Å; Y158-F233 HydrophobicContact CD1-CZ 4.19Å |
| 159 | G | 51.4 | Low | 52.6 | Low | 36 Ų | 36 | 77.9 Ų | 77.9 | 37% | 0.371 | 48% | 0.484 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 72.8 | 2.8 | 178.4 | 0 | 0 | 0 | 0 | 0 | 114.8 | C161 Y230 | G159-C161 PolarHBondContact O-N 2.84Å; G159-Y230 PolarHBondContact O-OH 3.17Å; G159-Y230 VanDerWaalsContact O-OH 3.08Å |
| 160 | T | 54.8 | Low | 53.3 | Low | 8 Ų | 8 | 77.4 Ų | 77.4 | 5% | 0.049 | 47% | 0.465 | C | S | . | . | G | 310 helix | trans | -78.4 | 10.4 | 175.9 | 39.4 | 0 | 0 | 0 | 0 | 113.7 | S155 Y158 C162 L163 V164 L234 | S155-T160 PolarHBondContact N-OG1 2.89Å; S155-T160 PolarHBondContact O-OG1 2.94Å; Y158-T160 PolarHBondContact O-N 3.19Å; T160-C162 PolarHBondContact O-N 2.7Å; T160-L163 HydrophobicContact CG2-CB 4.46Å; T160-L163 HydrophobicContact CG2-CD1 4.07Å; T160-L163 PolarHBondContact O-N 2.73Å; T160-V164 PolarHBondContact O-N 2.93Å; T160-L234 HydrophobicContact CG2-CD2 3.47Å; T160-L234 VanDerWaalsContact CG2-CD2 3.47Å |
| 161 | C | 52 | Low | 53.8 | Low | 73 Ų | 73 | 75 Ų | 75 | 49% | 0.493 | 47% | 0.466 | S | S | . | . | G | 310 helix | trans | -61.4 | -29.8 | 176.6 | 68.2 | 0 | 0 | 0 | 0 | 112.5 | G159 L163 V164 | G159-C161 PolarHBondContact O-N 2.84Å; C161-L163 VanDerWaalsContact C-N 3.31Å; C161-V164 VanDerWaalsContact O-CG2 3.31Å; C161-V164 WeakPolarHBondContact O-CG2 3.26Å |
| 162 | C | 47.9 | Very low | 54.8 | Low | 119 Ų | 119 | 70.5 Ų | 70.5 | 80% | 0.804 | 44% | 0.436 | S | S | * | . | G | 310 helix | trans | -81.3 | -6 | 174.2 | -58.1 | 0 | 0 | 0 | 0 | 113.8 | T160 | T160-C162 PolarHBondContact O-N 2.7Š|
| 163 | L | 50.4 | Low | 55.8 | Low | 32 Ų | 32 | 69.9 Ų | 69.9 | 17% | 0.168 | 43% | 0.432 | C | S | . | . | G | 310 helix | trans | -110.9 | 11 | -177.8 | -77.4 | 143.7 | 0 | 0 | 0 | 112.5 | T160 C161 G165 M166 Y230 L234 | T160-L163 HydrophobicContact CG2-CB 4.46Å; T160-L163 HydrophobicContact CG2-CD1 4.07Å; T160-L163 PolarHBondContact O-N 2.73Å; C161-L163 VanDerWaalsContact C-N 3.31Å; L163-G165 PolarHBondContact O-N 2.74Å; L163-M166 HydrophobicContact CD2-CG 4.42Å; L163-M166 PolarHBondContact O-N 3.31Å; L163-Y230 WeakPolarHBondContact CD1-OH 3.5Å; L163-L234 HydrophobicContact CD1-CD1 3.83Å; L163-L234 HydrophobicContact CD1-CD2 4.12Å |
| 164 | V | 42.4 | Very low | 57.1 | Low | 96 Ų | 96 | 65.4 Ų | 65.4 | 58% | 0.582 | 41% | 0.409 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.4 | 117.7 | 175.6 | 173.2 | 0 | 0 | 0 | 0 | 109.6 | T160 C161 | T160-V164 PolarHBondContact O-N 2.93Å; C161-V164 VanDerWaalsContact O-CG2 3.31Å; C161-V164 WeakPolarHBondContact O-CG2 3.26Å |
| 165 | G | 47.3 | Very low | 58.9 | Low | 79 Ų | 79 | 66.4 Ų | 66.4 | 81% | 0.814 | 41% | 0.406 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 96.7 | -1.1 | 174.9 | 0 | 0 | 0 | 0 | 0 | 115.9 | L163 | L163-G165 PolarHBondContact O-N 2.74Š|
| 166 | M | 51.3 | Low | 60.4 | Low | 97 Ų | 97 | 64.2 Ų | 64.2 | 48% | 0.478 | 39% | 0.39 | S | S | . | . | trans | -75.9 | 127.2 | 169.4 | -69.3 | -82.3 | -76.3 | 0 | 0 | 109 | I152 L163 | I152-M166 HydrophobicContact CD1-CB 3.68Å; I152-M166 WeakPolarHBondContact CD1-O 3.27Å; I152-M166 WeakPolarHBondContact CG1-O 3.26Å; L163-M166 HydrophobicContact CD2-CG 4.42Å; L163-M166 PolarHBondContact O-N 3.31Å | ||
| 167 | S | 54.1 | Low | 62.3 | Low | 74 Ų | 74 | 59.6 Ų | 59.6 | 52% | 0.517 | 36% | 0.357 | S | S | . | . | B | Isolated β-bridge | trans | -75.3 | 146.9 | 162.4 | 50.3 | 0 | 0 | 0 | 0 | 108.2 | S169 | S167-S169 PolarHBondContact O-N 3.13Å |
| 168 | Y | 61.8 | Low | 64.2 | Low | 26 Ų | 26 | 55 Ų | 55 | 10% | 0.102 | 33% | 0.331 | C | S | . | . | S | Bend | trans | -60.6 | 111.3 | 169.8 | -66.8 | -68 | 0 | 0 | 0 | 109 | I147 K150 I152 F172 A238 | I147-Y168 HydrophobicContact CG2-CD1 4.18Å; I147-Y168 HydrophobicContact CG2-CD2 3.76Å; I147-Y168 HydrophobicContact CG2-CG 3.4Å; I147-Y168 VanDerWaalsContact CG2-CG 3.4Å; K150-Y168 HydrophobicContact CB-CD2 4.12Å; K150-Y168 HydrophobicContact CB-CE2 4.3Å; K150-Y168 VanDerWaalsContact O-CD2 3.23Å; K150-Y168 WeakPolarHBondContact O-CD2 3.08Å; I152-Y168 HydrophobicContact CG1-CD1 4.05Å; I152-Y168 HydrophobicContact CG1-CD2 4.46Å; I152-Y168 HydrophobicContact CG1-CE1 3.85Å; I152-Y168 HydrophobicContact CG1-CE2 4.34Å; I152-Y168 HydrophobicContact CG1-CG 4.3Å; Y168-F172 HydrophobicContact CD1-CD1 4.17Å; Y168-F172 HydrophobicContact CD1-CE1 4.18Å; Y168-F172 HydrophobicContact CE1-CE1 4.4Å; Y168-A238 HydrophobicContact CD1-CB 3.8Å; Y168-A238 HydrophobicContact CE1-CB 3.12Å; Y168-A238 WeakPolarHBondContact OH-CA 2.9Å |
| 169 | S | 65.1 | Low | 65.9 | Low | 47 Ų | 47 | 49 Ų | 49 | 33% | 0.329 | 31% | 0.309 | S | S | . | . | trans | -129.5 | 162.2 | -170.7 | 177.7 | 0 | 0 | 0 | 0 | 109.5 | S167 G171 F172 L173 | S167-S169 PolarHBondContact O-N 3.13Å; S169-G171 PolarHBondContact O-N 3.25Å; S169-F172 WeakPolarHBondContact O-CB 2.9Å; S169-F172 PolarHBondContact O-N 3.46Å; S169-L173 PolarHBondContact O-N 2.73Å | ||
| 170 | I | 70.1 | Confident | 67.6 | Low | 56 Ų | 56 | 47.2 Ų | 47.2 | 29% | 0.287 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -50.2 | -32.4 | 174.3 | -167.8 | 69.8 | 0 | 0 | 0 | 112.1 | M144 F172 R174 | M144-I170 HydrophobicContact CE-CB 4.48Å; M144-I170 HydrophobicContact SD-CB 4.21Å; I170-F172 VanDerWaalsContact C-N 3.34Å; I170-F172 PolarHBondContact O-N 2.98Å; I170-R174 WeakPolarHBondContact O-CB 3.24Å; I170-R174 WeakPolarHBondContact O-CG 3.37Å; I170-R174 PolarHBondContact O-N 2.93Å |
| 171 | G | 72.1 | Confident | 69.1 | Low | 39 Ų | 39 | 47.2 Ų | 47.2 | 40% | 0.402 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -64.7 | -33.7 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.9 | S169 F175 | S169-G171 PolarHBondContact O-N 3.25Å; G171-F175 WeakPolarHBondContact O-CB 3.36Å; G171-F175 PolarHBondContact O-N 3.28Å |
| 172 | F | 77.6 | Confident | 71 | Confident | 11 Ų | 11 | 46.4 Ų | 46.4 | 5% | 0.048 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -70.6 | -46.5 | 178.2 | 170.6 | -97.2 | 0 | 0 | 0 | 111.8 | Y168 S169 I170 R174 F175 C176 L234 A238 | Y168-F172 HydrophobicContact CD1-CD1 4.17Å; Y168-F172 HydrophobicContact CD1-CE1 4.18Å; Y168-F172 HydrophobicContact CE1-CE1 4.4Å; S169-F172 WeakPolarHBondContact O-CB 2.9Å; S169-F172 PolarHBondContact O-N 3.46Å; I170-F172 VanDerWaalsContact C-N 3.34Å; I170-F172 PolarHBondContact O-N 2.98Å; F172-R174 VanDerWaalsContact C-N 3.29Å; F172-R174 PolarHBondContact O-N 3.22Å; F172-F175 WeakPolarHBondContact O-CB 3.14Å; F172-F175 PolarHBondContact O-N 3.42Å; F172-C176 PolarHBondContact O-N 3.33Å; F172-C176 PolarHBondContact O-SG 3.4Å; F172-L234 HydrophobicContact CE2-CB 3.91Å; F172-L234 HydrophobicContact CE2-CD1 4.3Å; F172-L234 HydrophobicContact CZ-CB 3.83Å; F172-A238 HydrophobicContact CE1-CB 3.72Å; F172-A238 HydrophobicContact CZ-CB 4.05Å |
| 173 | L | 78.8 | Confident | 73 | Confident | 10 Ų | 10 | 40.8 Ų | 40.8 | 5% | 0.052 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -61.5 | -41.6 | 176 | -65.7 | 173.5 | 0 | 0 | 0 | 111 | F134 I143 S169 C176 K177 F235 | F134-L173 HydrophobicContact CE1-CB 4.24Å; F134-L173 HydrophobicContact CE1-CD2 4Å; F134-L173 HydrophobicContact CE1-CG 4.49Å; F134-L173 HydrophobicContact CZ-CB 4.23Å; F134-L173 HydrophobicContact CZ-CD2 4.1Å; I143-L173 HydrophobicContact CB-CD1 4.35Å; I143-L173 HydrophobicContact CG2-CD1 3.55Å; I143-L173 HydrophobicContact CG2-CD2 3.89Å; I143-L173 HydrophobicContact CG2-CG 4.36Å; S169-L173 PolarHBondContact O-N 2.73Å; L173-C176 PolarHBondContact O-N 3.23Å; L173-K177 PolarHBondContact O-N 2.66Å; L173-F235 HydrophobicContact CD2-CD2 3.79Å; L173-F235 HydrophobicContact CD2-CE2 3.64Å |
| 174 | R | 80.1 | Confident | 74.7 | Confident | 55 Ų | 55 | 39.9 Ų | 39.9 | 21% | 0.208 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -62.8 | -44.2 | 173.6 | -77 | -174.1 | -171.2 | 169.2 | 11.3 | 112.7 | I170 F172 C176 K177 Q178 Y364 | I170-R174 WeakPolarHBondContact O-CB 3.24Å; I170-R174 WeakPolarHBondContact O-CG 3.37Å; I170-R174 PolarHBondContact O-N 2.93Å; F172-R174 VanDerWaalsContact C-N 3.29Å; F172-R174 PolarHBondContact O-N 3.22Å; R174-C176 VanDerWaalsContact C-N 3.26Å; R174-C176 PolarHBondContact O-N 2.89Å; R174-K177 PolarHBondContact O-N 3.48Å; R174-Q178 VanDerWaalsContact O-CB 3.25Å; R174-Q178 WeakPolarHBondContact O-CB 3.31Å; R174-Q178 VanDerWaalsContact O-CG 3.24Å; R174-Q178 WeakPolarHBondContact O-CG 3.48Å; R174-Q178 PolarHBondContact O-N 3.38Å; R174-Y364 VanDerWaalsContact NH2-CD1 3.33Å |
| 175 | F | 84.4 | Confident | 76.9 | Confident | 84 Ų | 84 | 37.8 Ų | 37.8 | 37% | 0.368 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -57 | -43.4 | 175.5 | 172.7 | -97.5 | 0 | 0 | 0 | 111 | G171 F172 K177 Q178 A179 L227 A231 | G171-F175 WeakPolarHBondContact O-CB 3.36Å; G171-F175 PolarHBondContact O-N 3.28Å; F172-F175 WeakPolarHBondContact O-CB 3.14Å; F172-F175 PolarHBondContact O-N 3.42Å; F175-K177 PolarHBondContact O-N 2.87Å; F175-Q178 PolarHBondContact O-N 3.46Å; F175-A179 VanDerWaalsContact O-CB 3.28Å; F175-A179 WeakPolarHBondContact O-CB 3.23Å; F175-A179 PolarHBondContact O-N 3.36Å; F175-L227 HydrophobicContact CZ-CD1 4.18Å; F175-A231 HydrophobicContact CE1-CB 4.19Å |
| 176 | C | 84.1 | Confident | 78.9 | Confident | 0 Ų | 0 | 35.3 Ų | 35.3 | 0% | 0 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -62 | -44.6 | 177.7 | -61.5 | 0 | 0 | 0 | 0 | 112.7 | F172 L173 R174 T180 A231 F235 | F172-C176 PolarHBondContact O-N 3.33Å; F172-C176 PolarHBondContact O-SG 3.4Å; L173-C176 PolarHBondContact O-N 3.23Å; R174-C176 VanDerWaalsContact C-N 3.26Å; R174-C176 PolarHBondContact O-N 2.89Å; C176-T180 WeakPolarHBondContact O-CB 3.37Å; C176-T180 PolarHBondContact O-N 2.93Å; C176-T180 VanDerWaalsContact O-N 3.17Å; C176-T180 PolarHBondContact O-OG1 3.32Å; C176-A231 HydrophobicContact CB-CB 4.49Å; C176-A231 PolarHBondContact SG-O 3Å; C176-F235 HydrophobicContact CB-CB 4.22Å |
| 177 | K | 85.1 | Confident | 80.5 | Confident | 13 Ų | 13 | 31 Ų | 31 | 6% | 0.057 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -69.3 | -41.8 | 178.2 | -157.8 | 167.3 | 158.2 | 172.7 | 0 | 111.7 | L130 E140 L173 R174 F175 T180 L181 D355 N359 | L130-K177 HydrophobicContact CD2-CB 4.31Å; L130-K177 HydrophobicContact CD2-CG 4.39Å; E140-K177 IonicContact OE1-NZ 2.9Å; E140-K177 PolarHBondContact OE1-NZ 2.93Å; L173-K177 PolarHBondContact O-N 2.66Å; R174-K177 PolarHBondContact O-N 3.48Å; F175-K177 PolarHBondContact O-N 2.87Å; K177-T180 PolarHBondContact O-N 3.42Å; K177-L181 HydrophobicContact CG-CD1 4.06Å; K177-L181 VanDerWaalsContact O-CB 3.32Å; K177-L181 WeakPolarHBondContact O-CB 3.44Å; K177-L181 WeakPolarHBondContact O-CD1 3.23Å; K177-L181 WeakPolarHBondContact O-CG 3.1Å; K177-L181 PolarHBondContact O-N 3.37Å; K177-D355 WeakPolarHBondContact CE-OD1 3.33Å; K177-D355 WeakPolarHBondContact CE-OD2 3.45Å; K177-D355 IonicContact NZ-OD1 3.78Å; K177-D355 PolarHBondContact NZ-OD1 2.9Å; K177-D355 IonicContact NZ-OD2 2.61Å; K177-D355 PolarHBondContact NZ-OD2 3.49Å; K177-N359 WeakPolarHBondContact CB-ND2 3.42Å; K177-N359 WeakPolarHBondContact CD-ND2 3.29Å; K177-N359 WeakPolarHBondContact CE-ND2 3.49Å; K177-N359 WeakPolarHBondContact CG-ND2 3.22Å |
| 178 | Q | 85.9 | Confident | 82.1 | Confident | 67 Ų | 67 | 29.9 Ų | 29.9 | 31% | 0.313 | 17% | 0.17 | S | C | . | . | H | α-helix | trans | -64.2 | -44.3 | 176.4 | -75.8 | 176 | -15.2 | 0 | 0 | 112.5 | R174 F175 T180 L181 Q182 N359 F360 | R174-Q178 VanDerWaalsContact O-CB 3.25Å; R174-Q178 WeakPolarHBondContact O-CB 3.31Å; R174-Q178 VanDerWaalsContact O-CG 3.24Å; R174-Q178 WeakPolarHBondContact O-CG 3.48Å; R174-Q178 PolarHBondContact O-N 3.38Å; F175-Q178 PolarHBondContact O-N 3.46Å; Q178-T180 VanDerWaalsContact C-N 3.33Å; Q178-T180 PolarHBondContact O-N 2.91Å; Q178-L181 PolarHBondContact O-N 3Å; Q178-Q182 WeakPolarHBondContact O-CB 3.35Å; Q178-Q182 PolarHBondContact O-N 3.41Å; Q178-N359 HydrophobicContact CG-CB 4.23Å; Q178-N359 PolarHBondContact NE2-O 2.85Å; Q178-F360 HydrophobicContact CB-CE1 4.47Å; Q178-F360 HydrophobicContact CB-CZ 4.24Å; Q178-F360 HydrophobicContact CG-CE1 4.31Å; Q178-F360 HydrophobicContact CG-CZ 4.32Å |
| 179 | A | 87.7 | Confident | 83.4 | Confident | 6 Ų | 6 | 33.1 Ų | 33.1 | 5% | 0.05 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -61.7 | -42.4 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | F175 Q182 F183 L227 A231 | F175-A179 VanDerWaalsContact O-CB 3.28Å; F175-A179 WeakPolarHBondContact O-CB 3.23Å; F175-A179 PolarHBondContact O-N 3.36Å; A179-Q182 PolarHBondContact O-N 2.88Å; A179-Q182 PolarHBondContact O-OE1 3.26Å; A179-F183 PolarHBondContact O-N 3.29Å; A179-F183 VanDerWaalsContact O-N 3.14Å; A179-L227 HydrophobicContact CB-CG 4.27Å; A179-A231 HydrophobicContact CB-CB 3.58Å |
| 180 | T | 87 | Confident | 84.4 | Confident | 0 Ų | 0 | 32.2 Ų | 32.2 | 0% | 0 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -69.3 | -42.8 | 178.5 | -56.7 | 0 | 0 | 0 | 0 | 112.1 | I126 L130 C176 K177 Q178 Q182 F183 C184 | I126-T180 HydrophobicContact CG2-CG2 3.81Å; L130-T180 HydrophobicContact CB-CG2 4.39Å; L130-T180 HydrophobicContact CD2-CG2 4.09Å; L130-T180 WeakPolarHBondContact CD2-OG1 3.25Å; C176-T180 WeakPolarHBondContact O-CB 3.37Å; C176-T180 PolarHBondContact O-N 2.93Å; C176-T180 VanDerWaalsContact O-N 3.17Å; C176-T180 PolarHBondContact O-OG1 3.32Å; K177-T180 PolarHBondContact O-N 3.42Å; Q178-T180 VanDerWaalsContact C-N 3.33Å; Q178-T180 PolarHBondContact O-N 2.91Å; T180-Q182 VanDerWaalsContact C-N 3.32Å; T180-Q182 PolarHBondContact O-N 3.02Å; T180-F183 PolarHBondContact O-N 3.28Å; T180-C184 PolarHBondContact O-N 2.93Å; T180-C184 VanDerWaalsContact O-N 3.07Å; T180-C184 PolarHBondContact O-SG 3.16Å |
| 181 | L | 86.6 | Confident | 85.1 | Confident | 7 Ų | 7 | 30 Ų | 30 | 4% | 0.037 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -65.7 | -35.4 | 175.3 | -73.1 | 165.4 | 0 | 0 | 0 | 112.1 | Y127 K177 Q178 F183 C184 A185 M352 A356 N359 F360 | Y127-L181 HydrophobicContact CD2-CD2 3.74Å; Y127-L181 HydrophobicContact CD2-CG 4.41Å; Y127-L181 HydrophobicContact CE2-CD2 3.74Å; K177-L181 HydrophobicContact CG-CD1 4.06Å; K177-L181 VanDerWaalsContact O-CB 3.32Å; K177-L181 WeakPolarHBondContact O-CB 3.44Å; K177-L181 WeakPolarHBondContact O-CD1 3.23Å; K177-L181 WeakPolarHBondContact O-CG 3.1Å; K177-L181 PolarHBondContact O-N 3.37Å; Q178-L181 PolarHBondContact O-N 3Å; L181-F183 VanDerWaalsContact C-N 3.34Å; L181-C184 WeakPolarHBondContact O-CB 3.36Å; L181-C184 PolarHBondContact O-N 3.04Å; L181-A185 PolarHBondContact O-N 3.3Å; L181-M352 HydrophobicContact CD2-CG 4.11Å; L181-A356 HydrophobicContact CD2-CB 4.25Å; L181-N359 HydrophobicContact CD1-CB 4.14Å; L181-F360 HydrophobicContact CB-CE2 3.77Å; L181-F360 HydrophobicContact CB-CZ 4.4Å; L181-F360 HydrophobicContact CD1-CE2 4.3Å |
| 182 | Q | 91.3 | Very high | 85.8 | Confident | 56 Ų | 56 | 30.4 Ų | 30.4 | 26% | 0.262 | 17% | 0.168 | S | C | . | . | H | α-helix | trans | -60.4 | -44.6 | 173.8 | 173.7 | -84.9 | -23.9 | 0 | 0 | 110.6 | Q178 A179 T180 C184 A185 V186 S224 | Q178-Q182 WeakPolarHBondContact O-CB 3.35Å; Q178-Q182 PolarHBondContact O-N 3.41Å; A179-Q182 PolarHBondContact O-N 2.88Å; A179-Q182 PolarHBondContact O-OE1 3.26Å; T180-Q182 VanDerWaalsContact C-N 3.32Å; T180-Q182 PolarHBondContact O-N 3.02Å; Q182-C184 VanDerWaalsContact C-N 3.34Å; Q182-C184 PolarHBondContact O-N 3.04Å; Q182-A185 PolarHBondContact O-N 3.19Å; Q182-V186 HydrophobicContact CG-CG2 4.3Å; Q182-V186 VanDerWaalsContact NE2-CG2 3.26Å; Q182-V186 WeakPolarHBondContact O-CB 3.47Å; Q182-V186 WeakPolarHBondContact O-CG2 3.13Å; Q182-V186 PolarHBondContact O-N 3.08Å; Q182-S224 PolarHBondContact NE2-OG 3.38Å; Q182-S224 PolarHBondContact OE1-OG 3.37Å |
| 183 | F | 88.9 | Confident | 86.3 | Confident | 1 Ų | 1 | 32.8 Ų | 32.8 | 0% | 0.004 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -61.7 | -41.7 | 174.3 | 178.4 | -111.3 | 0 | 0 | 0 | 112.3 | A123 I126 A179 T180 L181 A185 V186 K187 Y221 V225 A228 | A123-F183 HydrophobicContact CB-CD1 4.01Å; A123-F183 HydrophobicContact CB-CE1 3.9Å; I126-F183 HydrophobicContact CD1-CD1 4.03Å; I126-F183 HydrophobicContact CD1-CE1 3.57Å; I126-F183 HydrophobicContact CD1-CZ 4.41Å; A179-F183 PolarHBondContact O-N 3.29Å; A179-F183 VanDerWaalsContact O-N 3.14Å; T180-F183 PolarHBondContact O-N 3.28Å; L181-F183 VanDerWaalsContact C-N 3.34Å; F183-A185 VanDerWaalsContact C-N 3.26Å; F183-A185 PolarHBondContact O-N 3.12Å; F183-V186 PolarHBondContact O-N 3.49Å; F183-K187 HydrophobicContact CE1-CD 4.01Å; F183-K187 HydrophobicContact CE2-CD 3.86Å; F183-K187 HydrophobicContact CZ-CD 3.44Å; F183-K187 VanDerWaalsContact CZ-CD 3.44Å; F183-K187 WeakPolarHBondContact O-CB 3.5Å; F183-K187 PolarHBondContact O-N 2.87Å; F183-Y221 HydrophobicContact CE2-CD2 4.3Å; F183-Y221 AromaticContact CE2-CE2 3.9Å; F183-Y221 HydrophobicContact CE2-CE2 3.9Å; F183-Y221 HydrophobicContact CZ-CE2 4.17Å; F183-V225 HydrophobicContact CD2-CB 4.18Å; F183-V225 HydrophobicContact CE1-CG2 4.45Å; F183-V225 HydrophobicContact CE2-CB 3.52Å; F183-V225 HydrophobicContact CE2-CG2 3.75Å; F183-V225 HydrophobicContact CZ-CB 3.98Å; F183-V225 HydrophobicContact CZ-CG2 3.65Å; F183-A228 HydrophobicContact CB-CB 3.59Å; F183-A228 HydrophobicContact CD1-CB 4.36Å; F183-A228 HydrophobicContact CG-CB 3.98Å |
| 184 | C | 87.6 | Confident | 86.5 | Confident | 14 Ų | 14 | 32.9 Ų | 32.9 | 10% | 0.095 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -62.8 | -30.2 | 177.3 | -63.2 | 0 | 0 | 0 | 0 | 114 | A123 Y127 T180 L181 Q182 P188 M352 | A123-C184 HydrophobicContact CB-CB 4.39Å; A123-C184 PolarHBondContact O-SG 2.94Å; Y127-C184 VanDerWaalsContact CB-SG 3.52Å; T180-C184 PolarHBondContact O-N 2.93Å; T180-C184 VanDerWaalsContact O-N 3.07Å; T180-C184 PolarHBondContact O-SG 3.16Å; L181-C184 WeakPolarHBondContact O-CB 3.36Å; L181-C184 PolarHBondContact O-N 3.04Å; Q182-C184 VanDerWaalsContact C-N 3.34Å; Q182-C184 PolarHBondContact O-N 3.04Å; C184-P188 WeakPolarHBondContact O-CD 3.44Å; C184-P188 VanDerWaalsContact O-CG 3.31Å; C184-P188 WeakPolarHBondContact O-CG 3.27Å; C184-M352 HydrophobicContact CB-SD 4.1Å |
| 185 | A | 88.3 | Confident | 86.7 | Confident | 51 Ų | 51 | 33 Ų | 33 | 42% | 0.421 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -84.2 | -41.7 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | L181 Q182 F183 K187 P188 I189 | L181-A185 PolarHBondContact O-N 3.3Å; Q182-A185 PolarHBondContact O-N 3.19Å; F183-A185 VanDerWaalsContact C-N 3.26Å; F183-A185 PolarHBondContact O-N 3.12Å; A185-K187 VanDerWaalsContact C-N 3.35Å; A185-K187 PolarHBondContact O-N 2.62Å; A185-P188 WeakPolarHBondContact O-CD 3.44Å; A185-P188 WeakPolarHBondContact O-CG 3.24Å; A185-I189 VanDerWaalsContact O-CD1 3.3Å; A185-I189 WeakPolarHBondContact O-CD1 3.06Å; A185-I189 VanDerWaalsContact O-CG1 3.23Å; A185-I189 WeakPolarHBondContact O-CG1 3.46Å; A185-I189 PolarHBondContact O-N 2.91Å |
| 186 | V | 89 | Confident | 86.7 | Confident | 28 Ų | 28 | 33.2 Ų | 33.2 | 17% | 0.17 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -64.9 | -39.7 | -178.1 | 165.7 | 0 | 0 | 0 | 0 | 111.4 | Q182 F183 I189 M190 I220 | Q182-V186 HydrophobicContact CG-CG2 4.3Å; Q182-V186 VanDerWaalsContact NE2-CG2 3.26Å; Q182-V186 WeakPolarHBondContact O-CB 3.47Å; Q182-V186 WeakPolarHBondContact O-CG2 3.13Å; Q182-V186 PolarHBondContact O-N 3.08Å; F183-V186 PolarHBondContact O-N 3.49Å; V186-I189 PolarHBondContact O-N 2.89Å; V186-M190 HydrophobicContact CG1-CE 4.15Å; V186-M190 HydrophobicContact CG1-CG 3.79Å; V186-M190 VanDerWaalsContact O-CG 3.28Å; V186-M190 WeakPolarHBondContact O-CG 3.15Å; V186-M190 PolarHBondContact O-N 3.27Å; V186-I220 HydrophobicContact CG1-CG2 4.26Å |
| 187 | K | 85.9 | Confident | 86.7 | Confident | 5 Ų | 5 | 35.5 Ų | 35.5 | 2% | 0.022 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -59.8 | -52.5 | -175.9 | -157.4 | 148.7 | -173.1 | -167 | 0 | 114.2 | D119 E122 A123 F183 A185 I189 M190 A191 Y221 | D119-K187 VanDerWaalsContact CA-CE 3.49Å; D119-K187 HydrophobicContact CB-CD 4.42Å; D119-K187 VanDerWaalsContact CB-CE 3.47Å; D119-K187 HydrophobicContact CB-CG 4.24Å; D119-K187 WeakPolarHBondContact O-CD 3.21Å; D119-K187 WeakPolarHBondContact O-CE 3.46Å; D119-K187 WeakPolarHBondContact O-CG 3.02Å; D119-K187 PolarHBondContact O-NZ 2.96Å; D119-K187 VanDerWaalsContact OD1-CE 3.22Å; D119-K187 WeakPolarHBondContact OD1-CE 3.03Å; D119-K187 IonicContact OD1-NZ 2.84Å; D119-K187 PolarHBondContact OD1-NZ 3.2Å; D119-K187 VanDerWaalsContact OD1-NZ 3.17Å; E122-K187 VanDerWaalsContact CB-NZ 3.34Å; E122-K187 IonicContact OE1-NZ 3.32Å; E122-K187 PolarHBondContact OE1-NZ 2.97Å; E122-K187 IonicContact OE2-NZ 3.17Å; E122-K187 PolarHBondContact OE2-NZ 2.93Å; A123-K187 HydrophobicContact CB-CB 3.97Å; A123-K187 HydrophobicContact CB-CD 4.01Å; A123-K187 HydrophobicContact CB-CG 4.4Å; F183-K187 HydrophobicContact CE1-CD 4.01Å; F183-K187 HydrophobicContact CE2-CD 3.86Å; F183-K187 HydrophobicContact CZ-CD 3.44Å; F183-K187 VanDerWaalsContact CZ-CD 3.44Å; F183-K187 WeakPolarHBondContact O-CB 3.5Å; F183-K187 PolarHBondContact O-N 2.87Å; A185-K187 VanDerWaalsContact C-N 3.35Å; A185-K187 PolarHBondContact O-N 2.62Å; K187-I189 VanDerWaalsContact C-N 3.3Å; K187-I189 PolarHBondContact O-N 3.47Å; K187-M190 PolarHBondContact O-N 3.01Å; K187-A191 PolarHBondContact O-N 3.44Å; K187-Y221 HydrophobicContact CD-CE2 3.99Å; K187-Y221 VanDerWaalsContact CE-CE2 3.47Å; K187-Y221 PolarHBondContact NZ-OH 2.84Å |
| 188 | P | 86.9 | Confident | 86.4 | Confident | 52 Ų | 52 | 36.6 Ų | 36.6 | 34% | 0.338 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -65 | -31.8 | 175.1 | 24.6 | -33.9 | 0 | 0 | 0 | 113.1 | C184 A185 A191 A192 | C184-P188 WeakPolarHBondContact O-CD 3.44Å; C184-P188 VanDerWaalsContact O-CG 3.31Å; C184-P188 WeakPolarHBondContact O-CG 3.27Å; A185-P188 WeakPolarHBondContact O-CD 3.44Å; A185-P188 WeakPolarHBondContact O-CG 3.24Å; P188-A191 PolarHBondContact O-N 3.14Å; P188-A192 WeakPolarHBondContact O-CB 3.18Å; P188-A192 PolarHBondContact O-N 3.09Å |
| 189 | I | 89 | Confident | 86.2 | Confident | 93 Ų | 93 | 37.7 Ų | 37.7 | 48% | 0.477 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -64.5 | -44.7 | 174 | -66.7 | 168.8 | 0 | 0 | 0 | 110.1 | A185 V186 K187 A192 I193 | A185-I189 VanDerWaalsContact O-CD1 3.3Å; A185-I189 WeakPolarHBondContact O-CD1 3.06Å; A185-I189 VanDerWaalsContact O-CG1 3.23Å; A185-I189 WeakPolarHBondContact O-CG1 3.46Å; A185-I189 PolarHBondContact O-N 2.91Å; V186-I189 PolarHBondContact O-N 2.89Å; K187-I189 VanDerWaalsContact C-N 3.3Å; K187-I189 PolarHBondContact O-N 3.47Å; I189-A192 PolarHBondContact O-N 3.12Å; I189-I193 HydrophobicContact CG2-CD1 3.8Å; I189-I193 HydrophobicContact CG2-CG1 4.45Å; I189-I193 WeakPolarHBondContact O-CB 3.39Å; I189-I193 VanDerWaalsContact O-CG1 3.24Å; I189-I193 WeakPolarHBondContact O-CG1 3.3Å; I189-I193 PolarHBondContact O-N 3.35Å |
| 190 | M | 86 | Confident | 86 | Confident | 28 Ų | 28 | 45 Ų | 45 | 14% | 0.138 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -65 | -39 | 176.6 | -67.5 | -57.7 | 126.9 | 0 | 0 | 111.7 | V186 K187 I193 T194 I217 I220 | V186-M190 HydrophobicContact CG1-CE 4.15Å; V186-M190 HydrophobicContact CG1-CG 3.79Å; V186-M190 VanDerWaalsContact O-CG 3.28Å; V186-M190 WeakPolarHBondContact O-CG 3.15Å; V186-M190 PolarHBondContact O-N 3.27Å; K187-M190 PolarHBondContact O-N 3.01Å; M190-I193 HydrophobicContact CE-CD1 4.03Å; M190-I193 PolarHBondContact O-N 2.97Å; M190-I193 HydrophobicContact SD-CD1 4.38Å; M190-T194 WeakPolarHBondContact O-CB 3.1Å; M190-T194 PolarHBondContact O-N 3.42Å; M190-T194 PolarHBondContact O-OG1 3.34Å; M190-I217 HydrophobicContact CB-CG2 4.48Å; M190-I220 HydrophobicContact CE-CG2 3.92Å; M190-I220 HydrophobicContact SD-CB 4.39Å; M190-I220 HydrophobicContact SD-CD1 4.49Å; M190-I220 HydrophobicContact SD-CG2 3.95Å |
| 191 | A | 84.5 | Confident | 85.4 | Confident | 9 Ų | 9 | 47.1 Ų | 47.1 | 7% | 0.074 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -61.4 | -45.4 | 173.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | K187 P188 I193 T194 I195 | K187-A191 PolarHBondContact O-N 3.44Å; P188-A191 PolarHBondContact O-N 3.14Å; A191-I193 PolarHBondContact O-N 3.38Å; A191-T194 WeakPolarHBondContact O-CB 3.11Å; A191-T194 PolarHBondContact O-N 3.01Å; A191-I195 WeakPolarHBondContact O-CG1 3.23Å; A191-I195 PolarHBondContact O-N 3.28Å |
| 192 | A | 87.4 | Confident | 85 | Confident | 48 Ų | 48 | 53.4 Ų | 53.4 | 40% | 0.397 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -62.7 | -43.3 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | P188 I189 T194 I195 I196 | P188-A192 WeakPolarHBondContact O-CB 3.18Å; P188-A192 PolarHBondContact O-N 3.09Å; I189-A192 PolarHBondContact O-N 3.12Å; A192-T194 VanDerWaalsContact C-N 3.3Å; A192-T194 PolarHBondContact O-N 3.03Å; A192-I195 PolarHBondContact O-N 3.05Å; A192-I196 VanDerWaalsContact O-CG1 3.27Å; A192-I196 WeakPolarHBondContact O-CG1 3.3Å; A192-I196 PolarHBondContact O-N 3.07Å |
| 193 | I | 87.3 | Confident | 84.1 | Confident | 61 Ų | 61 | 52 Ų | 52 | 31% | 0.313 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -60.1 | -43.2 | 174.4 | -70.8 | 169.4 | 0 | 0 | 0 | 110.1 | I189 M190 A191 I196 L197 I217 | I189-I193 HydrophobicContact CG2-CD1 3.8Å; I189-I193 HydrophobicContact CG2-CG1 4.45Å; I189-I193 WeakPolarHBondContact O-CB 3.39Å; I189-I193 VanDerWaalsContact O-CG1 3.24Å; I189-I193 WeakPolarHBondContact O-CG1 3.3Å; I189-I193 PolarHBondContact O-N 3.35Å; M190-I193 HydrophobicContact CE-CD1 4.03Å; M190-I193 PolarHBondContact O-N 2.97Å; M190-I193 HydrophobicContact SD-CD1 4.38Å; A191-I193 PolarHBondContact O-N 3.38Å; I193-I196 PolarHBondContact O-N 3.26Å; I193-L197 HydrophobicContact CG2-CD1 3.65Å; I193-L197 WeakPolarHBondContact O-CD1 3.34Å; I193-L197 PolarHBondContact O-N 3.49Å; I193-I217 HydrophobicContact CG2-CD1 4.27Å; I193-I217 HydrophobicContact CG2-CG1 4.48Å |
| 194 | T | 83.2 | Confident | 83 | Confident | 12 Ų | 12 | 57.6 Ų | 57.6 | 7% | 0.074 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -58.2 | -50.2 | 178 | -59.6 | 0 | 0 | 0 | 0 | 111.6 | V112 M190 A191 A192 I196 L197 Q198 Y203 | V112-T194 HydrophobicContact CG1-CG2 4.31Å; M190-T194 WeakPolarHBondContact O-CB 3.1Å; M190-T194 PolarHBondContact O-N 3.42Å; M190-T194 PolarHBondContact O-OG1 3.34Å; A191-T194 WeakPolarHBondContact O-CB 3.11Å; A191-T194 PolarHBondContact O-N 3.01Å; A192-T194 VanDerWaalsContact C-N 3.3Å; A192-T194 PolarHBondContact O-N 3.03Å; T194-I196 VanDerWaalsContact C-N 3.3Å; T194-I196 PolarHBondContact O-N 3.42Å; T194-L197 PolarHBondContact O-N 2.84Å; T194-Q198 WeakPolarHBondContact O-CB 3.46Å; T194-Q198 PolarHBondContact O-N 2.9Å; T194-Y203 HydrophobicContact CG2-CD1 3.98Å; T194-Y203 HydrophobicContact CG2-CD2 4.08Å; T194-Y203 HydrophobicContact CG2-CE1 3.53Å; T194-Y203 HydrophobicContact CG2-CE2 3.64Å; T194-Y203 HydrophobicContact CG2-CG 4.22Å |
| 195 | I | 83.9 | Confident | 81.9 | Confident | 58 Ų | 58 | 59.5 Ų | 59.5 | 30% | 0.297 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -59.1 | -42.2 | 177.6 | -65.9 | 166.9 | 0 | 0 | 0 | 111 | A191 A192 Q198 A199 | A191-I195 WeakPolarHBondContact O-CG1 3.23Å; A191-I195 PolarHBondContact O-N 3.28Å; A192-I195 PolarHBondContact O-N 3.05Å; I195-Q198 PolarHBondContact O-N 3.16Å; I195-A199 PolarHBondContact O-N 3.41Å |
| 196 | I | 85.9 | Confident | 80.7 | Confident | 89 Ų | 89 | 57.3 Ų | 57.3 | 46% | 0.456 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -64.6 | -47.3 | 177.9 | -67.9 | 166.2 | 0 | 0 | 0 | 110.8 | A192 I193 T194 Q198 A199 F200 | A192-I196 VanDerWaalsContact O-CG1 3.27Å; A192-I196 WeakPolarHBondContact O-CG1 3.3Å; A192-I196 PolarHBondContact O-N 3.07Å; I193-I196 PolarHBondContact O-N 3.26Å; T194-I196 VanDerWaalsContact C-N 3.3Å; T194-I196 PolarHBondContact O-N 3.42Å; I196-Q198 VanDerWaalsContact C-N 3.28Å; I196-Q198 PolarHBondContact O-N 2.72Å; I196-A199 WeakPolarHBondContact O-CB 3.26Å; I196-A199 PolarHBondContact O-N 2.93Å; I196-F200 HydrophobicContact CG2-CD2 3.83Å; I196-F200 HydrophobicContact CG2-CE2 3.63Å; I196-F200 WeakPolarHBondContact O-CD2 3.44Å; I196-F200 PolarHBondContact O-N 2.97Å |
| 197 | L | 83 | Confident | 79.7 | Confident | 47 Ų | 47 | 58.6 Ų | 58.6 | 25% | 0.246 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -67.1 | -32.1 | -179.5 | -88.8 | 70.2 | 0 | 0 | 0 | 112.1 | I193 T194 F200 G201 K202 Y203 I217 | I193-L197 HydrophobicContact CG2-CD1 3.65Å; I193-L197 WeakPolarHBondContact O-CD1 3.34Å; I193-L197 PolarHBondContact O-N 3.49Å; T194-L197 PolarHBondContact O-N 2.84Å; L197-F200 PolarHBondContact O-N 3.45Å; L197-G201 PolarHBondContact O-N 2.86Å; L197-K202 PolarHBondContact O-N 2.99Å; L197-Y203 PolarHBondContact O-N 3.31Å; L197-I217 HydrophobicContact CD2-CD1 4.39Å |
| 198 | Q | 78.6 | Confident | 78.8 | Confident | 37 Ų | 37 | 61.4 Ų | 61.4 | 17% | 0.173 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -65.8 | -43.2 | 172.5 | -169.7 | 177.8 | 10.6 | 0 | 0 | 111.3 | V112 T194 I195 I196 F200 G201 Y203 | V112-Q198 VanDerWaalsContact CG1-OE1 3.28Å; T194-Q198 WeakPolarHBondContact O-CB 3.46Å; T194-Q198 PolarHBondContact O-N 2.9Å; I195-Q198 PolarHBondContact O-N 3.16Å; I196-Q198 VanDerWaalsContact C-N 3.28Å; I196-Q198 PolarHBondContact O-N 2.72Å; Q198-F200 PolarHBondContact O-N 3.45Å; Q198-G201 PolarHBondContact O-N 2.83Å; Q198-Y203 HydrophobicContact CB-CD1 4.45Å |
| 199 | A | 81.4 | Confident | 78.1 | Confident | 89 Ų | 89 | 62.8 Ų | 62.8 | 74% | 0.736 | 34% | 0.34 | S | S | * | . | H | α-helix | trans | -60.3 | -30 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | I195 I196 | I195-A199 PolarHBondContact O-N 3.41Å; I196-A199 WeakPolarHBondContact O-CB 3.26Å; I196-A199 PolarHBondContact O-N 2.93Å |
| 200 | F | 83.9 | Confident | 77.4 | Confident | 160 Ų | 160 | 62.7 Ų | 62.7 | 70% | 0.702 | 34% | 0.344 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.6 | 0.9 | 173.9 | -71.8 | -66.5 | 0 | 0 | 0 | 114.4 | I196 L197 Q198 K202 | I196-F200 HydrophobicContact CG2-CD2 3.83Å; I196-F200 HydrophobicContact CG2-CE2 3.63Å; I196-F200 WeakPolarHBondContact O-CD2 3.44Å; I196-F200 PolarHBondContact O-N 2.97Å; L197-F200 PolarHBondContact O-N 3.45Å; Q198-F200 PolarHBondContact O-N 3.45Å; F200-K202 HydrophobicContact CB-CG 4.39Å; F200-K202 PolarHBondContact O-N 3.39Å |
| 201 | G | 75.6 | Confident | 76.8 | Confident | 44 Ų | 44 | 68.1 Ų | 68.1 | 45% | 0.454 | 37% | 0.373 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 65.9 | 20.3 | -177.2 | 0 | 0 | 0 | 0 | 0 | 114.2 | L197 Q198 H204 | L197-G201 PolarHBondContact O-N 2.86Å; Q198-G201 PolarHBondContact O-N 2.83Å; G201-H204 PolarHBondContact O-CE1 2.84Å |
| 202 | K | 78.4 | Confident | 76.4 | Confident | 139 Ų | 139 | 68.2 Ų | 68.2 | 60% | 0.604 | 38% | 0.375 | S | S | * | . | trans | -101.4 | 2.2 | 179.6 | -67 | -65.4 | -173 | 179.6 | 0 | 113.2 | L197 F200 G213 | L197-K202 PolarHBondContact O-N 2.99Å; F200-K202 HydrophobicContact CB-CG 4.39Å; F200-K202 PolarHBondContact O-N 3.39Å; K202-G213 PolarHBondContact O-N 3.46Å | ||
| 203 | Y | 70.9 | Confident | 76 | Confident | 27 Ų | 27 | 66.4 Ų | 66.4 | 11% | 0.106 | 36% | 0.361 | C | S | . | . | trans | -118.8 | 121.2 | 174.9 | -171.6 | -94 | 0 | 0 | 0 | 109.3 | T194 L197 Q198 D205 Y214 I217 | T194-Y203 HydrophobicContact CG2-CD1 3.98Å; T194-Y203 HydrophobicContact CG2-CD2 4.08Å; T194-Y203 HydrophobicContact CG2-CE1 3.53Å; T194-Y203 HydrophobicContact CG2-CE2 3.64Å; T194-Y203 HydrophobicContact CG2-CG 4.22Å; L197-Y203 PolarHBondContact O-N 3.31Å; Q198-Y203 HydrophobicContact CB-CD1 4.45Å; Y203-D205 WeakPolarHBondContact CE1-OD1 3.21Å; Y203-D205 PolarHBondContact OH-OD1 3.49Å; Y203-Y214 HydrophobicContact CE1-CD2 4.44Å; Y203-Y214 AromaticContact CE2-CD2 3.82Å; Y203-Y214 HydrophobicContact CE2-CD2 3.82Å; Y203-Y214 HydrophobicContact CE2-CG 4.4Å; Y203-Y214 AromaticContact CZ-CD2 3.66Å; Y203-Y214 WeakPolarHBondContact OH-CD2 3.39Å; Y203-I217 HydrophobicContact CD2-CD1 3.87Å; Y203-I217 HydrophobicContact CE2-CD1 3.7Å | ||
| 204 | H | 66.3 | Low | 75.5 | Confident | 118 Ų | 118 | 65.1 Ų | 65.1 | 55% | 0.546 | 35% | 0.353 | S | S | . | . | trans | -130.6 | 123 | 169.7 | -68.6 | 84.3 | 0 | 0 | 0 | 106.5 | G201 G206 D207 | G201-H204 PolarHBondContact O-CE1 2.84Å; H204-G206 PolarHBondContact O-N 2.98Å; H204-D207 HydrophobicContact CB-CB 4.05Å; H204-D207 PolarHBondContact O-N 2.98Å; H204-D207 VanDerWaalsContact O-N 3.15Å | ||
| 205 | D | 64.9 | Low | 75.4 | Confident | 55 Ų | 55 | 66.2 Ų | 66.2 | 29% | 0.294 | 36% | 0.358 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -58.2 | 135.4 | 176.6 | -73 | -59.8 | 0 | 0 | 0 | 110.3 | Y203 D207 | Y203-D205 WeakPolarHBondContact CE1-OD1 3.21Å; Y203-D205 PolarHBondContact OH-OD1 3.49Å; D205-D207 VanDerWaalsContact C-N 3.26Å; D205-D207 PolarHBondContact O-N 3.1Å |
| 206 | G | 63 | Low | 75.4 | Confident | 4 Ų | 4 | 69.3 Ų | 69.3 | 4% | 0.041 | 37% | 0.366 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 81.4 | -6.9 | -177.8 | 0 | 0 | 0 | 0 | 0 | 115.2 | H204 F208 E273 R274 | H204-G206 PolarHBondContact O-N 2.98Å; G206-F208 WeakPolarHBondContact O-CD2 3.26Å; G206-F208 PolarHBondContact O-N 3.18Å; G206-E273 VanDerWaalsContact CA-OE2 3.26Å; G206-E273 WeakPolarHBondContact CA-OE2 3.12Å; G206-R274 PolarHBondContact O-NE 2.79Å; G206-R274 PolarHBondContact O-NH2 3Å |
| 207 | D | 68.4 | Low | 75.3 | Confident | 56 Ų | 56 | 65.9 Ų | 65.9 | 30% | 0.299 | 35% | 0.349 | S | S | . | . | trans | -89.8 | 93.3 | 178.3 | -164.8 | 15.6 | 0 | 0 | 0 | 114.2 | H204 D205 N209 R274 | H204-D207 HydrophobicContact CB-CB 4.05Å; H204-D207 PolarHBondContact O-N 2.98Å; H204-D207 VanDerWaalsContact O-N 3.15Å; D205-D207 VanDerWaalsContact C-N 3.26Å; D205-D207 PolarHBondContact O-N 3.1Å; D207-N209 PolarHBondContact O-N 3.2Å; D207-N209 WeakPolarHBondContact OD1-CB 3.15Å; D207-N209 PolarHBondContact OD1-N 3.18Å; D207-N209 VanDerWaalsContact OD1-N 3.11Å; D207-R274 VanDerWaalsContact CA-NH2 3.32Å; D207-R274 IonicContact OD1-NH2 2.74Å; D207-R274 PolarHBondContact OD1-NH2 3.25Å | ||
| 208 | F | 66.5 | Low | 75.1 | Confident | 63 Ų | 63 | 64.7 Ų | 64.7 | 28% | 0.276 | 34% | 0.343 | S | S | . | . | trans | -76.2 | 21.7 | 170.9 | -65.1 | -91.4 | 0 | 0 | 0 | 114.6 | G206 Y214 L215 T218 A270 R274 | G206-F208 WeakPolarHBondContact O-CD2 3.26Å; G206-F208 PolarHBondContact O-N 3.18Å; F208-Y214 HydrophobicContact CD1-CD1 4.46Å; F208-Y214 HydrophobicContact CD1-CE1 4.38Å; F208-Y214 HydrophobicContact CD2-CD1 4.48Å; F208-Y214 HydrophobicContact CD2-CE1 4.17Å; F208-Y214 HydrophobicContact CE1-CD1 4.45Å; F208-Y214 AromaticContact CE1-CE1 3.97Å; F208-Y214 HydrophobicContact CE1-CE1 3.97Å; F208-Y214 AromaticContact CE2-CE1 3.78Å; F208-Y214 HydrophobicContact CE2-CE1 3.78Å; F208-Y214 HydrophobicContact CG-CE1 4.49Å; F208-Y214 AromaticContact CZ-CE1 3.68Å; F208-Y214 HydrophobicContact CZ-CE1 3.68Å; F208-L215 HydrophobicContact CB-CD1 4.21Å; F208-L215 HydrophobicContact CD1-CD1 4.45Å; F208-L215 VanDerWaalsContact O-CD1 3.25Å; F208-L215 WeakPolarHBondContact O-CD1 3.4Å; F208-T218 HydrophobicContact CE1-CG2 4.31Å; F208-A270 HydrophobicContact CE2-CB 4.35Å; F208-A270 HydrophobicContact CZ-CB 4.37Å; F208-R274 HydrophobicContact CD2-CG 4.23Å; F208-R274 VanDerWaalsContact CD2-NE 3.33Å; F208-R274 HydrophobicContact CE2-CG 4.28Å | ||
| 209 | N | 72.9 | Confident | 75.4 | Confident | 82 Ų | 82 | 67.8 Ų | 67.8 | 44% | 0.439 | 36% | 0.36 | S | S | . | . | trans | -63 | 138.9 | 171.1 | -163.9 | -18.3 | 0 | 0 | 0 | 110.2 | D207 N211 G212 | D207-N209 PolarHBondContact O-N 3.2Å; D207-N209 WeakPolarHBondContact OD1-CB 3.15Å; D207-N209 PolarHBondContact OD1-N 3.18Å; D207-N209 VanDerWaalsContact OD1-N 3.11Å; N209-N211 PolarHBondContact O-N 3.47Å; N209-N211 VanDerWaalsContact O-N 3.14Å; N209-N211 PolarHBondContact OD1-N 2.95Å; N209-G212 PolarHBondContact O-N 3.27Å | ||
| 210 | V | 74.3 | Confident | 75.7 | Confident | 91 Ų | 91 | 67.3 Ų | 67.3 | 55% | 0.552 | 34% | 0.344 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61 | -24.7 | 178.8 | -175.3 | 0 | 0 | 0 | 0 | 111.3 | G212 Y216 | V210-G212 VanDerWaalsContact C-N 3.33Å; V210-Y216 VanDerWaalsContact O-CE2 3.31Å; V210-Y216 WeakPolarHBondContact O-CE2 3.28Å; V210-Y216 PolarHBondContact O-OH 3.22Å |
| 211 | N | 73.2 | Confident | 75.6 | Confident | 141 Ų | 141 | 61.5 Ų | 61.5 | 75% | 0.754 | 32% | 0.318 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.4 | -5.5 | 177.3 | -68.5 | 41.7 | 0 | 0 | 0 | 113.6 | N209 | N209-N211 PolarHBondContact O-N 3.47Å; N209-N211 VanDerWaalsContact O-N 3.14Å; N209-N211 PolarHBondContact OD1-N 2.95Å |
| 212 | G | 74.5 | Confident | 76 | Confident | 12 Ų | 12 | 61.2 Ų | 61.2 | 12% | 0.124 | 31% | 0.306 | C | S | . | . | S | Bend | trans | -100.2 | 149.8 | -178.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | N209 V210 Y214 Y216 | N209-G212 PolarHBondContact O-N 3.27Å; V210-G212 VanDerWaalsContact C-N 3.33Å; G212-Y214 VanDerWaalsContact C-N 3.34Å; G212-Y214 PolarHBondContact O-N 3.08Å; G212-Y216 WeakPolarHBondContact O-CD2 3.41Å |
| 213 | G | 79.4 | Confident | 76.3 | Confident | 9 Ų | 9 | 61.6 Ų | 61.6 | 9% | 0.093 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -69.8 | -28.2 | 179.9 | 0 | 0 | 0 | 0 | 0 | 114.9 | K202 L215 Y216 I217 | K202-G213 PolarHBondContact O-N 3.46Å; G213-L215 VanDerWaalsContact C-N 3.34Å; G213-L215 PolarHBondContact O-N 3.38Å; G213-Y216 PolarHBondContact O-N 2.98Å; G213-I217 WeakPolarHBondContact O-CG1 3.43Å; G213-I217 PolarHBondContact O-N 3.36Å; G213-I217 VanDerWaalsContact O-N 3.07Å |
| 214 | Y | 77.6 | Confident | 77.2 | Confident | 35 Ų | 35 | 60.4 Ų | 60.4 | 14% | 0.137 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -58.4 | -42.3 | -173.1 | -180 | -93.2 | 0 | 0 | 0 | 112.6 | Y203 F208 G212 Y216 T218 | Y203-Y214 HydrophobicContact CE1-CD2 4.44Å; Y203-Y214 AromaticContact CE2-CD2 3.82Å; Y203-Y214 HydrophobicContact CE2-CD2 3.82Å; Y203-Y214 HydrophobicContact CE2-CG 4.4Å; Y203-Y214 AromaticContact CZ-CD2 3.66Å; Y203-Y214 WeakPolarHBondContact OH-CD2 3.39Å; F208-Y214 HydrophobicContact CD1-CD1 4.46Å; F208-Y214 HydrophobicContact CD1-CE1 4.38Å; F208-Y214 HydrophobicContact CD2-CD1 4.48Å; F208-Y214 HydrophobicContact CD2-CE1 4.17Å; F208-Y214 HydrophobicContact CE1-CD1 4.45Å; F208-Y214 AromaticContact CE1-CE1 3.97Å; F208-Y214 HydrophobicContact CE1-CE1 3.97Å; F208-Y214 AromaticContact CE2-CE1 3.78Å; F208-Y214 HydrophobicContact CE2-CE1 3.78Å; F208-Y214 HydrophobicContact CG-CE1 4.49Å; F208-Y214 AromaticContact CZ-CE1 3.68Å; F208-Y214 HydrophobicContact CZ-CE1 3.68Å; G212-Y214 VanDerWaalsContact C-N 3.34Å; G212-Y214 PolarHBondContact O-N 3.08Å; Y214-Y216 PolarHBondContact O-N 3.36Å; Y214-T218 VanDerWaalsContact O-CB 3.23Å; Y214-T218 WeakPolarHBondContact O-CB 3.32Å; Y214-T218 PolarHBondContact O-N 3.12Å; Y214-T218 PolarHBondContact O-OG1 3.49Å |
| 215 | L | 80.9 | Confident | 78 | Confident | 35 Ų | 35 | 55.1 Ų | 55.1 | 18% | 0.183 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -60.3 | -47.6 | 178 | -179.4 | 142.5 | 0 | 0 | 0 | 112.4 | F208 G213 T218 I219 | F208-L215 HydrophobicContact CB-CD1 4.21Å; F208-L215 HydrophobicContact CD1-CD1 4.45Å; F208-L215 VanDerWaalsContact O-CD1 3.25Å; F208-L215 WeakPolarHBondContact O-CD1 3.4Å; G213-L215 VanDerWaalsContact C-N 3.34Å; G213-L215 PolarHBondContact O-N 3.38Å; L215-T218 PolarHBondContact O-N 3.35Å; L215-I219 HydrophobicContact CD2-CD1 3.59Å; L215-I219 HydrophobicContact CG-CD1 4.09Å; L215-I219 WeakPolarHBondContact O-CG1 3.01Å; L215-I219 PolarHBondContact O-N 2.94Å |
| 216 | Y | 84.7 | Confident | 78.9 | Confident | 122 Ų | 122 | 55.9 Ų | 55.9 | 48% | 0.478 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -67.7 | -44.2 | -178.2 | -66 | -77.7 | 0 | 0 | 0 | 111.9 | V210 G212 G213 Y214 T218 I219 I220 | V210-Y216 VanDerWaalsContact O-CE2 3.31Å; V210-Y216 WeakPolarHBondContact O-CE2 3.28Å; V210-Y216 PolarHBondContact O-OH 3.22Å; G212-Y216 WeakPolarHBondContact O-CD2 3.41Å; G213-Y216 PolarHBondContact O-N 2.98Å; Y214-Y216 PolarHBondContact O-N 3.36Å; Y216-T218 VanDerWaalsContact C-N 3.3Å; Y216-T218 PolarHBondContact O-N 3.26Å; Y216-I219 PolarHBondContact O-N 3.26Å; Y216-I220 VanDerWaalsContact O-CG1 3.31Å; Y216-I220 WeakPolarHBondContact O-CG1 3.18Å; Y216-I220 PolarHBondContact O-N 2.88Å |
| 217 | I | 83.4 | Confident | 79.9 | Confident | 18 Ų | 18 | 58 Ų | 58 | 9% | 0.092 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -59.4 | -46.2 | 176.2 | -68.5 | 161.8 | 0 | 0 | 0 | 109.5 | M190 I193 L197 Y203 G213 I219 I220 Y221 | M190-I217 HydrophobicContact CB-CG2 4.48Å; I193-I217 HydrophobicContact CG2-CD1 4.27Å; I193-I217 HydrophobicContact CG2-CG1 4.48Å; L197-I217 HydrophobicContact CD2-CD1 4.39Å; Y203-I217 HydrophobicContact CD2-CD1 3.87Å; Y203-I217 HydrophobicContact CE2-CD1 3.7Å; G213-I217 WeakPolarHBondContact O-CG1 3.43Å; G213-I217 PolarHBondContact O-N 3.36Å; G213-I217 VanDerWaalsContact O-N 3.07Å; I217-I219 PolarHBondContact O-N 2.91Å; I217-I220 PolarHBondContact O-N 3.38Å; I217-Y221 WeakPolarHBondContact O-CB 3.44Å; I217-Y221 PolarHBondContact O-N 3.42Å |
| 218 | T | 78.9 | Confident | 80.7 | Confident | 21 Ų | 21 | 55.4 Ų | 55.4 | 13% | 0.129 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -60.5 | -44.7 | 178.5 | -60.5 | 0 | 0 | 0 | 0 | 112 | F208 Y214 L215 Y216 N222 | F208-T218 HydrophobicContact CE1-CG2 4.31Å; Y214-T218 VanDerWaalsContact O-CB 3.23Å; Y214-T218 WeakPolarHBondContact O-CB 3.32Å; Y214-T218 PolarHBondContact O-N 3.12Å; Y214-T218 PolarHBondContact O-OG1 3.49Å; L215-T218 PolarHBondContact O-N 3.35Å; Y216-T218 VanDerWaalsContact C-N 3.3Å; Y216-T218 PolarHBondContact O-N 3.26Å; T218-N222 WeakPolarHBondContact CG2-ND2 3.41Å; T218-N222 VanDerWaalsContact O-CB 3.29Å; T218-N222 WeakPolarHBondContact O-CB 3.34Å; T218-N222 PolarHBondContact O-N 2.97Å; T218-N222 PolarHBondContact O-ND2 3.14Å |
| 219 | I | 83.9 | Confident | 81.4 | Confident | 103 Ų | 103 | 53.5 Ų | 53.5 | 53% | 0.528 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -65.3 | -48.7 | 179.1 | -69.9 | 169.5 | 0 | 0 | 0 | 111.4 | L215 Y216 I217 Y221 N222 F223 | L215-I219 HydrophobicContact CD2-CD1 3.59Å; L215-I219 HydrophobicContact CG-CD1 4.09Å; L215-I219 WeakPolarHBondContact O-CG1 3.01Å; L215-I219 PolarHBondContact O-N 2.94Å; Y216-I219 PolarHBondContact O-N 3.26Å; I217-I219 PolarHBondContact O-N 2.91Å; I219-Y221 VanDerWaalsContact C-N 3.3Å; I219-Y221 PolarHBondContact O-N 3.5Å; I219-N222 PolarHBondContact O-N 3.38Å; I219-F223 WeakPolarHBondContact O-CB 3.38Å; I219-F223 PolarHBondContact O-N 3.41Å |
| 220 | I | 87.4 | Confident | 81.7 | Confident | 78 Ų | 78 | 53 Ų | 53 | 40% | 0.4 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -61.1 | -44.3 | 179.9 | -67.5 | 167.6 | 0 | 0 | 0 | 109.9 | V186 M190 Y216 I217 F223 S224 | V186-I220 HydrophobicContact CG1-CG2 4.26Å; M190-I220 HydrophobicContact CE-CG2 3.92Å; M190-I220 HydrophobicContact SD-CB 4.39Å; M190-I220 HydrophobicContact SD-CD1 4.49Å; M190-I220 HydrophobicContact SD-CG2 3.95Å; Y216-I220 VanDerWaalsContact O-CG1 3.31Å; Y216-I220 WeakPolarHBondContact O-CG1 3.18Å; Y216-I220 PolarHBondContact O-N 2.88Å; I217-I220 PolarHBondContact O-N 3.38Å; I220-F223 PolarHBondContact O-N 3.18Å; I220-S224 VanDerWaalsContact O-CB 3.25Å; I220-S224 WeakPolarHBondContact O-CB 3.47Å; I220-S224 PolarHBondContact O-N 3.02Å |
| 221 | Y | 83.1 | Confident | 82.1 | Confident | 39 Ų | 39 | 48.7 Ų | 48.7 | 15% | 0.153 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -58.4 | -52.5 | 176.3 | 172.1 | -114.5 | 0 | 0 | 0 | 111.9 | E122 F183 K187 I217 I219 F223 S224 V225 F263 | E122-Y221 PolarHBondContact OE1-OH 3.33Å; F183-Y221 HydrophobicContact CE2-CD2 4.3Å; F183-Y221 AromaticContact CE2-CE2 3.9Å; F183-Y221 HydrophobicContact CE2-CE2 3.9Å; F183-Y221 HydrophobicContact CZ-CE2 4.17Å; K187-Y221 HydrophobicContact CD-CE2 3.99Å; K187-Y221 VanDerWaalsContact CE-CE2 3.47Å; K187-Y221 PolarHBondContact NZ-OH 2.84Å; I217-Y221 WeakPolarHBondContact O-CB 3.44Å; I217-Y221 PolarHBondContact O-N 3.42Å; I219-Y221 VanDerWaalsContact C-N 3.3Å; I219-Y221 PolarHBondContact O-N 3.5Å; Y221-F223 VanDerWaalsContact C-N 3.31Å; Y221-F223 PolarHBondContact O-N 3.21Å; Y221-S224 PolarHBondContact O-N 3.15Å; Y221-V225 HydrophobicContact CE2-CB 4.38Å; Y221-V225 WeakPolarHBondContact O-CG1 3.45Å; Y221-V225 PolarHBondContact O-N 3.49Å; Y221-F263 AromaticContact CE1-CD2 3.91Å; Y221-F263 HydrophobicContact CE1-CD2 3.91Å; Y221-F263 AromaticContact CE1-CE2 3.92Å; Y221-F263 HydrophobicContact CE1-CE2 3.92Å |
| 222 | N | 83.3 | Confident | 82.5 | Confident | 37 Ų | 37 | 42.4 Ų | 42.4 | 20% | 0.198 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -58.2 | -41.5 | 179.5 | -90.7 | -84.1 | 0 | 0 | 0 | 112.6 | T218 I219 V225 S226 F263 | T218-N222 WeakPolarHBondContact CG2-ND2 3.41Å; T218-N222 VanDerWaalsContact O-CB 3.29Å; T218-N222 WeakPolarHBondContact O-CB 3.34Å; T218-N222 PolarHBondContact O-N 2.97Å; T218-N222 PolarHBondContact O-ND2 3.14Å; I219-N222 PolarHBondContact O-N 3.38Å; N222-V225 WeakPolarHBondContact O-CG1 3.24Å; N222-S226 WeakPolarHBondContact O-CB 3.08Å; N222-S226 PolarHBondContact O-N 3.17Å; N222-S226 VanDerWaalsContact O-N 3.08Å; N222-S226 PolarHBondContact O-OG 2.98Å; N222-F263 WeakPolarHBondContact OD1-CE2 3.38Å; N222-F263 WeakPolarHBondContact OD1-CZ 3.32Å |
| 223 | F | 85.9 | Confident | 82.6 | Confident | 148 Ų | 148 | 44.5 Ų | 44.5 | 65% | 0.649 | 22% | 0.217 | S | C | * | . | H | α-helix | trans | -66.5 | -46.8 | 176.5 | -178.2 | -97.6 | 0 | 0 | 0 | 111.6 | I219 I220 Y221 S226 L227 | I219-F223 WeakPolarHBondContact O-CB 3.38Å; I219-F223 PolarHBondContact O-N 3.41Å; I220-F223 PolarHBondContact O-N 3.18Å; Y221-F223 VanDerWaalsContact C-N 3.31Å; Y221-F223 PolarHBondContact O-N 3.21Å; F223-S226 PolarHBondContact O-N 2.98Å; F223-L227 WeakPolarHBondContact O-CB 3.49Å; F223-L227 PolarHBondContact O-N 2.77Å |
| 224 | S | 88.5 | Confident | 82.5 | Confident | 1 Ų | 1 | 44.5 Ų | 44.5 | 1% | 0.007 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -61.7 | -47.6 | -179 | -164.9 | 0 | 0 | 0 | 0 | 111.9 | Q182 I220 Y221 L227 A228 | Q182-S224 PolarHBondContact NE2-OG 3.38Å; Q182-S224 PolarHBondContact OE1-OG 3.37Å; I220-S224 VanDerWaalsContact O-CB 3.25Å; I220-S224 WeakPolarHBondContact O-CB 3.47Å; I220-S224 PolarHBondContact O-N 3.02Å; Y221-S224 PolarHBondContact O-N 3.15Å; S224-L227 PolarHBondContact O-N 3.37Å; S224-A228 PolarHBondContact O-N 3.37Å |
| 225 | V | 83.1 | Confident | 82.6 | Confident | 7 Ų | 7 | 43 Ų | 43 | 4% | 0.042 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -66.2 | -40.7 | 178.7 | 75.4 | 0 | 0 | 0 | 0 | 111.4 | F183 Y221 N222 L227 A228 L229 | F183-V225 HydrophobicContact CD2-CB 4.18Å; F183-V225 HydrophobicContact CE1-CG2 4.45Å; F183-V225 HydrophobicContact CE2-CB 3.52Å; F183-V225 HydrophobicContact CE2-CG2 3.75Å; F183-V225 HydrophobicContact CZ-CB 3.98Å; F183-V225 HydrophobicContact CZ-CG2 3.65Å; Y221-V225 HydrophobicContact CE2-CB 4.38Å; Y221-V225 WeakPolarHBondContact O-CG1 3.45Å; Y221-V225 PolarHBondContact O-N 3.49Å; N222-V225 WeakPolarHBondContact O-CG1 3.24Å; V225-L227 VanDerWaalsContact C-N 3.34Å; V225-L227 PolarHBondContact O-N 2.99Å; V225-A228 PolarHBondContact O-N 2.91Å; V225-L229 HydrophobicContact CG2-CD1 3.69Å; V225-L229 HydrophobicContact CG2-CG 4.28Å; V225-L229 WeakPolarHBondContact O-CB 3.14Å; V225-L229 VanDerWaalsContact O-CG 3.24Å; V225-L229 WeakPolarHBondContact O-CG 3.48Å; V225-L229 PolarHBondContact O-N 2.92Å |
| 226 | S | 83.3 | Confident | 82.4 | Confident | 71 Ų | 71 | 43 Ų | 43 | 50% | 0.497 | 21% | 0.206 | S | C | . | . | H | α-helix | trans | -62.7 | -41.9 | 177.1 | -63.4 | 0 | 0 | 0 | 0 | 111.6 | N222 F223 Y230 | N222-S226 WeakPolarHBondContact O-CB 3.08Å; N222-S226 PolarHBondContact O-N 3.17Å; N222-S226 VanDerWaalsContact O-N 3.08Å; N222-S226 PolarHBondContact O-OG 2.98Å; F223-S226 PolarHBondContact O-N 2.98Å; S226-Y230 WeakPolarHBondContact O-CB 3.24Å; S226-Y230 PolarHBondContact O-N 2.88Å |
| 227 | L | 85.5 | Confident | 82 | Confident | 50 Ų | 50 | 40.7 Ų | 40.7 | 26% | 0.262 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -63.6 | -47.3 | 177.2 | -178.3 | 65.9 | 0 | 0 | 0 | 111.7 | F175 A179 F223 S224 V225 Y230 A231 | F175-L227 HydrophobicContact CZ-CD1 4.18Å; A179-L227 HydrophobicContact CB-CG 4.27Å; F223-L227 WeakPolarHBondContact O-CB 3.49Å; F223-L227 PolarHBondContact O-N 2.77Å; S224-L227 PolarHBondContact O-N 3.37Å; V225-L227 VanDerWaalsContact C-N 3.34Å; V225-L227 PolarHBondContact O-N 2.99Å; L227-Y230 PolarHBondContact O-N 2.93Å; L227-A231 WeakPolarHBondContact O-CB 3.12Å; L227-A231 PolarHBondContact O-N 3.37Å |
| 228 | A | 85.4 | Confident | 81.5 | Confident | 0 Ų | 0 | 40.2 Ų | 40.2 | 0% | 0 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -64.4 | -44.6 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | F183 S224 V225 Y230 A231 L232 | F183-A228 HydrophobicContact CB-CB 3.59Å; F183-A228 HydrophobicContact CD1-CB 4.36Å; F183-A228 HydrophobicContact CG-CB 3.98Å; S224-A228 PolarHBondContact O-N 3.37Å; V225-A228 PolarHBondContact O-N 2.91Å; A228-Y230 VanDerWaalsContact C-N 3.34Å; A228-Y230 PolarHBondContact O-N 3.22Å; A228-A231 PolarHBondContact O-N 3.28Å; A228-L232 WeakPolarHBondContact O-CB 3.23Å; A228-L232 PolarHBondContact O-N 2.86Å |
| 229 | L | 79.6 | Confident | 81.2 | Confident | 23 Ų | 23 | 39.2 Ų | 39.2 | 12% | 0.12 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -68.5 | -34.7 | 178.4 | -68.9 | 170.3 | 0 | 0 | 0 | 112.3 | I126 V225 L232 F233 F260 | I126-L229 HydrophobicContact CD1-CD2 3.96Å; I126-L229 HydrophobicContact CD1-CG 4.5Å; V225-L229 HydrophobicContact CG2-CD1 3.69Å; V225-L229 HydrophobicContact CG2-CG 4.28Å; V225-L229 WeakPolarHBondContact O-CB 3.14Å; V225-L229 VanDerWaalsContact O-CG 3.24Å; V225-L229 WeakPolarHBondContact O-CG 3.48Å; V225-L229 PolarHBondContact O-N 2.92Å; L229-L232 HydrophobicContact CD2-CD2 4.5Å; L229-F233 VanDerWaalsContact O-CB 3.25Å; L229-F233 WeakPolarHBondContact O-CB 3.34Å; L229-F233 PolarHBondContact O-N 3.22Å; L229-F260 HydrophobicContact CB-CE2 4.45Å; L229-F260 HydrophobicContact CB-CZ 4.32Å; L229-F260 HydrophobicContact CD1-CD2 4.33Å; L229-F260 HydrophobicContact CD1-CE1 4.26Å; L229-F260 HydrophobicContact CD1-CE2 3.54Å; L229-F260 HydrophobicContact CD1-CZ 3.52Å; L229-F260 HydrophobicContact CD2-CE2 3.95Å; L229-F260 HydrophobicContact CG-CE2 4.19Å; L229-F260 HydrophobicContact CG-CZ 4.36Å |
| 230 | Y | 81 | Confident | 80.7 | Confident | 72 Ų | 72 | 35.8 Ų | 35.8 | 28% | 0.282 | 18% | 0.176 | S | C | . | . | H | α-helix | trans | -63.9 | -44.6 | 171.8 | 179 | -116.1 | 0 | 0 | 0 | 111.2 | G159 L163 S226 L227 A228 F233 L234 | G159-Y230 PolarHBondContact O-OH 3.17Å; G159-Y230 VanDerWaalsContact O-OH 3.08Å; L163-Y230 WeakPolarHBondContact CD1-OH 3.5Å; S226-Y230 WeakPolarHBondContact O-CB 3.24Å; S226-Y230 PolarHBondContact O-N 2.88Å; L227-Y230 PolarHBondContact O-N 2.93Å; A228-Y230 VanDerWaalsContact C-N 3.34Å; A228-Y230 PolarHBondContact O-N 3.22Å; Y230-F233 WeakPolarHBondContact O-CB 3.43Å; Y230-F233 PolarHBondContact O-N 2.88Å; Y230-L234 HydrophobicContact CD1-CD1 3.88Å; Y230-L234 HydrophobicContact CD1-CG 4.44Å; Y230-L234 HydrophobicContact CD2-CG 4.42Å; Y230-L234 HydrophobicContact CE1-CD1 3.39Å; Y230-L234 HydrophobicContact CE1-CG 4.1Å; Y230-L234 HydrophobicContact CE2-CD1 4.25Å; Y230-L234 HydrophobicContact CE2-CD2 4.17Å; Y230-L234 HydrophobicContact CE2-CG 4.05Å; Y230-L234 WeakPolarHBondContact O-CB 3.33Å; Y230-L234 WeakPolarHBondContact O-CG 3.35Å; Y230-L234 PolarHBondContact O-N 3.46Å |
| 231 | A | 82.7 | Confident | 80 | Confident | 0 Ų | 0 | 37.7 Ų | 37.7 | 0% | 0 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -65.4 | -40.8 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | F175 C176 A179 L227 A228 F233 L234 F235 | F175-A231 HydrophobicContact CE1-CB 4.19Å; C176-A231 HydrophobicContact CB-CB 4.49Å; C176-A231 PolarHBondContact SG-O 3Å; A179-A231 HydrophobicContact CB-CB 3.58Å; L227-A231 WeakPolarHBondContact O-CB 3.12Å; L227-A231 PolarHBondContact O-N 3.37Å; A228-A231 PolarHBondContact O-N 3.28Å; A231-F233 VanDerWaalsContact C-N 3.35Å; A231-L234 PolarHBondContact O-N 3.4Å; A231-F235 WeakPolarHBondContact O-CB 3.37Å; A231-F235 PolarHBondContact O-N 3.18Å |
| 232 | L | 80.2 | Confident | 79.4 | Confident | 9 Ų | 9 | 37.8 Ų | 37.8 | 5% | 0.047 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -61.6 | -42.6 | 172.4 | -172.5 | 78.1 | 0 | 0 | 0 | 111.8 | F129 L130 A228 L229 F235 Y236 F252 | F129-L232 HydrophobicContact CD1-CD1 3.67Å; F129-L232 HydrophobicContact CD1-CD2 3.74Å; F129-L232 HydrophobicContact CD1-CG 4.17Å; F129-L232 HydrophobicContact CE1-CD1 3.96Å; F129-L232 HydrophobicContact CE1-CD2 3.89Å; F129-L232 HydrophobicContact CE1-CG 4.17Å; L130-L232 HydrophobicContact CB-CD1 3.9Å; L130-L232 HydrophobicContact CD1-CD1 3.91Å; L130-L232 HydrophobicContact CG-CD1 4.48Å; A228-L232 WeakPolarHBondContact O-CB 3.23Å; A228-L232 PolarHBondContact O-N 2.86Å; L229-L232 HydrophobicContact CD2-CD2 4.5Å; L232-F235 PolarHBondContact O-N 3.42Å; L232-Y236 WeakPolarHBondContact O-CB 3.48Å; L232-Y236 PolarHBondContact O-N 3.48Å; L232-F252 HydrophobicContact CD2-CE2 3.89Å; L232-F252 HydrophobicContact CD2-CZ 4.32Å; L232-F252 HydrophobicContact CG-CE2 3.91Å |
| 233 | F | 78.1 | Confident | 78.8 | Confident | 57 Ų | 57 | 36.2 Ų | 36.2 | 25% | 0.25 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -64.3 | -43.3 | 176.6 | 176.5 | -102.4 | 0 | 0 | 0 | 112.2 | Y158 L229 Y230 A231 Y236 F237 | Y158-F233 HydrophobicContact CD1-CE1 4.48Å; Y158-F233 HydrophobicContact CD1-CZ 4.19Å; L229-F233 VanDerWaalsContact O-CB 3.25Å; L229-F233 WeakPolarHBondContact O-CB 3.34Å; L229-F233 PolarHBondContact O-N 3.22Å; Y230-F233 WeakPolarHBondContact O-CB 3.43Å; Y230-F233 PolarHBondContact O-N 2.88Å; A231-F233 VanDerWaalsContact C-N 3.35Å; F233-Y236 PolarHBondContact O-N 3.44Å; F233-F237 PolarHBondContact O-N 2.87Å |
| 234 | L | 77 | Confident | 77.9 | Confident | 9 Ų | 9 | 38.3 Ų | 38.3 | 5% | 0.047 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -60.3 | -46.3 | 174.3 | -75.3 | 177.3 | 0 | 0 | 0 | 111.4 | T160 L163 F172 Y230 A231 Y236 F237 A238 | T160-L234 HydrophobicContact CG2-CD2 3.47Å; T160-L234 VanDerWaalsContact CG2-CD2 3.47Å; L163-L234 HydrophobicContact CD1-CD1 3.83Å; L163-L234 HydrophobicContact CD1-CD2 4.12Å; F172-L234 HydrophobicContact CE2-CB 3.91Å; F172-L234 HydrophobicContact CE2-CD1 4.3Å; F172-L234 HydrophobicContact CZ-CB 3.83Å; Y230-L234 HydrophobicContact CD1-CD1 3.88Å; Y230-L234 HydrophobicContact CD1-CG 4.44Å; Y230-L234 HydrophobicContact CD2-CG 4.42Å; Y230-L234 HydrophobicContact CE1-CD1 3.39Å; Y230-L234 HydrophobicContact CE1-CG 4.1Å; Y230-L234 HydrophobicContact CE2-CD1 4.25Å; Y230-L234 HydrophobicContact CE2-CD2 4.17Å; Y230-L234 HydrophobicContact CE2-CG 4.05Å; Y230-L234 WeakPolarHBondContact O-CB 3.33Å; Y230-L234 WeakPolarHBondContact O-CG 3.35Å; Y230-L234 PolarHBondContact O-N 3.46Å; A231-L234 PolarHBondContact O-N 3.4Å; L234-Y236 VanDerWaalsContact C-N 3.34Å; L234-Y236 PolarHBondContact O-N 2.86Å; L234-F237 PolarHBondContact O-N 2.61Å; L234-A238 WeakPolarHBondContact O-CB 3.39Å; L234-A238 PolarHBondContact O-N 3.37Å |
| 235 | F | 79.5 | Confident | 76.7 | Confident | 2 Ų | 2 | 43.2 Ų | 43.2 | 1% | 0.009 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -59.4 | -45.3 | 176.5 | 176 | -88.4 | 0 | 0 | 0 | 111.5 | L130 S133 F134 L137 L173 C176 A231 L232 A238 T239 | L130-F235 HydrophobicContact CD1-CB 4.32Å; L130-F235 HydrophobicContact CD1-CD1 3.96Å; L130-F235 HydrophobicContact CD1-CD2 4.28Å; L130-F235 HydrophobicContact CD1-CE1 4.4Å; L130-F235 HydrophobicContact CD1-CG 3.9Å; S133-F235 VanDerWaalsContact CB-CE1 3.48Å; F134-F235 HydrophobicContact CD1-CE2 4.26Å; F134-F235 HydrophobicContact CD1-CZ 4.47Å; F134-F235 HydrophobicContact CD2-CE2 4.13Å; F134-F235 HydrophobicContact CD2-CZ 4.12Å; F134-F235 AromaticContact CE1-CE2 3.83Å; F134-F235 HydrophobicContact CE1-CE2 3.83Å; F134-F235 HydrophobicContact CE1-CZ 4.47Å; F134-F235 HydrophobicContact CE2-CD2 4.18Å; F134-F235 AromaticContact CE2-CE2 3.7Å; F134-F235 HydrophobicContact CE2-CE2 3.7Å; F134-F235 HydrophobicContact CE2-CZ 4.14Å; F134-F235 HydrophobicContact CG-CE2 4.38Å; F134-F235 HydrophobicContact CG-CZ 4.27Å; F134-F235 HydrophobicContact CZ-CD2 4.04Å; F134-F235 AromaticContact CZ-CE2 3.52Å; F134-F235 HydrophobicContact CZ-CE2 3.52Å; F134-F235 HydrophobicContact CZ-CZ 4.31Å; L137-F235 HydrophobicContact CD1-CE1 4.37Å; L137-F235 HydrophobicContact CD1-CZ 3.81Å; L173-F235 HydrophobicContact CD2-CD2 3.79Å; L173-F235 HydrophobicContact CD2-CE2 3.64Å; C176-F235 HydrophobicContact CB-CB 4.22Å; A231-F235 WeakPolarHBondContact O-CB 3.37Å; A231-F235 PolarHBondContact O-N 3.18Å; L232-F235 PolarHBondContact O-N 3.42Å; F235-A238 WeakPolarHBondContact O-CB 3.5Å; F235-A238 PolarHBondContact O-N 3.14Å; F235-T239 HydrophobicContact CD2-CG2 4.41Å; F235-T239 HydrophobicContact CE1-CG2 4.21Å; F235-T239 HydrophobicContact CE2-CG2 4.03Å; F235-T239 HydrophobicContact CZ-CG2 3.93Å; F235-T239 WeakPolarHBondContact O-CB 3.35Å; F235-T239 WeakPolarHBondContact O-CG2 3.28Å; F235-T239 PolarHBondContact O-N 3.49Å; F235-T239 VanDerWaalsContact O-N 3.08Å; F235-T239 PolarHBondContact O-OG1 3.17Å |
| 236 | Y | 76.4 | Confident | 75.8 | Confident | 36 Ų | 36 | 47.8 Ų | 47.8 | 14% | 0.141 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -60.7 | -47.1 | 177.3 | 174.6 | -93.1 | 0 | 0 | 0 | 111.6 | L232 F233 L234 A238 T239 S240 P248 V249 F252 | L232-Y236 WeakPolarHBondContact O-CB 3.48Å; L232-Y236 PolarHBondContact O-N 3.48Å; F233-Y236 PolarHBondContact O-N 3.44Å; L234-Y236 VanDerWaalsContact C-N 3.34Å; L234-Y236 PolarHBondContact O-N 2.86Å; Y236-A238 VanDerWaalsContact C-N 3.29Å; Y236-A238 PolarHBondContact O-N 3.14Å; Y236-T239 CarbonylContact O-C 3.59Å; Y236-T239 PolarHBondContact O-N 2.94Å; Y236-S240 VanDerWaalsContact O-CA 3.32Å; Y236-S240 WeakPolarHBondContact O-CA 3.44Å; Y236-S240 WeakPolarHBondContact O-CB 3.42Å; Y236-S240 PolarHBondContact O-N 3.44Å; Y236-P248 HydrophobicContact CE2-CB 3.95Å; Y236-P248 HydrophobicContact CE2-CG 4.14Å; Y236-V249 WeakPolarHBondContact OH-CA 3.21Å; Y236-V249 WeakPolarHBondContact OH-CG2 3.32Å; Y236-V249 PolarHBondContact OH-N 2.72Å; Y236-F252 HydrophobicContact CD2-CB 4.13Å; Y236-F252 AromaticContact CD2-CD2 3.53Å; Y236-F252 HydrophobicContact CD2-CD2 3.53Å; Y236-F252 HydrophobicContact CD2-CE2 4.09Å; Y236-F252 AromaticContact CD2-CG 3.85Å; Y236-F252 HydrophobicContact CD2-CG 3.85Å; Y236-F252 HydrophobicContact CE2-CB 3.97Å; Y236-F252 HydrophobicContact CE2-CD2 4.24Å; Y236-F252 HydrophobicContact CE2-CG 4.1Å; Y236-F252 AromaticContact CG-CD2 3.8Å; Y236-F252 HydrophobicContact CG-CD2 3.8Å; Y236-F252 AromaticContact CG-CE2 3.88Å; Y236-F252 HydrophobicContact CG-CE2 3.88Å; Y236-F252 HydrophobicContact CG-CG 4.21Å; Y236-F252 HydrophobicContact CG-CZ 4.3Å |
| 237 | F | 75 | Confident | 74.7 | Confident | 74 Ų | 74 | 51 Ų | 51 | 33% | 0.325 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -59.2 | -43.9 | 178.2 | -175.4 | -101.7 | 0 | 0 | 0 | 111.3 | F233 L234 T239 S240 | F233-F237 PolarHBondContact O-N 2.87Å; L234-F237 PolarHBondContact O-N 2.61Å; F237-T239 VanDerWaalsContact C-N 3.27Å; F237-T239 PolarHBondContact O-N 2.84Å; F237-S240 PolarHBondContact O-OG 3.45Å |
| 238 | A | 73.7 | Confident | 73.5 | Confident | 8 Ų | 8 | 49.3 Ų | 49.3 | 7% | 0.066 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -59.8 | -35 | 178.5 | 0 | 0 | 0 | 0 | 0 | 114.6 | Y168 F172 L234 F235 Y236 | Y168-A238 HydrophobicContact CD1-CB 3.8Å; Y168-A238 HydrophobicContact CE1-CB 3.12Å; Y168-A238 WeakPolarHBondContact OH-CA 2.9Å; F172-A238 HydrophobicContact CE1-CB 3.72Å; F172-A238 HydrophobicContact CZ-CB 4.05Å; L234-A238 WeakPolarHBondContact O-CB 3.39Å; L234-A238 PolarHBondContact O-N 3.37Å; F235-A238 WeakPolarHBondContact O-CB 3.5Å; F235-A238 PolarHBondContact O-N 3.14Å; Y236-A238 VanDerWaalsContact C-N 3.29Å; Y236-A238 PolarHBondContact O-N 3.14Å |
| 239 | T | 72.3 | Confident | 72.3 | Confident | 0 Ų | 0 | 53.5 Ų | 53.5 | 0% | 0 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -111.8 | 0.9 | -170.3 | 58.4 | 0 | 0 | 0 | 0 | 112.9 | L137 I147 F235 Y236 F237 D241 L242 L243 | L137-T239 HydrophobicContact CD1-CG2 3.56Å; I147-T239 HydrophobicContact CD1-CG2 3.76Å; F235-T239 HydrophobicContact CD2-CG2 4.41Å; F235-T239 HydrophobicContact CE1-CG2 4.21Å; F235-T239 HydrophobicContact CE2-CG2 4.03Å; F235-T239 HydrophobicContact CZ-CG2 3.93Å; F235-T239 WeakPolarHBondContact O-CB 3.35Å; F235-T239 WeakPolarHBondContact O-CG2 3.28Å; F235-T239 PolarHBondContact O-N 3.49Å; F235-T239 VanDerWaalsContact O-N 3.08Å; F235-T239 PolarHBondContact O-OG1 3.17Å; Y236-T239 CarbonylContact O-C 3.59Å; Y236-T239 PolarHBondContact O-N 2.94Å; F237-T239 VanDerWaalsContact C-N 3.27Å; F237-T239 PolarHBondContact O-N 2.84Å; T239-D241 VanDerWaalsContact C-N 3.28Å; T239-D241 PolarHBondContact O-N 3.33Å; T239-L242 PolarHBondContact O-N 3.32Å; T239-L243 WeakPolarHBondContact O-CB 3.44Å; T239-L243 WeakPolarHBondContact O-CG 3.44Å; T239-L243 PolarHBondContact O-N 3.36Å; T239-L243 VanDerWaalsContact OG1-CD1 3.29Å; T239-L243 WeakPolarHBondContact OG1-CD1 3.27Å |
| 240 | S | 74.5 | Confident | 71.4 | Confident | 30 Ų | 30 | 57.3 Ų | 57.3 | 21% | 0.21 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -57.7 | -39 | -173.6 | 57.3 | 0 | 0 | 0 | 0 | 113 | Y236 F237 L243 R244 | Y236-S240 VanDerWaalsContact O-CA 3.32Å; Y236-S240 WeakPolarHBondContact O-CA 3.44Å; Y236-S240 WeakPolarHBondContact O-CB 3.42Å; Y236-S240 PolarHBondContact O-N 3.44Å; F237-S240 PolarHBondContact O-OG 3.45Å; S240-L243 PolarHBondContact O-N 3.45Å; S240-R244 PolarHBondContact O-N 3.38Å |
| 241 | D | 71.4 | Confident | 70.9 | Confident | 119 Ų | 119 | 55.5 Ų | 55.5 | 64% | 0.636 | 27% | 0.273 | S | S | * | . | H | α-helix | trans | -66 | -39.3 | 176.9 | -70 | -40.2 | 0 | 0 | 0 | 112.5 | T239 R244 | T239-D241 VanDerWaalsContact C-N 3.28Å; T239-D241 PolarHBondContact O-N 3.33Å; D241-R244 WeakPolarHBondContact O-CB 3.44Å |
| 242 | L | 70.8 | Confident | 70.1 | Confident | 40 Ų | 40 | 56.1 Ų | 56.1 | 21% | 0.209 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -73.7 | -34.2 | 178.3 | -74.2 | 65.8 | 0 | 0 | 0 | 111.1 | L137 E146 I147 T239 R244 P245 | L137-L242 HydrophobicContact CD2-CB 3.37Å; L137-L242 HydrophobicContact CD2-CD2 3.84Å; L137-L242 HydrophobicContact CD2-CG 4.29Å; E146-L242 HydrophobicContact CB-CD2 3.86Å; E146-L242 HydrophobicContact CG-CD1 4.11Å; E146-L242 HydrophobicContact CG-CD2 3.39Å; E146-L242 HydrophobicContact CG-CG 3.73Å; I147-L242 HydrophobicContact CG1-CD2 4.21Å; T239-L242 PolarHBondContact O-N 3.32Å; L242-R244 VanDerWaalsContact C-N 3.34Å; L242-P245 VanDerWaalsContact O-CD 3.26Å; L242-P245 WeakPolarHBondContact O-CD 3.04Å |
| 243 | L | 70 | Confident | 69.3 | Low | 4 Ų | 4 | 60.7 Ų | 60.7 | 2% | 0.021 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -80.6 | -13.5 | 179.6 | -74.2 | 165.1 | 0 | 0 | 0 | 113 | Y136 L137 T239 S240 P245 Y246 P248 | Y136-L243 HydrophobicContact CD2-CD2 4.41Å; L137-L243 HydrophobicContact CD1-CG 4.45Å; L137-L243 HydrophobicContact CD2-CD2 4.01Å; L137-L243 HydrophobicContact CD2-CG 3.88Å; L137-L243 HydrophobicContact CG-CD2 4.01Å; L137-L243 HydrophobicContact CG-CG 4.22Å; T239-L243 WeakPolarHBondContact O-CB 3.44Å; T239-L243 WeakPolarHBondContact O-CG 3.44Å; T239-L243 PolarHBondContact O-N 3.36Å; T239-L243 VanDerWaalsContact OG1-CD1 3.29Å; T239-L243 WeakPolarHBondContact OG1-CD1 3.27Å; S240-L243 PolarHBondContact O-N 3.45Å; L243-P245 VanDerWaalsContact C-N 3.29Å; L243-P245 WeakPolarHBondContact O-CD 3.06Å; L243-P245 VanDerWaalsContact O-N 3.12Å; L243-Y246 WeakPolarHBondContact O-CB 3.46Å; L243-Y246 PolarHBondContact O-N 3.12Å; L243-P248 HydrophobicContact CB-CB 3.67Å; L243-P248 HydrophobicContact CB-CG 3.57Å; L243-P248 HydrophobicContact CD1-CB 4.38Å; L243-P248 HydrophobicContact CG-CB 4.47Å; L243-P248 WeakPolarHBondContact O-CD 3.39Å; L243-P248 WeakPolarHBondContact O-CG 3.44Å |
| 244 | R | 67.4 | Low | 68.8 | Low | 193 Ų | 193 | 58.8 Ų | 58.8 | 73% | 0.728 | 29% | 0.293 | S | S | * | . | G | 310 helix | trans | -48.1 | -37.3 | -176.5 | -165.9 | 174.7 | -179.6 | 178.1 | -0.1 | 115.1 | S240 D241 L242 Y246 E247 | S240-R244 PolarHBondContact O-N 3.38Å; D241-R244 WeakPolarHBondContact O-CB 3.44Å; L242-R244 VanDerWaalsContact C-N 3.34Å; R244-Y246 PolarHBondContact O-N 3.43Å; R244-E247 PolarHBondContact O-N 3.28Å |
| 245 | P | 64.9 | Low | 68.3 | Low | 104 Ų | 104 | 58.8 Ų | 58.8 | 68% | 0.675 | 29% | 0.292 | S | S | * | . | G | 310 helix | trans | -63 | -18.7 | 176.1 | -21.6 | 34.2 | 0 | 0 | 0 | 114.5 | L242 L243 | L242-P245 VanDerWaalsContact O-CD 3.26Å; L242-P245 WeakPolarHBondContact O-CD 3.04Å; L243-P245 VanDerWaalsContact C-N 3.29Å; L243-P245 WeakPolarHBondContact O-CD 3.06Å; L243-P245 VanDerWaalsContact O-N 3.12Å |
| 246 | Y | 63.3 | Low | 67.8 | Low | 102 Ų | 102 | 62 Ų | 62 | 40% | 0.4 | 31% | 0.307 | S | S | . | . | G | 310 helix | trans | -104.8 | 13.3 | -174 | -62.4 | -75.1 | 0 | 0 | 0 | 114.2 | L243 R244 K251 | L243-Y246 WeakPolarHBondContact O-CB 3.46Å; L243-Y246 PolarHBondContact O-N 3.12Å; R244-Y246 PolarHBondContact O-N 3.43Å; Y246-K251 WeakPolarHBondContact O-CE 3.46Å; Y246-K251 PolarHBondContact O-NZ 2.89Å |
| 247 | E | 60.9 | Low | 67.2 | Low | 138 Ų | 138 | 62.7 Ų | 62.7 | 65% | 0.645 | 32% | 0.317 | S | S | * | . | trans | 46.9 | 56.9 | -176.2 | -61.7 | -171.7 | 137 | 0 | 0 | 113.3 | R244 V249 L250 | R244-E247 PolarHBondContact O-N 3.28Å; E247-V249 VanDerWaalsContact C-N 3.3Å; E247-V249 PolarHBondContact O-N 3.49Å; E247-L250 PolarHBondContact O-N 3.07Å | ||
| 248 | P | 59.7 | Low | 66.9 | Low | 16 Ų | 16 | 60 Ų | 60 | 10% | 0.104 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -75.6 | -23.8 | -164.9 | 36.4 | -39.5 | 0 | 0 | 0 | 111.5 | Y236 L243 L250 K251 F252 | Y236-P248 HydrophobicContact CE2-CB 3.95Å; Y236-P248 HydrophobicContact CE2-CG 4.14Å; L243-P248 HydrophobicContact CB-CB 3.67Å; L243-P248 HydrophobicContact CB-CG 3.57Å; L243-P248 HydrophobicContact CD1-CB 4.38Å; L243-P248 HydrophobicContact CG-CB 4.47Å; L243-P248 WeakPolarHBondContact O-CD 3.39Å; L243-P248 WeakPolarHBondContact O-CG 3.44Å; P248-L250 PolarHBondContact O-N 3.47Å; P248-K251 PolarHBondContact O-N 2.75Å; P248-F252 WeakPolarHBondContact O-CB 3.44Å; P248-F252 PolarHBondContact O-N 3.24Å |
| 249 | V | 60.3 | Low | 66.7 | Low | 88 Ų | 88 | 59.9 Ų | 59.9 | 53% | 0.533 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -59.2 | -46.3 | 177.7 | -174.1 | 0 | 0 | 0 | 0 | 110.4 | Y236 E247 L253 | Y236-V249 WeakPolarHBondContact OH-CA 3.21Å; Y236-V249 WeakPolarHBondContact OH-CG2 3.32Å; Y236-V249 PolarHBondContact OH-N 2.72Å; E247-V249 VanDerWaalsContact C-N 3.3Å; E247-V249 PolarHBondContact O-N 3.49Å; V249-L253 WeakPolarHBondContact O-CB 3.34Å; V249-L253 PolarHBondContact O-N 3.18Å |
| 250 | L | 60.1 | Low | 66.5 | Low | 103 Ų | 103 | 62.7 Ų | 62.7 | 54% | 0.539 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -67.7 | -42.6 | -178.6 | -89.8 | 164 | 0 | 0 | 0 | 111.4 | E247 P248 T254 | E247-L250 PolarHBondContact O-N 3.07Å; P248-L250 PolarHBondContact O-N 3.47Å; L250-T254 WeakPolarHBondContact O-CB 3.25Å; L250-T254 PolarHBondContact O-N 3.41Å; L250-T254 PolarHBondContact O-OG1 3.18Å |
| 251 | K | 70 | Confident | 66.2 | Low | 33 Ų | 33 | 65 Ų | 65 | 14% | 0.143 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -64.4 | -47.7 | 176.9 | -68 | 167.9 | 179.5 | 169.7 | 0 | 111.9 | Y246 P248 T254 I255 A317 F318 | Y246-K251 WeakPolarHBondContact O-CE 3.46Å; Y246-K251 PolarHBondContact O-NZ 2.89Å; P248-K251 PolarHBondContact O-N 2.75Å; K251-T254 PolarHBondContact O-N 2.73Å; K251-I255 PolarHBondContact O-N 3.32Å; K251-A317 WeakPolarHBondContact CE-O 3.48Å; K251-A317 HydrophobicContact CG-CB 4.1Å; K251-A317 VanDerWaalsContact CG-O 3.27Å; K251-A317 WeakPolarHBondContact CG-O 3.36Å; K251-F318 HydrophobicContact CB-CE1 4.39Å; K251-F318 HydrophobicContact CB-CZ 4.14Å; K251-F318 HydrophobicContact CD-CD1 4.47Å; K251-F318 HydrophobicContact CD-CE1 4.08Å; K251-F318 HydrophobicContact CG-CE1 4.11Å; K251-F318 HydrophobicContact CG-CZ 4.24Å |
| 252 | F | 65.8 | Low | 66.1 | Low | 14 Ų | 14 | 59.8 Ų | 59.8 | 6% | 0.061 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -63.5 | -49 | 178 | -176.1 | -86.8 | 0 | 0 | 0 | 111.3 | F129 L232 Y236 P248 T254 I255 K256 | F129-F252 AromaticContact CE1-CD2 3.33Å; F129-F252 HydrophobicContact CE1-CD2 3.33Å; F129-F252 AromaticContact CE1-CE2 3.78Å; F129-F252 HydrophobicContact CE1-CE2 3.78Å; F129-F252 HydrophobicContact CE1-CG 4.26Å; F129-F252 HydrophobicContact CZ-CB 3.88Å; F129-F252 AromaticContact CZ-CD2 3.43Å; F129-F252 HydrophobicContact CZ-CD2 3.43Å; F129-F252 VanDerWaalsContact CZ-CD2 3.43Å; F129-F252 HydrophobicContact CZ-CE2 4.33Å; F129-F252 HydrophobicContact CZ-CG 4.04Å; L232-F252 HydrophobicContact CD2-CE2 3.89Å; L232-F252 HydrophobicContact CD2-CZ 4.32Å; L232-F252 HydrophobicContact CG-CE2 3.91Å; Y236-F252 HydrophobicContact CD2-CB 4.13Å; Y236-F252 AromaticContact CD2-CD2 3.53Å; Y236-F252 HydrophobicContact CD2-CD2 3.53Å; Y236-F252 HydrophobicContact CD2-CE2 4.09Å; Y236-F252 AromaticContact CD2-CG 3.85Å; Y236-F252 HydrophobicContact CD2-CG 3.85Å; Y236-F252 HydrophobicContact CE2-CB 3.97Å; Y236-F252 HydrophobicContact CE2-CD2 4.24Å; Y236-F252 HydrophobicContact CE2-CG 4.1Å; Y236-F252 AromaticContact CG-CD2 3.8Å; Y236-F252 HydrophobicContact CG-CD2 3.8Å; Y236-F252 AromaticContact CG-CE2 3.88Å; Y236-F252 HydrophobicContact CG-CE2 3.88Å; Y236-F252 HydrophobicContact CG-CG 4.21Å; Y236-F252 HydrophobicContact CG-CZ 4.3Å; P248-F252 WeakPolarHBondContact O-CB 3.44Å; P248-F252 PolarHBondContact O-N 3.24Å; F252-T254 VanDerWaalsContact C-N 3.33Å; F252-T254 PolarHBondContact O-N 3.49Å; F252-I255 PolarHBondContact O-N 3.05Å; F252-K256 HydrophobicContact CD1-CB 4.46Å; F252-K256 HydrophobicContact CD1-CD 4.19Å; F252-K256 HydrophobicContact CE1-CB 4.43Å; F252-K256 HydrophobicContact CE1-CD 3.5Å; F252-K256 HydrophobicContact CZ-CD 4.17Å; F252-K256 WeakPolarHBondContact O-CB 3.47Å; F252-K256 PolarHBondContact O-N 2.83Å |
| 253 | L | 64.6 | Low | 65.9 | Low | 105 Ų | 105 | 59.7 Ų | 59.7 | 55% | 0.55 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -66.6 | -34.7 | -179.9 | -171.3 | 127.3 | 0 | 0 | 0 | 111.6 | V249 S257 | V249-L253 WeakPolarHBondContact O-CB 3.34Å; V249-L253 PolarHBondContact O-N 3.18Å; L253-S257 WeakPolarHBondContact O-CA 3.24Å; L253-S257 WeakPolarHBondContact O-CB 3.38Å; L253-S257 PolarHBondContact O-N 2.7Å |
| 254 | T | 67.5 | Low | 65.9 | Low | 17 Ų | 17 | 66.7 Ų | 66.7 | 10% | 0.104 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -64.6 | -52.3 | 176.6 | -60.7 | 0 | 0 | 0 | 0 | 111 | L250 K251 F252 S257 V258 A313 L314 A317 | L250-T254 WeakPolarHBondContact O-CB 3.25Å; L250-T254 PolarHBondContact O-N 3.41Å; L250-T254 PolarHBondContact O-OG1 3.18Å; K251-T254 PolarHBondContact O-N 2.73Å; F252-T254 VanDerWaalsContact C-N 3.33Å; F252-T254 PolarHBondContact O-N 3.49Å; T254-S257 PolarHBondContact O-N 3.25Å; T254-V258 VanDerWaalsContact O-CG2 3.26Å; T254-V258 WeakPolarHBondContact O-CG2 3.44Å; T254-V258 PolarHBondContact O-N 3.07Å; T254-A313 HydrophobicContact CG2-CB 3.67Å; T254-L314 HydrophobicContact CG2-CD2 3.94Å; T254-L314 HydrophobicContact CG2-CG 4.03Å; T254-A317 HydrophobicContact CG2-CB 4.39Å |
| 255 | I | 66.4 | Low | 65.9 | Low | 8 Ų | 8 | 58.7 Ų | 58.7 | 4% | 0.041 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -66.3 | -44.5 | 179.8 | -65.7 | 163.8 | 0 | 0 | 0 | 110.8 | I87 V125 F129 K251 F252 S257 V258 I259 L314 F318 | I87-I255 HydrophobicContact CD1-CD1 4.16Å; I87-I255 HydrophobicContact CG2-CD1 3.67Å; I87-I255 HydrophobicContact CG2-CG1 3.92Å; V125-I255 HydrophobicContact CG1-CG2 4.15Å; F129-I255 HydrophobicContact CB-CD1 4.42Å; F129-I255 HydrophobicContact CD2-CD1 3.18Å; F129-I255 HydrophobicContact CE2-CD1 3.6Å; F129-I255 HydrophobicContact CG-CD1 3.94Å; K251-I255 PolarHBondContact O-N 3.32Å; F252-I255 PolarHBondContact O-N 3.05Å; I255-S257 PolarHBondContact O-N 3.09Å; I255-V258 PolarHBondContact O-N 3.29Å; I255-I259 HydrophobicContact CG2-CD1 3.81Å; I255-I259 WeakPolarHBondContact O-CG1 3.34Å; I255-I259 PolarHBondContact O-N 3.28Å; I255-I259 VanDerWaalsContact O-N 3.12Å; I255-L314 HydrophobicContact CG1-CD2 4.17Å; I255-F318 HydrophobicContact CD1-CE2 3.78Å; I255-F318 HydrophobicContact CD1-CZ 3.64Å; I255-F318 HydrophobicContact CG1-CE2 4.23Å |
| 256 | K | 68.8 | Low | 66.1 | Low | 70 Ų | 70 | 54.7 Ų | 54.7 | 30% | 0.304 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -59.1 | -47.3 | 177.3 | -174 | 176.3 | 176.2 | -176.4 | 0 | 110.7 | F252 V258 I259 F260 | F252-K256 HydrophobicContact CD1-CB 4.46Å; F252-K256 HydrophobicContact CD1-CD 4.19Å; F252-K256 HydrophobicContact CE1-CB 4.43Å; F252-K256 HydrophobicContact CE1-CD 3.5Å; F252-K256 HydrophobicContact CZ-CD 4.17Å; F252-K256 WeakPolarHBondContact O-CB 3.47Å; F252-K256 PolarHBondContact O-N 2.83Å; K256-V258 VanDerWaalsContact C-N 3.32Å; K256-V258 PolarHBondContact O-N 3.23Å; K256-I259 PolarHBondContact O-N 3.49Å; K256-F260 HydrophobicContact CB-CD2 4.47Å; K256-F260 HydrophobicContact CD-CD2 4.29Å; K256-F260 HydrophobicContact CD-CE2 3.95Å; K256-F260 HydrophobicContact CG-CD2 3.34Å; K256-F260 HydrophobicContact CG-CE2 3.41Å; K256-F260 VanDerWaalsContact CG-CE2 3.41Å; K256-F260 HydrophobicContact CG-CG 4.43Å; K256-F260 VanDerWaalsContact O-CB 3.29Å; K256-F260 WeakPolarHBondContact O-CB 3.16Å; K256-F260 WeakPolarHBondContact O-CD2 3.23Å; K256-F260 PolarHBondContact O-N 3.29Å |
| 257 | S | 64.1 | Low | 66.3 | Low | 51 Ų | 51 | 52.6 Ų | 52.6 | 36% | 0.357 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -62.2 | -40.4 | 179.8 | -170.5 | 0 | 0 | 0 | 0 | 111.5 | L253 T254 I255 L261 | L253-S257 WeakPolarHBondContact O-CA 3.24Å; L253-S257 WeakPolarHBondContact O-CB 3.38Å; L253-S257 PolarHBondContact O-N 2.7Å; T254-S257 PolarHBondContact O-N 3.25Å; I255-S257 PolarHBondContact O-N 3.09Å; S257-L261 VanDerWaalsContact O-CB 3.23Å; S257-L261 WeakPolarHBondContact O-CB 3.49Å; S257-L261 WeakPolarHBondContact O-CD1 2.96Å; S257-L261 WeakPolarHBondContact O-CG 3.35Å; S257-L261 PolarHBondContact O-N 3.16Å; S257-L261 WeakPolarHBondContact OG-CD1 3.26Å |
| 258 | V | 68.4 | Low | 66.8 | Low | 17 Ų | 17 | 49.4 Ų | 49.4 | 10% | 0.103 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -62 | -46.3 | 178.6 | 171.3 | 0 | 0 | 0 | 0 | 111.4 | I90 T254 I255 K256 S262 M307 A310 | I90-V258 HydrophobicContact CD1-CG1 4.2Å; T254-V258 VanDerWaalsContact O-CG2 3.26Å; T254-V258 WeakPolarHBondContact O-CG2 3.44Å; T254-V258 PolarHBondContact O-N 3.07Å; I255-V258 PolarHBondContact O-N 3.29Å; K256-V258 VanDerWaalsContact C-N 3.32Å; K256-V258 PolarHBondContact O-N 3.23Å; V258-S262 PolarHBondContact O-N 3.19Å; V258-S262 PolarHBondContact O-OG 3.04Å; V258-M307 HydrophobicContact CG1-CE 3.91Å; V258-A310 HydrophobicContact CG2-CB 3.6Å |
| 259 | I | 70.5 | Confident | 67.3 | Low | 6 Ų | 6 | 49.7 Ų | 49.7 | 3% | 0.031 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -73.2 | -39 | -178.4 | -62.5 | 169.6 | 0 | 0 | 0 | 111.7 | I90 E122 V125 I126 I255 K256 S262 F263 | I90-I259 HydrophobicContact CD1-CG1 4.23Å; E122-I259 HydrophobicContact CG-CG1 4.36Å; E122-I259 HydrophobicContact CG-CG2 3.72Å; V125-I259 HydrophobicContact CG1-CD1 4.16Å; I126-I259 HydrophobicContact CD1-CD1 4.44Å; I126-I259 HydrophobicContact CG1-CD1 3.78Å; I255-I259 HydrophobicContact CG2-CD1 3.81Å; I255-I259 WeakPolarHBondContact O-CG1 3.34Å; I255-I259 PolarHBondContact O-N 3.28Å; I255-I259 VanDerWaalsContact O-N 3.12Å; K256-I259 PolarHBondContact O-N 3.49Å; I259-S262 PolarHBondContact O-OG 3.09Å; I259-F263 PolarHBondContact O-N 3.45Å |
| 260 | F | 66.4 | Low | 67.6 | Low | 59 Ų | 59 | 45.9 Ų | 45.9 | 26% | 0.259 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -71.8 | -37.8 | 179.7 | -90.2 | -94.3 | 0 | 0 | 0 | 112.5 | L229 K256 F263 W264 | L229-F260 HydrophobicContact CB-CE2 4.45Å; L229-F260 HydrophobicContact CB-CZ 4.32Å; L229-F260 HydrophobicContact CD1-CD2 4.33Å; L229-F260 HydrophobicContact CD1-CE1 4.26Å; L229-F260 HydrophobicContact CD1-CE2 3.54Å; L229-F260 HydrophobicContact CD1-CZ 3.52Å; L229-F260 HydrophobicContact CD2-CE2 3.95Å; L229-F260 HydrophobicContact CG-CE2 4.19Å; L229-F260 HydrophobicContact CG-CZ 4.36Å; K256-F260 HydrophobicContact CB-CD2 4.47Å; K256-F260 HydrophobicContact CD-CD2 4.29Å; K256-F260 HydrophobicContact CD-CE2 3.95Å; K256-F260 HydrophobicContact CG-CD2 3.34Å; K256-F260 HydrophobicContact CG-CE2 3.41Å; K256-F260 VanDerWaalsContact CG-CE2 3.41Å; K256-F260 HydrophobicContact CG-CG 4.43Å; K256-F260 VanDerWaalsContact O-CB 3.29Å; K256-F260 WeakPolarHBondContact O-CB 3.16Å; K256-F260 WeakPolarHBondContact O-CD2 3.23Å; K256-F260 PolarHBondContact O-N 3.29Å; F260-F263 PolarHBondContact O-N 2.96Å; F260-W264 AromaticContact CD1-NE1 3.85Å; F260-W264 WeakPolarHBondContact O-CB 3.33Å; F260-W264 VanDerWaalsContact O-CD1 3.22Å; F260-W264 PolarHBondContact O-N 3.43Å |
| 261 | L | 69.7 | Low | 68 | Low | 79 Ų | 79 | 45.3 Ų | 45.3 | 41% | 0.414 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -62.7 | -46.1 | 179.2 | -74.8 | 171.1 | 0 | 0 | 0 | 110.9 | S257 F263 W264 Q265 | S257-L261 VanDerWaalsContact O-CB 3.23Å; S257-L261 WeakPolarHBondContact O-CB 3.49Å; S257-L261 WeakPolarHBondContact O-CD1 2.96Å; S257-L261 WeakPolarHBondContact O-CG 3.35Å; S257-L261 PolarHBondContact O-N 3.16Å; S257-L261 WeakPolarHBondContact OG-CD1 3.26Å; L261-F263 VanDerWaalsContact C-N 3.32Å; L261-F263 PolarHBondContact O-N 3.43Å; L261-W264 PolarHBondContact O-N 3.06Å; L261-Q265 WeakPolarHBondContact O-CB 3.29Å; L261-Q265 VanDerWaalsContact O-CD 3.22Å; L261-Q265 WeakPolarHBondContact O-CG 2.91Å; L261-Q265 PolarHBondContact O-N 3.25Å |
| 262 | S | 68.2 | Low | 67.9 | Low | 8 Ų | 8 | 46.6 Ų | 46.6 | 6% | 0.056 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -63 | -37.1 | 177.2 | 54.8 | 0 | 0 | 0 | 0 | 112.9 | V258 I259 G266 | V258-S262 PolarHBondContact O-N 3.19Å; V258-S262 PolarHBondContact O-OG 3.04Å; I259-S262 PolarHBondContact O-OG 3.09Å; S262-G266 PolarHBondContact O-N 2.7Å |
| 263 | F | 66.8 | Low | 67.8 | Low | 38 Ų | 38 | 47.3 Ų | 47.3 | 17% | 0.167 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -67.4 | -49.2 | 175.7 | 168.5 | -94.5 | 0 | 0 | 0 | 112.4 | Y221 N222 I259 F260 L261 Q265 G266 M267 | Y221-F263 AromaticContact CE1-CD2 3.91Å; Y221-F263 HydrophobicContact CE1-CD2 3.91Å; Y221-F263 AromaticContact CE1-CE2 3.92Å; Y221-F263 HydrophobicContact CE1-CE2 3.92Å; N222-F263 WeakPolarHBondContact OD1-CE2 3.38Å; N222-F263 WeakPolarHBondContact OD1-CZ 3.32Å; I259-F263 PolarHBondContact O-N 3.45Å; F260-F263 PolarHBondContact O-N 2.96Å; L261-F263 VanDerWaalsContact C-N 3.32Å; L261-F263 PolarHBondContact O-N 3.43Å; F263-Q265 VanDerWaalsContact C-N 3.27Å; F263-Q265 PolarHBondContact O-N 3.24Å; F263-G266 PolarHBondContact O-N 3.06Å; F263-M267 HydrophobicContact CD1-CG 4.44Å; F263-M267 HydrophobicContact CE1-CG 3.8Å; F263-M267 HydrophobicContact CE2-CG 3.89Å; F263-M267 HydrophobicContact CE2-SD 4.45Å; F263-M267 HydrophobicContact CZ-CG 3.47Å; F263-M267 VanDerWaalsContact CZ-CG 3.47Å; F263-M267 HydrophobicContact CZ-SD 4.14Å; F263-M267 PolarHBondContact O-N 3.14Å |
| 264 | W | 69.8 | Low | 67.8 | Low | 152 Ų | 152 | 48.6 Ų | 48.6 | 58% | 0.576 | 24% | 0.24 | S | C | * | . | H | α-helix | trans | -64.9 | -33.2 | -179.1 | -85.6 | 100.2 | 0 | 0 | 0 | 112 | F260 L261 M267 V268 | F260-W264 AromaticContact CD1-NE1 3.85Å; F260-W264 WeakPolarHBondContact O-CB 3.33Å; F260-W264 VanDerWaalsContact O-CD1 3.22Å; F260-W264 PolarHBondContact O-N 3.43Å; L261-W264 PolarHBondContact O-N 3.06Å; W264-M267 PolarHBondContact O-N 3.39Å; W264-V268 VanDerWaalsContact O-CB 3.29Å; W264-V268 WeakPolarHBondContact O-CB 3.32Å; W264-V268 WeakPolarHBondContact O-CG2 3.31Å; W264-V268 PolarHBondContact O-N 3.12Å |
| 265 | Q | 68.1 | Low | 67.8 | Low | 25 Ų | 25 | 52 Ų | 52 | 12% | 0.117 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -61 | -49.4 | 171.9 | -73.2 | 159.4 | 6.3 | 0 | 0 | 112.2 | L261 F263 M267 V268 L269 Q299 E306 | L261-Q265 WeakPolarHBondContact O-CB 3.29Å; L261-Q265 VanDerWaalsContact O-CD 3.22Å; L261-Q265 WeakPolarHBondContact O-CG 2.91Å; L261-Q265 PolarHBondContact O-N 3.25Å; F263-Q265 VanDerWaalsContact C-N 3.27Å; F263-Q265 PolarHBondContact O-N 3.24Å; Q265-M267 VanDerWaalsContact C-N 3.3Å; Q265-M267 PolarHBondContact O-N 3.43Å; Q265-V268 PolarHBondContact O-N 3.28Å; Q265-L269 VanDerWaalsContact O-CB 3.29Å; Q265-L269 WeakPolarHBondContact O-CB 3.36Å; Q265-L269 WeakPolarHBondContact O-CD1 3.2Å; Q265-L269 VanDerWaalsContact O-CG 3.25Å; Q265-L269 WeakPolarHBondContact O-CG 3.48Å; Q265-L269 PolarHBondContact O-N 2.95Å; Q265-Q299 HydrophobicContact CB-CG 4.22Å; Q265-E306 PolarHBondContact NE2-OE1 3.34Å; Q265-E306 PolarHBondContact NE2-OE2 3Å |
| 266 | G | 68.3 | Low | 67.4 | Low | 20 Ų | 20 | 54 Ų | 54 | 21% | 0.206 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -59.4 | -42.4 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | S262 F263 L269 A270 Q299 | S262-G266 PolarHBondContact O-N 2.7Å; F263-G266 PolarHBondContact O-N 3.06Å; G266-L269 PolarHBondContact O-N 2.97Å; G266-A270 WeakPolarHBondContact O-CB 3.34Å; G266-A270 PolarHBondContact O-N 3.15Å; G266-Q299 VanDerWaalsContact CA-OE1 3.24Å |
| 267 | M | 67.5 | Low | 66.9 | Low | 58 Ų | 58 | 55.4 Ų | 55.4 | 29% | 0.286 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -63.8 | -47 | 175.4 | -76.8 | -65.4 | -60.9 | 0 | 0 | 112.9 | F263 W264 Q265 L269 A270 I271 | F263-M267 HydrophobicContact CD1-CG 4.44Å; F263-M267 HydrophobicContact CE1-CG 3.8Å; F263-M267 HydrophobicContact CE2-CG 3.89Å; F263-M267 HydrophobicContact CE2-SD 4.45Å; F263-M267 HydrophobicContact CZ-CG 3.47Å; F263-M267 VanDerWaalsContact CZ-CG 3.47Å; F263-M267 HydrophobicContact CZ-SD 4.14Å; F263-M267 PolarHBondContact O-N 3.14Å; W264-M267 PolarHBondContact O-N 3.39Å; Q265-M267 VanDerWaalsContact C-N 3.3Å; Q265-M267 PolarHBondContact O-N 3.43Å; M267-L269 VanDerWaalsContact C-N 3.31Å; M267-L269 PolarHBondContact O-N 3.42Å; M267-A270 PolarHBondContact O-N 3Å; M267-I271 WeakPolarHBondContact O-CD1 3.25Å; M267-I271 VanDerWaalsContact O-CG1 3.25Å; M267-I271 WeakPolarHBondContact O-CG1 3.48Å; M267-I271 PolarHBondContact O-N 3.23Å |
| 268 | V | 72.9 | Confident | 66.5 | Low | 71 Ų | 71 | 54 Ų | 54 | 43% | 0.43 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -62 | -42.1 | 178.8 | 164.5 | 0 | 0 | 0 | 0 | 110.4 | W264 Q265 I271 L272 | W264-V268 VanDerWaalsContact O-CB 3.29Å; W264-V268 WeakPolarHBondContact O-CB 3.32Å; W264-V268 WeakPolarHBondContact O-CG2 3.31Å; W264-V268 PolarHBondContact O-N 3.12Å; Q265-V268 PolarHBondContact O-N 3.28Å; V268-I271 PolarHBondContact O-N 2.98Å; V268-L272 HydrophobicContact CG1-CD1 3.53Å; V268-L272 WeakPolarHBondContact O-CB 3.4Å; V268-L272 WeakPolarHBondContact O-CD1 3.35Å; V268-L272 WeakPolarHBondContact O-CG 3.29Å; V268-L272 PolarHBondContact O-N 3.15Å |
| 269 | L | 69.9 | Low | 65.8 | Low | 21 Ų | 21 | 55.9 Ų | 55.9 | 11% | 0.11 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -66.7 | -42 | 177.9 | -74.5 | 167.8 | 0 | 0 | 0 | 112.5 | Q265 G266 M267 I271 L272 E273 A295 W298 Q299 | Q265-L269 VanDerWaalsContact O-CB 3.29Å; Q265-L269 WeakPolarHBondContact O-CB 3.36Å; Q265-L269 WeakPolarHBondContact O-CD1 3.2Å; Q265-L269 VanDerWaalsContact O-CG 3.25Å; Q265-L269 WeakPolarHBondContact O-CG 3.48Å; Q265-L269 PolarHBondContact O-N 2.95Å; G266-L269 PolarHBondContact O-N 2.97Å; M267-L269 VanDerWaalsContact C-N 3.31Å; M267-L269 PolarHBondContact O-N 3.42Å; L269-I271 VanDerWaalsContact C-N 3.28Å; L269-I271 PolarHBondContact O-N 2.9Å; L269-L272 HydrophobicContact CD2-CD1 4.47Å; L269-L272 PolarHBondContact O-N 3.46Å; L269-E273 PolarHBondContact O-N 2.94Å; L269-A295 HydrophobicContact CB-CB 4.32Å; L269-A295 WeakPolarHBondContact CD1-O 3.43Å; L269-W298 HydrophobicContact CD2-CB 4.39Å; L269-Q299 HydrophobicContact CD1-CB 3.43Å; L269-Q299 VanDerWaalsContact CD1-CB 3.43Å; L269-Q299 HydrophobicContact CD1-CG 3.84Å |
| 270 | A | 66.3 | Low | 64.8 | Low | 8 Ų | 8 | 61.4 Ų | 61.4 | 7% | 0.066 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -62.1 | -35.1 | 172.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | F208 G266 M267 R274 | F208-A270 HydrophobicContact CE2-CB 4.35Å; F208-A270 HydrophobicContact CZ-CB 4.37Å; G266-A270 WeakPolarHBondContact O-CB 3.34Å; G266-A270 PolarHBondContact O-N 3.15Å; M267-A270 PolarHBondContact O-N 3Å; A270-R274 VanDerWaalsContact O-CG 3.3Å; A270-R274 WeakPolarHBondContact O-CG 3.47Å; A270-R274 PolarHBondContact O-N 2.98Å |
| 271 | I | 68.9 | Low | 63.9 | Low | 92 Ų | 92 | 61.2 Ų | 61.2 | 47% | 0.472 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -71.5 | -41.5 | 173.8 | -67 | 164.1 | 0 | 0 | 0 | 111 | M267 V268 L269 E273 R274 C275 | M267-I271 WeakPolarHBondContact O-CD1 3.25Å; M267-I271 VanDerWaalsContact O-CG1 3.25Å; M267-I271 WeakPolarHBondContact O-CG1 3.48Å; M267-I271 PolarHBondContact O-N 3.23Å; V268-I271 PolarHBondContact O-N 2.98Å; L269-I271 VanDerWaalsContact C-N 3.28Å; L269-I271 PolarHBondContact O-N 2.9Å; I271-E273 VanDerWaalsContact C-N 3.32Å; I271-E273 PolarHBondContact O-N 3.32Å; I271-R274 CarbonylContact O-C 3.57Å; I271-R274 WeakPolarHBondContact O-CA 3.29Å; I271-R274 WeakPolarHBondContact O-CB 3.49Å; I271-R274 PolarHBondContact O-N 3.36Å; I271-R274 VanDerWaalsContact O-N 3.09Å; I271-C275 PolarHBondContact O-N 2.9Å; I271-C275 PolarHBondContact O-SG 3.27Å; I271-C275 VanDerWaalsContact O-SG 3.42Å |
| 272 | L | 67.5 | Low | 63 | Low | 59 Ų | 59 | 58.2 Ų | 58.2 | 31% | 0.309 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -62.2 | -38 | 177.3 | -87.3 | 148.3 | 0 | 0 | 0 | 112.4 | V268 L269 R274 C275 G276 V277 I278 | V268-L272 HydrophobicContact CG1-CD1 3.53Å; V268-L272 WeakPolarHBondContact O-CB 3.4Å; V268-L272 WeakPolarHBondContact O-CD1 3.35Å; V268-L272 WeakPolarHBondContact O-CG 3.29Å; V268-L272 PolarHBondContact O-N 3.15Å; L269-L272 HydrophobicContact CD2-CD1 4.47Å; L269-L272 PolarHBondContact O-N 3.46Å; L272-R274 VanDerWaalsContact C-N 3.34Å; L272-C275 PolarHBondContact O-N 3.3Å; L272-G276 PolarHBondContact O-N 2.85Å; L272-V277 HydrophobicContact CD2-CB 3.92Å; L272-V277 HydrophobicContact CD2-CG1 3.82Å; L272-V277 HydrophobicContact CD2-CG2 4.26Å; L272-V277 PolarHBondContact O-N 2.84Å; L272-I278 HydrophobicContact CB-CD1 3.99Å; L272-I278 HydrophobicContact CB-CG1 4.29Å |
| 273 | E | 64.1 | Low | 62 | Low | 29 Ų | 29 | 63 Ų | 63 | 14% | 0.136 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -58.6 | -47.1 | 170 | -176 | -177.9 | -174.2 | 0 | 0 | 110.7 | G206 L269 I271 C275 G276 A291 G292 | G206-E273 VanDerWaalsContact CA-OE2 3.26Å; G206-E273 WeakPolarHBondContact CA-OE2 3.12Å; L269-E273 PolarHBondContact O-N 2.94Å; I271-E273 VanDerWaalsContact C-N 3.32Å; I271-E273 PolarHBondContact O-N 3.32Å; E273-C275 PolarHBondContact O-N 3.21Å; E273-G276 PolarHBondContact O-N 2.84Å; E273-A291 HydrophobicContact CG-CB 4.07Å; E273-G292 PolarHBondContact OE1-N 3.08Å |
| 274 | R | 64.1 | Low | 61.2 | Low | 132 Ų | 132 | 61.7 Ų | 61.7 | 50% | 0.498 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -64.8 | -35.9 | 178.6 | -73.9 | -79.6 | 157.1 | 171.7 | -8.9 | 113.9 | G206 D207 F208 A270 I271 L272 G276 | G206-R274 PolarHBondContact O-NE 2.79Å; G206-R274 PolarHBondContact O-NH2 3Å; D207-R274 VanDerWaalsContact CA-NH2 3.32Å; D207-R274 IonicContact OD1-NH2 2.74Å; D207-R274 PolarHBondContact OD1-NH2 3.25Å; F208-R274 HydrophobicContact CD2-CG 4.23Å; F208-R274 VanDerWaalsContact CD2-NE 3.33Å; F208-R274 HydrophobicContact CE2-CG 4.28Å; A270-R274 VanDerWaalsContact O-CG 3.3Å; A270-R274 WeakPolarHBondContact O-CG 3.47Å; A270-R274 PolarHBondContact O-N 2.98Å; I271-R274 CarbonylContact O-C 3.57Å; I271-R274 WeakPolarHBondContact O-CA 3.29Å; I271-R274 WeakPolarHBondContact O-CB 3.49Å; I271-R274 PolarHBondContact O-N 3.36Å; I271-R274 VanDerWaalsContact O-N 3.09Å; L272-R274 VanDerWaalsContact C-N 3.34Å; R274-G276 PolarHBondContact O-N 3.29Å |
| 275 | C | 66.4 | Low | 60 | Low | 90 Ų | 90 | 61 Ų | 61 | 61% | 0.608 | 34% | 0.342 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.6 | -2.5 | 175.6 | -69.8 | 0 | 0 | 0 | 0 | 112.9 | I271 L272 E273 V277 | I271-C275 PolarHBondContact O-N 2.9Å; I271-C275 PolarHBondContact O-SG 3.27Å; I271-C275 VanDerWaalsContact O-SG 3.42Å; L272-C275 PolarHBondContact O-N 3.3Å; E273-C275 PolarHBondContact O-N 3.21Å; C275-V277 HydrophobicContact CB-CG2 3.91Å; C275-V277 PolarHBondContact O-N 3.08Å |
| 276 | G | 59.4 | Low | 58.9 | Low | 49 Ų | 49 | 62.9 Ų | 62.9 | 51% | 0.505 | 37% | 0.368 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 67.1 | 16.7 | -179.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | L272 E273 R274 I278 | L272-G276 PolarHBondContact O-N 2.85Å; E273-G276 PolarHBondContact O-N 2.84Å; R274-G276 PolarHBondContact O-N 3.29Å; G276-I278 VanDerWaalsContact C-N 3.28Å |
| 277 | V | 57.6 | Low | 57.8 | Low | 99 Ų | 99 | 68.1 Ų | 68.1 | 60% | 0.6 | 39% | 0.387 | S | S | * | . | trans | -73.6 | -29 | 175.7 | 179.8 | 0 | 0 | 0 | 0 | 109.8 | L272 C275 | L272-V277 HydrophobicContact CD2-CB 3.92Å; L272-V277 HydrophobicContact CD2-CG1 3.82Å; L272-V277 HydrophobicContact CD2-CG2 4.26Å; L272-V277 PolarHBondContact O-N 2.84Å; C275-V277 HydrophobicContact CB-CG2 3.91Å; C275-V277 PolarHBondContact O-N 3.08Å | ||
| 278 | I | 56.4 | Low | 56.9 | Low | 21 Ų | 21 | 70.4 Ų | 70.4 | 11% | 0.108 | 40% | 0.4 | C | S | . | . | S | Bend | trans | -94.7 | 123.9 | 173.8 | -54 | 178.5 | 0 | 0 | 0 | 108.3 | L272 G276 N280 A291 V294 A295 | L272-I278 HydrophobicContact CB-CD1 3.99Å; L272-I278 HydrophobicContact CB-CG1 4.29Å; G276-I278 VanDerWaalsContact C-N 3.28Å; I278-N280 PolarHBondContact O-N 3.46Å; I278-A291 HydrophobicContact CG2-CB 4.21Å; I278-V294 HydrophobicContact CG2-CB 4.41Å; I278-V294 HydrophobicContact CG2-CG1 4.08Å; I278-A295 HydrophobicContact CD1-CB 3.82Å |
| 279 | P | 54 | Low | 56.2 | Low | 58 Ų | 58 | 67.2 Ų | 67.2 | 38% | 0.377 | 38% | 0.381 | S | S | . | . | trans | -66.5 | 132.7 | -176.5 | -12.9 | 25 | 0 | 0 | 0 | 112.1 | A281 L282 | P279-A281 PolarHBondContact O-N 3.41Å; P279-A281 VanDerWaalsContact O-N 3.07Å; P279-L282 HydrophobicContact CB-CD1 3.54Å; P279-L282 HydrophobicContact CG-CD1 3.72Å | ||
| 280 | N | 47.7 | Very low | 55.7 | Low | 122 Ų | 122 | 67.9 Ų | 67.9 | 65% | 0.652 | 39% | 0.393 | S | S | * | . | S | Bend | trans | -65.1 | -10.3 | -168.2 | -71.3 | -56.8 | 0 | 0 | 0 | 117.1 | I278 | I278-N280 PolarHBondContact O-N 3.46Š|
| 281 | A | 48.4 | Very low | 55.5 | Low | 54 Ų | 54 | 67.7 Ų | 67.7 | 45% | 0.446 | 39% | 0.392 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -162.9 | 112.7 | 175.3 | 0 | 0 | 0 | 0 | 0 | 108 | P279 | P279-A281 PolarHBondContact O-N 3.41Å; P279-A281 VanDerWaalsContact O-N 3.07Å |
| 282 | L | 51.6 | Low | 55.3 | Low | 16 Ų | 16 | 63.9 Ų | 63.9 | 8% | 0.084 | 38% | 0.375 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.8 | 130.7 | 168.5 | -107.3 | 76.7 | 0 | 0 | 0 | 108.4 | I31 M42 P279 I284 V289 | I31-L282 HydrophobicContact CD1-CB 4.28Å; I31-L282 HydrophobicContact CD1-CD2 3.32Å; I31-L282 HydrophobicContact CD1-CG 3.58Å; I31-L282 HydrophobicContact CG1-CD2 4.21Å; I31-L282 HydrophobicContact CG1-CG 3.94Å; I31-L282 HydrophobicContact CG2-CD1 4.17Å; I31-L282 HydrophobicContact CG2-CD2 4.37Å; I31-L282 HydrophobicContact CG2-CG 3.84Å; M42-L282 HydrophobicContact CG-CD2 3.39Å; M42-L282 HydrophobicContact SD-CB 4.41Å; M42-L282 HydrophobicContact SD-CD2 3.25Å; M42-L282 WeakPolarHBondContact SD-CD2 3.22Å; M42-L282 HydrophobicContact SD-CG 4.42Å; P279-L282 HydrophobicContact CB-CD1 3.54Å; P279-L282 HydrophobicContact CG-CD1 3.72Å; L282-I284 PolarHBondContact O-N 2.87Å; L282-V289 HydrophobicContact CB-CG2 4.34Å; L282-V289 PolarHBondContact N-O 2.7Å; L282-V289 WeakPolarHBondContact O-CG2 3.2Å; L282-V289 PolarHBondContact O-N 3.46Å |
| 283 | F | 47.5 | Very low | 55.4 | Low | 109 Ų | 109 | 62.5 Ų | 62.5 | 48% | 0.478 | 37% | 0.369 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -76 | 109.5 | 171.1 | -72.8 | -91.6 | 0 | 0 | 0 | 108.1 | N288 | F283-N288 WeakPolarHBondContact CE1-OD1 3.49Å; F283-N288 WeakPolarHBondContact CZ-OD1 3.39Å |
| 284 | I | 48.9 | Very low | 55.8 | Low | 11 Ų | 11 | 61.7 Ų | 61.7 | 6% | 0.056 | 37% | 0.366 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -111.4 | 120.1 | 170.2 | -59 | 179.3 | 0 | 0 | 0 | 106.5 | M42 N45 L282 G286 H287 V289 | M42-I284 HydrophobicContact SD-CD1 3.89Å; M42-I284 HydrophobicContact SD-CG1 4.45Å; N45-I284 WeakPolarHBondContact ND2-CG2 3.25Å; L282-I284 PolarHBondContact O-N 2.87Å; I284-G286 VanDerWaalsContact C-N 3.29Å; I284-G286 PolarHBondContact O-N 2.92Å; I284-G286 VanDerWaalsContact O-N 3.11Å; I284-H287 PolarHBondContact N-O 3.27Å; I284-H287 VanDerWaalsContact N-O 3.17Å; I284-H287 PolarHBondContact O-N 3.4Å; I284-V289 HydrophobicContact CB-CG1 4.45Å; I284-V289 HydrophobicContact CB-CG2 4.26Å; I284-V289 HydrophobicContact CD1-CG1 4.38Å; I284-V289 HydrophobicContact CD1-CG2 3.48Å; I284-V289 VanDerWaalsContact CD1-CG2 3.48Å; I284-V289 HydrophobicContact CG1-CG2 3.68Å |
| 285 | E | 44.3 | Very low | 56.2 | Low | 136 Ų | 136 | 55.7 Ų | 55.7 | 64% | 0.636 | 35% | 0.345 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 47.6 | 41.7 | 175.9 | -62.3 | -176.7 | 145.9 | 0 | 0 | 115.4 | S106 H287 | S106-E285 PolarHBondContact OG-OE2 3.02Å; E285-H287 VanDerWaalsContact C-N 3.27Å; E285-H287 PolarHBondContact O-N 3.44Å |
| 286 | G | 44.3 | Very low | 56.6 | Low | 65 Ų | 65 | 51.6 Ų | 51.6 | 67% | 0.67 | 32% | 0.317 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 78.8 | 1.6 | 178.5 | 0 | 0 | 0 | 0 | 0 | 115.5 | I284 | I284-G286 VanDerWaalsContact C-N 3.29Å; I284-G286 PolarHBondContact O-N 2.92Å; I284-G286 VanDerWaalsContact O-N 3.11Å |
| 287 | H | 45.3 | Very low | 57.5 | Low | 131 Ų | 131 | 49.3 Ų | 49.3 | 61% | 0.606 | 29% | 0.294 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -109.5 | 139.1 | 173.8 | -70 | -81.8 | 0 | 0 | 0 | 111.3 | I284 E285 V289 | I284-H287 PolarHBondContact N-O 3.27Å; I284-H287 VanDerWaalsContact N-O 3.17Å; I284-H287 PolarHBondContact O-N 3.4Å; E285-H287 VanDerWaalsContact C-N 3.27Å; E285-H287 PolarHBondContact O-N 3.44Å; H287-V289 PolarHBondContact O-N 3.22Å |
| 288 | N | 49.7 | Very low | 58.6 | Low | 105 Ų | 105 | 49.3 Ų | 49.3 | 56% | 0.561 | 28% | 0.283 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -78.3 | 101.8 | 175.1 | -69.6 | -53.2 | 0 | 0 | 0 | 108.7 | F283 | F283-N288 WeakPolarHBondContact CE1-OD1 3.49Å; F283-N288 WeakPolarHBondContact CZ-OD1 3.39Å |
| 289 | V | 58.1 | Low | 59.9 | Low | 4 Ų | 4 | 49.8 Ų | 49.8 | 2% | 0.024 | 29% | 0.285 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -86.5 | 135.2 | 169.8 | -64.9 | 0 | 0 | 0 | 0 | 109.9 | L282 I284 H287 V294 | L282-V289 HydrophobicContact CB-CG2 4.34Å; L282-V289 PolarHBondContact N-O 2.7Å; L282-V289 WeakPolarHBondContact O-CG2 3.2Å; L282-V289 PolarHBondContact O-N 3.46Å; I284-V289 HydrophobicContact CB-CG1 4.45Å; I284-V289 HydrophobicContact CB-CG2 4.26Å; I284-V289 HydrophobicContact CD1-CG1 4.38Å; I284-V289 HydrophobicContact CD1-CG2 3.48Å; I284-V289 VanDerWaalsContact CD1-CG2 3.48Å; I284-V289 HydrophobicContact CG1-CG2 3.68Å; H287-V289 PolarHBondContact O-N 3.22Å; V289-V294 HydrophobicContact CG2-CG2 4.2Å |
| 290 | G | 60.3 | Low | 61.3 | Low | 35 Ų | 35 | 47 Ų | 47 | 36% | 0.361 | 27% | 0.267 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -68.1 | 156.3 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112 | G292 T293 V294 | G290-G292 PolarHBondContact O-N 3.39Å; G290-T293 PolarHBondContact O-N 2.95Å; G290-T293 VanDerWaalsContact O-N 3.12Å; G290-V294 PolarHBondContact O-N 3.31Å |
| 291 | A | 62.1 | Low | 63.2 | Low | 5 Ų | 5 | 42 Ų | 42 | 4% | 0.041 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -57.8 | -32.6 | 174.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | E273 I278 T293 V294 A295 | E273-A291 HydrophobicContact CG-CB 4.07Å; I278-A291 HydrophobicContact CG2-CB 4.21Å; A291-T293 PolarHBondContact O-N 3.45Å; A291-V294 PolarHBondContact O-N 2.97Å; A291-A295 PolarHBondContact O-N 2.98Å |
| 292 | G | 63.3 | Low | 65 | Low | 12 Ų | 12 | 42.4 Ų | 42.4 | 12% | 0.124 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -57 | -44.4 | 172.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | E273 G290 V294 A295 A296 | E273-G292 PolarHBondContact OE1-N 3.08Å; G290-G292 PolarHBondContact O-N 3.39Å; G292-V294 VanDerWaalsContact C-N 3.31Å; G292-V294 PolarHBondContact O-N 3.43Å; G292-A295 PolarHBondContact O-N 3.28Å; G292-A296 VanDerWaalsContact O-CB 3.28Å; G292-A296 WeakPolarHBondContact O-CB 3.42Å; G292-A296 PolarHBondContact O-N 3.26Å |
| 293 | T | 70.1 | Confident | 66.8 | Low | 30 Ų | 30 | 41.7 Ų | 41.7 | 18% | 0.184 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -64 | -36.8 | 178.4 | -47.6 | 0 | 0 | 0 | 0 | 111.8 | D108 G290 A291 A296 G297 | D108-T293 PolarHBondContact OD1-OG1 3.37Å; G290-T293 PolarHBondContact O-N 2.95Å; G290-T293 VanDerWaalsContact O-N 3.12Å; A291-T293 PolarHBondContact O-N 3.45Å; T293-A296 WeakPolarHBondContact O-CB 3.28Å; T293-G297 PolarHBondContact O-N 3.24Å |
| 294 | V | 72 | Confident | 68.8 | Low | 11 Ų | 11 | 36.5 Ų | 36.5 | 7% | 0.067 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -69.2 | -43.4 | 176.9 | 170.8 | 0 | 0 | 0 | 0 | 111.4 | M42 I278 V289 G290 A291 G292 G297 W298 | M42-V294 HydrophobicContact CE-CB 4.14Å; M42-V294 HydrophobicContact CE-CG1 3.4Å; M42-V294 HydrophobicContact CE-CG2 3.87Å; M42-V294 HydrophobicContact SD-CG1 4.44Å; M42-V294 HydrophobicContact SD-CG2 4.12Å; I278-V294 HydrophobicContact CG2-CB 4.41Å; I278-V294 HydrophobicContact CG2-CG1 4.08Å; V289-V294 HydrophobicContact CG2-CG2 4.2Å; G290-V294 PolarHBondContact O-N 3.31Å; A291-V294 PolarHBondContact O-N 2.97Å; G292-V294 VanDerWaalsContact C-N 3.31Å; G292-V294 PolarHBondContact O-N 3.43Å; V294-G297 PolarHBondContact O-N 3.37Å; V294-W298 PolarHBondContact O-N 2.57Å; V294-W298 VanDerWaalsContact O-N 3.14Å |
| 295 | A | 72.5 | Confident | 70.7 | Confident | 6 Ų | 6 | 38 Ų | 38 | 5% | 0.05 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -61.3 | -46.5 | 176.2 | 0 | 0 | 0 | 0 | 0 | 110.9 | L269 I278 A291 G292 G297 W298 Q299 | L269-A295 HydrophobicContact CB-CB 4.32Å; L269-A295 WeakPolarHBondContact CD1-O 3.43Å; I278-A295 HydrophobicContact CD1-CB 3.82Å; A291-A295 PolarHBondContact O-N 2.98Å; G292-A295 PolarHBondContact O-N 3.28Å; A295-G297 PolarHBondContact O-N 2.87Å; A295-W298 WeakPolarHBondContact O-CB 3.47Å; A295-W298 PolarHBondContact O-N 2.96Å; A295-Q299 PolarHBondContact O-N 3.22Å |
| 296 | A | 74.4 | Confident | 72.8 | Confident | 4 Ų | 4 | 33.7 Ų | 33.7 | 3% | 0.033 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -55.9 | -44.7 | 173 | 0 | 0 | 0 | 0 | 0 | 113.4 | Y111 G292 T293 W298 Q299 N300 | Y111-A296 HydrophobicContact CD1-CB 4.43Å; Y111-A296 HydrophobicContact CD2-CB 4.17Å; Y111-A296 HydrophobicContact CE1-CB 3.73Å; Y111-A296 HydrophobicContact CE2-CB 3.44Å; Y111-A296 VanDerWaalsContact CE2-CB 3.44Å; Y111-A296 VanDerWaalsContact OH-CB 3.28Å; Y111-A296 WeakPolarHBondContact OH-CB 3.28Å; G292-A296 VanDerWaalsContact O-CB 3.28Å; G292-A296 WeakPolarHBondContact O-CB 3.42Å; G292-A296 PolarHBondContact O-N 3.26Å; T293-A296 WeakPolarHBondContact O-CB 3.28Å; A296-W298 VanDerWaalsContact C-N 3.33Å; A296-W298 PolarHBondContact O-N 3.32Å; A296-Q299 WeakPolarHBondContact O-CB 3.34Å; A296-Q299 PolarHBondContact O-N 3.47Å; A296-N300 VanDerWaalsContact O-CG 3.25Å; A296-N300 PolarHBondContact O-N 3Å; A296-N300 PolarHBondContact O-ND2 2.89Å |
| 297 | G | 78.1 | Confident | 75 | Confident | 2 Ų | 2 | 30.7 Ų | 30.7 | 2% | 0.021 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -58.3 | -43.2 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | L102 T293 V294 A295 N300 F301 | L102-G297 VanDerWaalsContact CD2-O 3.23Å; L102-G297 WeakPolarHBondContact CD2-O 3.41Å; T293-G297 PolarHBondContact O-N 3.24Å; V294-G297 PolarHBondContact O-N 3.37Å; A295-G297 PolarHBondContact O-N 2.87Å; G297-N300 PolarHBondContact O-N 3.05Å; G297-F301 PolarHBondContact O-N 2.8Å |
| 298 | W | 80.9 | Confident | 77.2 | Confident | 98 Ų | 98 | 26.4 Ų | 26.4 | 37% | 0.371 | 14% | 0.143 | S | C | . | . | H | α-helix | trans | -64.2 | -40.9 | 174.5 | -86.6 | 106.2 | 0 | 0 | 0 | 112.6 | F43 L44 L269 V294 A295 A296 N300 F301 I302 | F43-W298 AromaticContact CD1-CH2 3.76Å; F43-W298 HydrophobicContact CD1-CH2 3.76Å; F43-W298 HydrophobicContact CD1-CZ2 4.41Å; F43-W298 HydrophobicContact CD1-CZ3 4.35Å; F43-W298 HydrophobicContact CE1-CH2 4.43Å; L44-W298 HydrophobicContact CD1-CB 4.44Å; L44-W298 HydrophobicContact CD1-CD2 4Å; L44-W298 HydrophobicContact CD1-CG 3.76Å; L44-W298 HydrophobicContact CD2-CD2 4.19Å; L44-W298 HydrophobicContact CD2-CE3 4.29Å; L44-W298 HydrophobicContact CG-CD2 4.22Å; L44-W298 HydrophobicContact CG-CG 4.48Å; L44-W298 HydrophobicContact CG-CZ2 4.4Å; L269-W298 HydrophobicContact CD2-CB 4.39Å; V294-W298 PolarHBondContact O-N 2.57Å; V294-W298 VanDerWaalsContact O-N 3.14Å; A295-W298 WeakPolarHBondContact O-CB 3.47Å; A295-W298 PolarHBondContact O-N 2.96Å; A296-W298 VanDerWaalsContact C-N 3.33Å; A296-W298 PolarHBondContact O-N 3.32Å; W298-N300 VanDerWaalsContact C-N 3.35Å; W298-N300 PolarHBondContact O-N 3.33Å; W298-F301 HydrophobicContact CE3-CD1 4.47Å; W298-F301 HydrophobicContact CZ3-CD1 4.35Å; W298-F301 PolarHBondContact O-N 3.27Å; W298-I302 WeakPolarHBondContact O-CG1 2.98Å; W298-I302 PolarHBondContact O-N 2.81Å; W298-I302 VanDerWaalsContact O-N 3.08Å |
| 299 | Q | 83.6 | Confident | 79.1 | Confident | 31 Ų | 31 | 27.2 Ų | 27.2 | 15% | 0.145 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -58.1 | -49.3 | 174.8 | -161.2 | 174.5 | -35.1 | 0 | 0 | 111.1 | Q265 G266 L269 A295 A296 F301 I302 I303 | Q265-Q299 HydrophobicContact CB-CG 4.22Å; G266-Q299 VanDerWaalsContact CA-OE1 3.24Å; L269-Q299 HydrophobicContact CD1-CB 3.43Å; L269-Q299 VanDerWaalsContact CD1-CB 3.43Å; L269-Q299 HydrophobicContact CD1-CG 3.84Å; A295-Q299 PolarHBondContact O-N 3.22Å; A296-Q299 WeakPolarHBondContact O-CB 3.34Å; A296-Q299 PolarHBondContact O-N 3.47Å; Q299-F301 VanDerWaalsContact C-N 3.31Å; Q299-F301 PolarHBondContact O-N 3.44Å; Q299-I302 PolarHBondContact O-N 3.02Å; Q299-I303 HydrophobicContact CG-CD1 3.93Å; Q299-I303 VanDerWaalsContact O-CG1 3.27Å; Q299-I303 WeakPolarHBondContact O-CG1 3.22Å; Q299-I303 PolarHBondContact O-N 3.32Å |
| 300 | N | 85 | Confident | 80.5 | Confident | 0 Ų | 0 | 27.4 Ų | 27.4 | 0% | 0 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -63.2 | -37.8 | -178.4 | -68.4 | -25.9 | 0 | 0 | 0 | 112.1 | S101 L102 R118 A296 G297 W298 I303 C304 | S101-N300 WeakPolarHBondContact CB-ND2 3.31Å; S101-N300 PolarHBondContact OG-ND2 3.14Å; L102-N300 HydrophobicContact CD2-CB 3.96Å; L102-N300 HydrophobicContact CG-CB 3.96Å; R118-N300 VanDerWaalsContact CZ-OD1 3.24Å; R118-N300 PolarHBondContact NH1-OD1 3.44Å; R118-N300 PolarHBondContact NH2-OD1 2.85Å; A296-N300 VanDerWaalsContact O-CG 3.25Å; A296-N300 PolarHBondContact O-N 3Å; A296-N300 PolarHBondContact O-ND2 2.89Å; G297-N300 PolarHBondContact O-N 3.05Å; W298-N300 VanDerWaalsContact C-N 3.35Å; W298-N300 PolarHBondContact O-N 3.33Å; N300-I303 PolarHBondContact O-N 3.2Å; N300-C304 PolarHBondContact O-N 3.11Å; N300-C304 PolarHBondContact O-SG 3.31Å |
| 301 | F | 86.6 | Confident | 81.8 | Confident | 18 Ų | 18 | 25.8 Ų | 25.8 | 8% | 0.079 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -62.5 | -45.1 | 174 | -178.3 | -100.6 | 0 | 0 | 0 | 112.7 | F43 L44 A49 L52 L102 G297 W298 Q299 C304 I305 | F43-F301 HydrophobicContact CE1-CE1 4.09Å; F43-F301 HydrophobicContact CE1-CE2 4.45Å; F43-F301 AromaticContact CE1-CZ 3.89Å; F43-F301 HydrophobicContact CE1-CZ 3.89Å; F43-F301 HydrophobicContact CZ-CZ 4.42Å; L44-F301 HydrophobicContact CD2-CB 3.64Å; L44-F301 HydrophobicContact CD2-CD2 4.37Å; L44-F301 HydrophobicContact CD2-CG 3.97Å; A49-F301 HydrophobicContact CB-CE2 4.12Å; L52-F301 HydrophobicContact CD2-CZ 4.42Å; L102-F301 HydrophobicContact CD1-CB 4.25Å; L102-F301 HydrophobicContact CD1-CD2 4.36Å; L102-F301 HydrophobicContact CD2-CB 4.19Å; G297-F301 PolarHBondContact O-N 2.8Å; W298-F301 HydrophobicContact CE3-CD1 4.47Å; W298-F301 HydrophobicContact CZ3-CD1 4.35Å; W298-F301 PolarHBondContact O-N 3.27Å; Q299-F301 VanDerWaalsContact C-N 3.31Å; Q299-F301 PolarHBondContact O-N 3.44Å; F301-C304 WeakPolarHBondContact O-CB 3.42Å; F301-C304 PolarHBondContact O-N 3.12Å; F301-I305 HydrophobicContact CD1-CD1 4.34Å; F301-I305 HydrophobicContact CE1-CD1 3.73Å; F301-I305 HydrophobicContact CZ-CD1 3.94Å; F301-I305 PolarHBondContact O-N 3.14Å |
| 302 | I | 87.3 | Confident | 83.1 | Confident | 61 Ų | 61 | 28.2 Ų | 28.2 | 31% | 0.313 | 14% | 0.138 | S | C | . | . | H | α-helix | trans | -64.2 | -44.7 | 176.9 | -65.9 | 167.2 | 0 | 0 | 0 | 110.1 | W298 Q299 C304 I305 E306 | W298-I302 WeakPolarHBondContact O-CG1 2.98Å; W298-I302 PolarHBondContact O-N 2.81Å; W298-I302 VanDerWaalsContact O-N 3.08Å; Q299-I302 PolarHBondContact O-N 3.02Å; I302-C304 VanDerWaalsContact C-N 3.3Å; I302-C304 PolarHBondContact O-N 2.85Å; I302-I305 PolarHBondContact O-N 3.33Å; I302-E306 HydrophobicContact CG2-CG 4.1Å; I302-E306 WeakPolarHBondContact O-CG 3.38Å; I302-E306 PolarHBondContact O-N 3.34Å |
| 303 | I | 88 | Confident | 84.2 | Confident | 2 Ų | 2 | 29.3 Ų | 29.3 | 1% | 0.01 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -57.3 | -42.4 | 177.6 | -69.5 | 167.6 | 0 | 0 | 0 | 111.2 | Y94 S98 Q299 N300 I305 E306 M307 | Y94-I303 HydrophobicContact CD1-CG2 4.33Å; S98-I303 WeakPolarHBondContact OG-CG2 3.29Å; Q299-I303 HydrophobicContact CG-CD1 3.93Å; Q299-I303 VanDerWaalsContact O-CG1 3.27Å; Q299-I303 WeakPolarHBondContact O-CG1 3.22Å; Q299-I303 PolarHBondContact O-N 3.32Å; N300-I303 PolarHBondContact O-N 3.2Å; I303-I305 VanDerWaalsContact C-N 3.26Å; I303-I305 PolarHBondContact O-N 3.01Å; I303-E306 PolarHBondContact O-N 3.18Å; I303-M307 HydrophobicContact CG2-CE 4.03Å; I303-M307 HydrophobicContact CG2-CG 3.9Å; I303-M307 WeakPolarHBondContact O-CB 3.21Å; I303-M307 VanDerWaalsContact O-CG 3.24Å; I303-M307 WeakPolarHBondContact O-CG 3.43Å; I303-M307 PolarHBondContact O-N 2.79Å |
| 304 | C | 88.9 | Confident | 84.9 | Confident | 0 Ų | 0 | 28 Ų | 28 | 0% | 0 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -55.6 | -40.5 | 176.6 | -72.5 | 0 | 0 | 0 | 0 | 112.8 | V57 N300 F301 I302 | V57-C304 HydrophobicContact CG2-CB 3.74Å; N300-C304 PolarHBondContact O-N 3.11Å; N300-C304 PolarHBondContact O-SG 3.31Å; F301-C304 WeakPolarHBondContact O-CB 3.42Å; F301-C304 PolarHBondContact O-N 3.12Å; I302-C304 VanDerWaalsContact C-N 3.3Å; I302-C304 PolarHBondContact O-N 2.85Å |
| 305 | I | 89.2 | Confident | 85.5 | Confident | 43 Ų | 43 | 32.3 Ų | 32.3 | 22% | 0.221 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -74.3 | -42.8 | 178.5 | -62.6 | 172.7 | 0 | 0 | 0 | 110.5 | F56 F301 I302 I303 M307 F308 F309 | F56-I305 HydrophobicContact CD2-CG1 4Å; F56-I305 HydrophobicContact CE2-CG1 4.28Å; F56-I305 HydrophobicContact CG-CG1 4.5Å; F301-I305 HydrophobicContact CD1-CD1 4.34Å; F301-I305 HydrophobicContact CE1-CD1 3.73Å; F301-I305 HydrophobicContact CZ-CD1 3.94Å; F301-I305 PolarHBondContact O-N 3.14Å; I302-I305 PolarHBondContact O-N 3.33Å; I303-I305 VanDerWaalsContact C-N 3.26Å; I303-I305 PolarHBondContact O-N 3.01Å; I305-M307 VanDerWaalsContact C-N 3.34Å; I305-M307 PolarHBondContact O-N 3.12Å; I305-F308 WeakPolarHBondContact O-CB 3.46Å; I305-F308 PolarHBondContact O-N 3.24Å; I305-F309 HydrophobicContact CG2-CD2 4.24Å; I305-F309 HydrophobicContact CG2-CE2 3.81Å; I305-F309 WeakPolarHBondContact O-CD2 3.35Å |
| 306 | E | 89.5 | Confident | 86.1 | Confident | 45 Ų | 45 | 40.5 Ų | 40.5 | 21% | 0.21 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -64.8 | -37.8 | -179.4 | -72 | -169.6 | 155 | 0 | 0 | 113 | Q265 I302 I303 F308 F309 A310 | Q265-E306 PolarHBondContact NE2-OE1 3.34Å; Q265-E306 PolarHBondContact NE2-OE2 3Å; I302-E306 HydrophobicContact CG2-CG 4.1Å; I302-E306 WeakPolarHBondContact O-CG 3.38Å; I302-E306 PolarHBondContact O-N 3.34Å; I303-E306 PolarHBondContact O-N 3.18Å; E306-F308 PolarHBondContact O-N 3.17Å; E306-F309 PolarHBondContact O-N 2.93Å; E306-F309 VanDerWaalsContact O-N 3.12Å; E306-A310 WeakPolarHBondContact O-CB 3.34Å; E306-A310 PolarHBondContact O-N 3.45Å |
| 307 | M | 89.9 | Confident | 86.3 | Confident | 1 Ų | 1 | 40.8 Ų | 40.8 | 1% | 0.005 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -61.9 | -28.2 | 178.2 | -71.6 | -56.5 | 129.5 | 0 | 0 | 112.4 | V91 Y94 A95 V258 I303 I305 A311 | V91-M307 HydrophobicContact CG1-CB 4.27Å; V91-M307 HydrophobicContact CG2-SD 4.48Å; Y94-M307 HydrophobicContact CD1-CE 4.03Å; Y94-M307 HydrophobicContact CG-CE 4.31Å; Y94-M307 HydrophobicContact CG-SD 4.35Å; A95-M307 HydrophobicContact CB-CB 3.88Å; A95-M307 HydrophobicContact CB-CG 4.21Å; V258-M307 HydrophobicContact CG1-CE 3.91Å; I303-M307 HydrophobicContact CG2-CE 4.03Å; I303-M307 HydrophobicContact CG2-CG 3.9Å; I303-M307 WeakPolarHBondContact O-CB 3.21Å; I303-M307 VanDerWaalsContact O-CG 3.24Å; I303-M307 WeakPolarHBondContact O-CG 3.43Å; I303-M307 PolarHBondContact O-N 2.79Å; I305-M307 VanDerWaalsContact C-N 3.34Å; I305-M307 PolarHBondContact O-N 3.12Å; M307-A311 WeakPolarHBondContact O-CB 3.31Å; M307-A311 PolarHBondContact O-N 2.97Å |
| 308 | F | 90.8 | Very high | 86.3 | Confident | 41 Ų | 41 | 41 Ų | 41 | 18% | 0.18 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -65.8 | -50 | 171.7 | 172.5 | -107.6 | 0 | 0 | 0 | 112.3 | F56 S59 A60 I63 I305 E306 A310 A311 I312 | F56-F308 HydrophobicContact CB-CB 4.37Å; F56-F308 HydrophobicContact CD1-CB 3.99Å; F56-F308 AromaticContact CD1-CD1 3.83Å; F56-F308 HydrophobicContact CD1-CD1 3.83Å; F56-F308 HydrophobicContact CD1-CE1 4.45Å; F56-F308 AromaticContact CD1-CG 3.86Å; F56-F308 HydrophobicContact CD1-CG 3.86Å; F56-F308 HydrophobicContact CE1-CD1 4.05Å; F56-F308 HydrophobicContact CE1-CE1 4.38Å; S59-F308 WeakPolarHBondContact OG-CD2 3.41Å; S59-F308 VanDerWaalsContact OG-CE2 3.22Å; S59-F308 WeakPolarHBondContact OG-CE2 3.33Å; A60-F308 HydrophobicContact CB-CB 4.32Å; I63-F308 HydrophobicContact CD1-CD2 4.22Å; I63-F308 HydrophobicContact CD1-CE2 3.78Å; I305-F308 WeakPolarHBondContact O-CB 3.46Å; I305-F308 PolarHBondContact O-N 3.24Å; E306-F308 PolarHBondContact O-N 3.17Å; F308-A310 VanDerWaalsContact C-N 3.31Å; F308-A310 PolarHBondContact O-N 3Å; F308-A311 WeakPolarHBondContact O-CB 3.3Å; F308-A311 PolarHBondContact O-N 3.25Å; F308-I312 HydrophobicContact CD1-CD1 4.32Å; F308-I312 HydrophobicContact CE1-CD1 3.75Å; F308-I312 HydrophobicContact CE2-CD1 4.13Å; F308-I312 HydrophobicContact CZ-CD1 3.66Å; F308-I312 PolarHBondContact O-N 3.4Å |
| 309 | F | 89.5 | Confident | 86.1 | Confident | 123 Ų | 123 | 39 Ų | 39 | 54% | 0.539 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -65.6 | -37.1 | 176.7 | -67.1 | -71.2 | 0 | 0 | 0 | 111.7 | I305 E306 A311 I312 A313 | I305-F309 HydrophobicContact CG2-CD2 4.24Å; I305-F309 HydrophobicContact CG2-CE2 3.81Å; I305-F309 WeakPolarHBondContact O-CD2 3.35Å; E306-F309 PolarHBondContact O-N 2.93Å; E306-F309 VanDerWaalsContact O-N 3.12Å; F309-A311 PolarHBondContact O-N 3.2Å; F309-I312 PolarHBondContact O-N 3.38Å; F309-A313 WeakPolarHBondContact O-CB 2.99Å; F309-A313 PolarHBondContact O-N 3.46Å |
| 310 | A | 87.8 | Confident | 85.3 | Confident | 8 Ų | 8 | 38.2 Ų | 38.2 | 7% | 0.066 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -61.6 | -41.1 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | V91 V258 E306 F308 I312 A313 L314 | V91-A310 HydrophobicContact CG2-CB 4.36Å; V258-A310 HydrophobicContact CG2-CB 3.6Å; E306-A310 WeakPolarHBondContact O-CB 3.34Å; E306-A310 PolarHBondContact O-N 3.45Å; F308-A310 VanDerWaalsContact C-N 3.31Å; F308-A310 PolarHBondContact O-N 3Å; A310-I312 VanDerWaalsContact C-N 3.3Å; A310-I312 PolarHBondContact O-N 3.23Å; A310-A313 PolarHBondContact O-N 3.25Å; A310-L314 VanDerWaalsContact O-CB 3.3Å; A310-L314 WeakPolarHBondContact O-CB 3.31Å; A310-L314 WeakPolarHBondContact O-CG 3.19Å; A310-L314 PolarHBondContact O-N 3.3Å |
| 311 | A | 89.1 | Confident | 84.6 | Confident | 0 Ų | 0 | 41.6 Ų | 41.6 | 0% | 0 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -58.7 | -43 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | A60 I63 V91 M307 F308 F309 R315 | A60-A311 HydrophobicContact CB-CB 4.26Å; I63-A311 HydrophobicContact CB-CB 4.29Å; I63-A311 HydrophobicContact CG2-CB 4.02Å; V91-A311 HydrophobicContact CG1-CB 3.94Å; M307-A311 WeakPolarHBondContact O-CB 3.31Å; M307-A311 PolarHBondContact O-N 2.97Å; F308-A311 WeakPolarHBondContact O-CB 3.3Å; F308-A311 PolarHBondContact O-N 3.25Å; F309-A311 PolarHBondContact O-N 3.2Å; A311-R315 WeakPolarHBondContact O-CB 3.35Å; A311-R315 PolarHBondContact O-N 3.42Å |
| 312 | I | 88.8 | Confident | 83.9 | Confident | 56 Ų | 56 | 45.3 Ų | 45.3 | 29% | 0.287 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -66.4 | -46.7 | 176.7 | -63.6 | 170.4 | 0 | 0 | 0 | 110.3 | I63 F308 F309 A310 R315 Y316 | I63-I312 HydrophobicContact CD1-CG1 4.05Å; F308-I312 HydrophobicContact CD1-CD1 4.32Å; F308-I312 HydrophobicContact CE1-CD1 3.75Å; F308-I312 HydrophobicContact CE2-CD1 4.13Å; F308-I312 HydrophobicContact CZ-CD1 3.66Å; F308-I312 PolarHBondContact O-N 3.4Å; F309-I312 PolarHBondContact O-N 3.38Å; A310-I312 VanDerWaalsContact C-N 3.3Å; A310-I312 PolarHBondContact O-N 3.23Å; I312-R315 WeakPolarHBondContact O-CB 3.12Å; I312-R315 PolarHBondContact O-N 3.45Å; I312-Y316 HydrophobicContact CG2-CD2 3.94Å; I312-Y316 HydrophobicContact CG2-CE2 3.59Å; I312-Y316 WeakPolarHBondContact O-CD2 3.48Å; I312-Y316 PolarHBondContact O-N 3.45Å |
| 313 | A | 86.1 | Confident | 83 | Confident | 35 Ų | 35 | 43.3 Ų | 43.3 | 29% | 0.289 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -62.6 | -44.1 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | T254 F309 A310 R315 Y316 A317 | T254-A313 HydrophobicContact CG2-CB 3.67Å; F309-A313 WeakPolarHBondContact O-CB 2.99Å; F309-A313 PolarHBondContact O-N 3.46Å; A310-A313 PolarHBondContact O-N 3.25Å; A313-R315 VanDerWaalsContact C-N 3.27Å; A313-R315 PolarHBondContact O-N 3.42Å; A313-Y316 PolarHBondContact O-N 2.93Å; A313-Y316 VanDerWaalsContact O-N 3.16Å; A313-A317 WeakPolarHBondContact O-CB 3.23Å; A313-A317 PolarHBondContact O-N 3.43Å |
| 314 | L | 84.7 | Confident | 81.9 | Confident | 4 Ų | 4 | 46.8 Ų | 46.8 | 2% | 0.021 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -64.7 | -30.9 | 175.7 | -75.4 | 167.3 | 0 | 0 | 0 | 112.2 | Q67 I87 I90 V91 T254 I255 A310 F318 | Q67-L314 PolarHBondContact NE2-O 3.06Å; I87-L314 HydrophobicContact CG2-CD2 4.46Å; I90-L314 HydrophobicContact CG2-CD1 4.14Å; V91-L314 HydrophobicContact CG2-CD1 3.42Å; V91-L314 VanDerWaalsContact CG2-CD1 3.42Å; T254-L314 HydrophobicContact CG2-CD2 3.94Å; T254-L314 HydrophobicContact CG2-CG 4.03Å; I255-L314 HydrophobicContact CG1-CD2 4.17Å; A310-L314 VanDerWaalsContact O-CB 3.3Å; A310-L314 WeakPolarHBondContact O-CB 3.31Å; A310-L314 WeakPolarHBondContact O-CG 3.19Å; A310-L314 PolarHBondContact O-N 3.3Å; L314-F318 HydrophobicContact CD2-CD2 3.87Å; L314-F318 HydrophobicContact CD2-CE2 3.75Å; L314-F318 WeakPolarHBondContact O-CB 3.35Å; L314-F318 PolarHBondContact O-N 3.46Å |
| 315 | R | 85.7 | Confident | 80.5 | Confident | 100 Ų | 100 | 54.3 Ų | 54.3 | 38% | 0.377 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -63.1 | -42.8 | 171.7 | -170.5 | 178.8 | -179.1 | 108.5 | -4 | 112.4 | H66 A311 I312 A313 | H66-R315 PolarHBondContact ND1-NH1 3.26Å; H66-R315 VanDerWaalsContact ND1-NH1 3.14Å; A311-R315 WeakPolarHBondContact O-CB 3.35Å; A311-R315 PolarHBondContact O-N 3.42Å; I312-R315 WeakPolarHBondContact O-CB 3.12Å; I312-R315 PolarHBondContact O-N 3.45Å; A313-R315 VanDerWaalsContact C-N 3.27Å; A313-R315 PolarHBondContact O-N 3.42Å |
| 316 | Y | 83.1 | Confident | 79 | Confident | 178 Ų | 178 | 58.2 Ų | 58.2 | 70% | 0.698 | 28% | 0.281 | S | S | * | . | H | α-helix | trans | -72.9 | -44.9 | 176.4 | -72.8 | -67.1 | 0 | 0 | 0 | 112 | I312 A313 F318 T319 | I312-Y316 HydrophobicContact CG2-CD2 3.94Å; I312-Y316 HydrophobicContact CG2-CE2 3.59Å; I312-Y316 WeakPolarHBondContact O-CD2 3.48Å; I312-Y316 PolarHBondContact O-N 3.45Å; A313-Y316 PolarHBondContact O-N 2.93Å; A313-Y316 VanDerWaalsContact O-N 3.16Å; Y316-F318 PolarHBondContact O-N 3.2Å; Y316-T319 PolarHBondContact O-OG1 2.98Å |
| 317 | A | 80.3 | Confident | 77.3 | Confident | 11 Ų | 11 | 59.8 Ų | 59.8 | 9% | 0.091 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -61.9 | -41.4 | -179.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | K251 T254 A313 | K251-A317 WeakPolarHBondContact CE-O 3.48Å; K251-A317 HydrophobicContact CG-CB 4.1Å; K251-A317 VanDerWaalsContact CG-O 3.27Å; K251-A317 WeakPolarHBondContact CG-O 3.36Å; T254-A317 HydrophobicContact CG2-CB 4.39Å; A313-A317 WeakPolarHBondContact O-CB 3.23Å; A313-A317 PolarHBondContact O-N 3.43Å |
| 318 | F | 77.4 | Confident | 75.6 | Confident | 5 Ų | 5 | 66.2 Ų | 66.2 | 2% | 0.022 | 33% | 0.326 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -113.3 | 64.5 | -179.3 | -63.3 | -73.7 | 0 | 0 | 0 | 111.9 | Q67 H71 I84 I87 L88 L132 K251 I255 L314 Y316 C320 | Q67-F318 PolarHBondContact NE2-O 2.87Å; Q67-F318 VanDerWaalsContact NE2-O 3.15Å; H71-F318 PolarHBondContact NE2-O 3.09Å; H71-F318 VanDerWaalsContact NE2-O 3.13Å; I84-F318 HydrophobicContact CD1-CD1 4.29Å; I84-F318 HydrophobicContact CG1-CD1 3.91Å; I84-F318 HydrophobicContact CG1-CE1 4.16Å; I84-F318 HydrophobicContact CG2-CB 3.96Å; I84-F318 HydrophobicContact CG2-CD1 3.93Å; I84-F318 HydrophobicContact CG2-CG 4Å; I87-F318 HydrophobicContact CG2-CE2 4.31Å; L88-F318 HydrophobicContact CD1-CB 4.2Å; L88-F318 HydrophobicContact CD1-CD2 4.07Å; L88-F318 HydrophobicContact CD1-CG 4.26Å; L132-F318 HydrophobicContact CD2-CE1 3.83Å; L132-F318 HydrophobicContact CD2-CZ 4.37Å; K251-F318 HydrophobicContact CB-CE1 4.39Å; K251-F318 HydrophobicContact CB-CZ 4.14Å; K251-F318 HydrophobicContact CD-CD1 4.47Å; K251-F318 HydrophobicContact CD-CE1 4.08Å; K251-F318 HydrophobicContact CG-CE1 4.11Å; K251-F318 HydrophobicContact CG-CZ 4.24Å; I255-F318 HydrophobicContact CD1-CE2 3.78Å; I255-F318 HydrophobicContact CD1-CZ 3.64Å; I255-F318 HydrophobicContact CG1-CE2 4.23Å; L314-F318 HydrophobicContact CD2-CD2 3.87Å; L314-F318 HydrophobicContact CD2-CE2 3.75Å; L314-F318 WeakPolarHBondContact O-CB 3.35Å; L314-F318 PolarHBondContact O-N 3.46Å; Y316-F318 PolarHBondContact O-N 3.2Å; F318-C320 PolarHBondContact O-N 3.39Å |
| 319 | T | 77.7 | Confident | 73.8 | Confident | 57 Ų | 57 | 69 Ų | 69 | 35% | 0.35 | 35% | 0.345 | S | S | . | . | trans | -67.5 | 123.9 | -179 | -65.7 | 0 | 0 | 0 | 0 | 111.9 | Y316 T321 | Y316-T319 PolarHBondContact O-OG1 2.98Å; T319-T321 VanDerWaalsContact C-N 3.28Å; T319-T321 HydrophobicContact CG2-CG2 3.88Å; T319-T321 WeakPolarHBondContact CG2-OG1 3.49Å; T319-T321 PolarHBondContact O-N 3.27Å | ||
| 320 | C | 66.5 | Low | 71.8 | Confident | 14 Ų | 14 | 69 Ų | 69 | 10% | 0.095 | 36% | 0.358 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -71.5 | -16.2 | -179 | -47.6 | 0 | 0 | 0 | 0 | 114.4 | T70 H71 F318 V322 Y323 Q324 | T70-C320 HydrophobicContact CG2-CB 3.62Å; H71-C320 PolarHBondContact CD2-SG 3.38Å; H71-C320 PolarHBondContact CE1-SG 2.79Å; H71-C320 PolarHBondContact NE2-SG 3.38Å; F318-C320 PolarHBondContact O-N 3.39Å; C320-V322 PolarHBondContact O-N 3.45Å; C320-Y323 PolarHBondContact O-N 3.38Å; C320-Y323 VanDerWaalsContact O-N 3.1Å; C320-Q324 PolarHBondContact O-N 3.4Å; C320-Q324 VanDerWaalsContact O-N 3.12Å |
| 321 | T | 69.3 | Low | 69.8 | Low | 71 Ų | 71 | 76.6 Ų | 76.6 | 44% | 0.436 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -64.6 | -25.5 | -174.2 | 63.5 | 0 | 0 | 0 | 0 | 112.9 | T319 Y323 Q324 K325 | T319-T321 VanDerWaalsContact C-N 3.28Å; T319-T321 HydrophobicContact CG2-CG2 3.88Å; T319-T321 WeakPolarHBondContact CG2-OG1 3.49Å; T319-T321 PolarHBondContact O-N 3.27Å; T321-Y323 VanDerWaalsContact C-N 3.32Å; T321-Y323 PolarHBondContact O-N 3.31Å; T321-Q324 PolarHBondContact O-N 3.26Å; T321-K325 PolarHBondContact O-N 2.92Å |
| 322 | V | 72.1 | Confident | 67.7 | Low | 97 Ų | 97 | 84.6 Ų | 84.6 | 59% | 0.588 | 44% | 0.435 | S | S | * | . | H | α-helix | trans | -62.8 | -40.6 | 174.8 | -175.9 | 0 | 0 | 0 | 0 | 110.8 | C320 | C320-V322 PolarHBondContact O-N 3.45Å |
| 323 | Y | 68.9 | Low | 65.8 | Low | 18 Ų | 18 | 88.2 Ų | 88.2 | 7% | 0.071 | 45% | 0.454 | C | S | . | . | H | α-helix | trans | -83 | -23.3 | 179.8 | -59.5 | -71.5 | 0 | 0 | 0 | 112.9 | T76 V77 E80 Q81 I84 C320 T321 N327 | T76-Y323 PolarHBondContact OG1-O 3.48Å; V77-Y323 HydrophobicContact CB-CD1 4.31Å; V77-Y323 HydrophobicContact CB-CE1 4.1Å; V77-Y323 HydrophobicContact CG2-CD1 4.17Å; V77-Y323 HydrophobicContact CG2-CE1 4.21Å; E80-Y323 WeakPolarHBondContact OE2-CE1 3.25Å; E80-Y323 PolarHBondContact OE2-OH 3.12Å; Q81-Y323 HydrophobicContact CG-CD1 3.99Å; Q81-Y323 HydrophobicContact CG-CD2 4.26Å; Q81-Y323 HydrophobicContact CG-CE1 3.95Å; Q81-Y323 HydrophobicContact CG-CE2 4.22Å; Q81-Y323 HydrophobicContact CG-CG 4.16Å; I84-Y323 HydrophobicContact CD1-CE2 3.96Å; I84-Y323 WeakPolarHBondContact CD1-OH 3.37Å; C320-Y323 PolarHBondContact O-N 3.38Å; C320-Y323 VanDerWaalsContact O-N 3.1Å; T321-Y323 VanDerWaalsContact C-N 3.32Å; T321-Y323 PolarHBondContact O-N 3.31Å; Y323-N327 PolarHBondContact O-ND2 3.18Å; Y323-N327 VanDerWaalsContact O-ND2 3.1Å |
| 324 | Q | 64.3 | Low | 63.8 | Low | 75 Ų | 75 | 92 Ų | 92 | 35% | 0.35 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -68.5 | -46.1 | 173.4 | -77 | 173.4 | -5.1 | 0 | 0 | 111.9 | T70 S74 C320 T321 K326 N327 | T70-Q324 VanDerWaalsContact CG2-NE2 3.27Å; S74-Q324 WeakPolarHBondContact OG-CG 3.26Å; C320-Q324 PolarHBondContact O-N 3.4Å; C320-Q324 VanDerWaalsContact O-N 3.12Å; T321-Q324 PolarHBondContact O-N 3.26Å; Q324-K326 PolarHBondContact O-N 3.26Å; Q324-N327 WeakPolarHBondContact O-CB 3.4Å; Q324-N327 PolarHBondContact O-N 3.37Å |
| 325 | K | 60.3 | Low | 62.2 | Low | 158 Ų | 158 | 97.5 Ų | 97.5 | 69% | 0.687 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -62.1 | -26.1 | 178.1 | -72.3 | -179.4 | 179.3 | 179.8 | 0 | 113.5 | T321 D328 | T321-K325 PolarHBondContact O-N 2.92Å; K325-D328 PolarHBondContact O-N 3.33Å |
| 326 | K | 57.9 | Low | 60.5 | Low | 125 Ų | 125 | 95.8 Ų | 95.8 | 54% | 0.543 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -75.6 | -24.6 | 176.9 | -157.4 | 173.4 | -179.8 | -179 | 0 | 112.5 | V77 Q324 D328 V329 | V77-K326 HydrophobicContact CG2-CD 3.86Å; Q324-K326 PolarHBondContact O-N 3.26Å; K326-D328 VanDerWaalsContact C-N 3.3Å; K326-V329 PolarHBondContact O-N 3.34Å |
| 327 | N | 52.9 | Low | 59.1 | Low | 78 Ų | 78 | 96 Ų | 96 | 42% | 0.417 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -71 | -22.3 | 172.6 | -81 | -71 | 0 | 0 | 0 | 113.3 | S74 T76 Y323 Q324 V329 | S74-N327 WeakPolarHBondContact CB-ND2 3.29Å; T76-N327 HydrophobicContact CG2-CB 4.08Å; T76-N327 WeakPolarHBondContact CG2-ND2 3.07Å; T76-N327 WeakPolarHBondContact CG2-OD1 3.27Å; Y323-N327 PolarHBondContact O-ND2 3.18Å; Y323-N327 VanDerWaalsContact O-ND2 3.1Å; Q324-N327 WeakPolarHBondContact O-CB 3.4Å; Q324-N327 PolarHBondContact O-N 3.37Å; N327-V329 PolarHBondContact O-N 2.86Å |
| 328 | D | 54.3 | Low | 58.2 | Low | 137 Ų | 137 | 98.9 Ų | 98.9 | 73% | 0.733 | 54% | 0.536 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.4 | -7.4 | 179.4 | -67.2 | -39.1 | 0 | 0 | 0 | 112.4 | K325 K326 | K325-D328 PolarHBondContact O-N 3.33Å; K326-D328 VanDerWaalsContact C-N 3.3Å |
| 329 | V | 53.2 | Low | 57.7 | Low | 98 Ų | 98 | 102.5 Ų | 102.5 | 59% | 0.594 | 55% | 0.554 | S | S | * | * | S | Bend | trans | -89.2 | 115.3 | 167.6 | -175.5 | 0 | 0 | 0 | 0 | 107.7 | K326 N327 E331 | K326-V329 PolarHBondContact O-N 3.34Å; N327-V329 PolarHBondContact O-N 2.86Å; V329-E331 PolarHBondContact O-N 3.44Å |
| 330 | P | 47.3 | Very low | 57.2 | Low | 125 Ų | 125 | 103.7 Ų | 103.7 | 81% | 0.812 | 57% | 0.565 | S | S | * | * | trans | -77 | 94.3 | -174.2 | 30.1 | -31.4 | 0 | 0 | 0 | 109.8 | ||||
| 331 | E | 46.3 | Very low | 57 | Low | 167 Ų | 167 | 105.3 Ų | 105.3 | 78% | 0.78 | 58% | 0.576 | S | S | * | * | trans | -114 | 129.4 | 164.2 | -149.6 | 168.9 | -161.1 | 0 | 0 | 108.6 | V329 L333 | V329-E331 PolarHBondContact O-N 3.44Å; E331-L333 PolarHBondContact O-N 3.42Å | ||
| 332 | N | 44.7 | Very low | 56.8 | Low | 168 Ų | 168 | 102 Ų | 102 | 90% | 0.898 | 56% | 0.556 | S | S | * | * | trans | -67.3 | 61.1 | -168.1 | -71.2 | -59.4 | 0 | 0 | 0 | 113.6 | ||||
| 333 | L | 49 | Very low | 56.9 | Low | 132 Ų | 132 | 99.9 Ų | 99.9 | 69% | 0.691 | 54% | 0.541 | S | S | * | . | P | Polyproline II helix | trans | -91.7 | 132.2 | 165.4 | -94.3 | 82.2 | 0 | 0 | 0 | 110 | E331 | E331-L333 PolarHBondContact O-N 3.42Š|
| 334 | P | 44.8 | Very low | 57.1 | Low | 114 Ų | 114 | 107 Ų | 107 | 74% | 0.74 | 57% | 0.573 | S | S | * | * | P | Polyproline II helix | trans | -62.3 | 129.7 | 174.2 | 25.5 | -31 | 0 | 0 | 0 | 108.8 | M336 | P334-M336 PolarHBondContact O-N 3.45Š|
| 335 | P | 50.3 | Low | 57.3 | Low | 120 Ų | 120 | 109 Ų | 109 | 78% | 0.779 | 58% | 0.582 | S | S | * | * | P | Polyproline II helix | trans | -56.5 | 133.3 | 169.8 | 24.1 | -31.5 | 0 | 0 | 0 | 107.9 | Q337 | P335-Q337 PolarHBondContact O-N 2.94Š|
| 336 | M | 50.9 | Low | 57.5 | Low | 63 Ų | 63 | 101.4 Ų | 101.4 | 31% | 0.31 | 55% | 0.549 | S | S | . | . | trans | -36.2 | 131.3 | -177.5 | -97.8 | 169.6 | 40.3 | 0 | 0 | 113.3 | Y75 P334 S338 | Y75-M336 HydrophobicContact CD1-SD 3.66Å; Y75-M336 HydrophobicContact CE1-SD 4.18Å; Y75-M336 HydrophobicContact CG-SD 4.05Å; P334-M336 PolarHBondContact O-N 3.45Å; M336-S338 VanDerWaalsContact C-N 3.33Å; M336-S338 PolarHBondContact O-N 3.43Å | ||
| 337 | Q | 53.8 | Low | 58.2 | Low | 183 Ų | 183 | 99.1 Ų | 99.1 | 86% | 0.855 | 54% | 0.542 | S | S | * | . | S | Bend | trans | -66.3 | 92.7 | 165.2 | -69.7 | -173.7 | -15 | 0 | 0 | 108.8 | P335 S341 | P335-Q337 PolarHBondContact O-N 2.94Å; Q337-S341 WeakPolarHBondContact O-CB 3.25Å |
| 338 | S | 60 | Low | 59.2 | Low | 71 Ų | 71 | 99.5 Ų | 99.5 | 50% | 0.497 | 54% | 0.544 | S | S | . | . | trans | 67.3 | 128.8 | -178.4 | -169.2 | 0 | 0 | 0 | 0 | 116.3 | M336 S340 S341 G342 | M336-S338 VanDerWaalsContact C-N 3.33Å; M336-S338 PolarHBondContact O-N 3.43Å; S338-S340 PolarHBondContact O-N 3.02Å; S338-S340 VanDerWaalsContact O-N 3.09Å; S338-S340 PolarHBondContact OG-N 3.24Å; S338-S340 PolarHBondContact OG-OG 3.17Å; S338-S341 PolarHBondContact O-N 3.26Å; S338-G342 PolarHBondContact O-N 3.11Å | ||
| 339 | I | 66.6 | Low | 60.2 | Low | 81 Ų | 81 | 96 Ų | 96 | 42% | 0.415 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -52.3 | -32.3 | 173.1 | -62.5 | 172.7 | 0 | 0 | 0 | 111.4 | Y69 L72 L343 | Y69-I339 HydrophobicContact CE2-CD1 3.96Å; L72-I339 HydrophobicContact CB-CG2 4.31Å; L72-I339 HydrophobicContact CD1-CG2 3.88Å; I339-L343 WeakPolarHBondContact O-CB 3.12Å; I339-L343 PolarHBondContact O-N 2.97Å |
| 340 | S | 67.1 | Low | 61 | Low | 82 Ų | 82 | 92.7 Ų | 92.7 | 57% | 0.573 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -68.1 | -34.1 | 177.5 | 67.4 | 0 | 0 | 0 | 0 | 113.4 | S338 K344 | S338-S340 PolarHBondContact O-N 3.02Å; S338-S340 VanDerWaalsContact O-N 3.09Å; S338-S340 PolarHBondContact OG-N 3.24Å; S338-S340 PolarHBondContact OG-OG 3.17Å; S340-K344 WeakPolarHBondContact O-CB 3.5Å; S340-K344 PolarHBondContact O-N 3.15Å |
| 341 | S | 63.4 | Low | 62.3 | Low | 48 Ų | 48 | 88.1 Ų | 88.1 | 34% | 0.336 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -69.7 | -47.2 | 179.5 | -159.4 | 0 | 0 | 0 | 0 | 110.4 | Q337 S338 L343 K344 E345 | Q337-S341 WeakPolarHBondContact O-CB 3.25Å; S338-S341 PolarHBondContact O-N 3.26Å; S341-L343 VanDerWaalsContact C-N 3.3Å; S341-L343 PolarHBondContact O-N 2.95Å; S341-K344 PolarHBondContact O-N 3.34Å; S341-K344 VanDerWaalsContact O-N 3.15Å; S341-E345 WeakPolarHBondContact O-CG 3.2Å; S341-E345 PolarHBondContact O-N 2.74Å |
| 342 | G | 65.6 | Low | 63.7 | Low | 1 Ų | 1 | 82.1 Ų | 82.1 | 1% | 0.01 | 46% | 0.456 | C | S | . | . | H | α-helix | trans | -68.2 | -28.9 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | S338 T346 | S338-G342 PolarHBondContact O-N 3.11Å; G342-T346 WeakPolarHBondContact O-CB 3.28Å; G342-T346 PolarHBondContact O-N 3.01Å; G342-T346 PolarHBondContact O-OG1 3.33Å |
| 343 | L | 72.7 | Confident | 65.2 | Low | 53 Ų | 53 | 77.9 Ų | 77.9 | 28% | 0.277 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -65 | -44.5 | 170 | -174.4 | 62.5 | 0 | 0 | 0 | 111.8 | L72 F89 I339 S341 T346 I347 | L72-L343 HydrophobicContact CD1-CD1 4.21Å; F89-L343 HydrophobicContact CE2-CD1 3.81Å; F89-L343 HydrophobicContact CZ-CD1 3.8Å; I339-L343 WeakPolarHBondContact O-CB 3.12Å; I339-L343 PolarHBondContact O-N 2.97Å; S341-L343 VanDerWaalsContact C-N 3.3Å; S341-L343 PolarHBondContact O-N 2.95Å; L343-T346 PolarHBondContact O-N 3.4Å; L343-I347 HydrophobicContact CD1-CD1 3.63Å; L343-I347 HydrophobicContact CD1-CG1 4.15Å; L343-I347 HydrophobicContact CD2-CD1 4.44Å; L343-I347 HydrophobicContact CG-CD1 3.76Å; L343-I347 WeakPolarHBondContact O-CB 3.37Å; L343-I347 VanDerWaalsContact O-CG1 3.31Å; L343-I347 WeakPolarHBondContact O-CG1 3.4Å; L343-I347 PolarHBondContact O-N 2.93Å |
| 344 | K | 73.6 | Confident | 66.4 | Low | 167 Ų | 167 | 78.2 Ų | 78.2 | 73% | 0.726 | 43% | 0.434 | S | S | * | . | H | α-helix | trans | -63 | -45.2 | 178.1 | -177.9 | -178.6 | 176 | -175.1 | 0 | 111.9 | S340 S341 T346 I347 N348 | S340-K344 WeakPolarHBondContact O-CB 3.5Å; S340-K344 PolarHBondContact O-N 3.15Å; S341-K344 PolarHBondContact O-N 3.34Å; S341-K344 VanDerWaalsContact O-N 3.15Å; K344-T346 VanDerWaalsContact C-N 3.31Å; K344-I347 PolarHBondContact O-N 3.42Å; K344-N348 PolarHBondContact O-N 2.85Å |
| 345 | E | 67.9 | Low | 67.6 | Low | 117 Ų | 117 | 74.3 Ų | 74.3 | 55% | 0.547 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -63.4 | -40.4 | 175.5 | -74 | 170.1 | -163.1 | 0 | 0 | 111.3 | R82 S341 I347 | R82-E345 PolarHBondContact NE-O 2.91Å; R82-E345 VanDerWaalsContact NE-O 3.13Å; R82-E345 PolarHBondContact NH2-O 2.81Å; S341-E345 WeakPolarHBondContact O-CG 3.2Å; S341-E345 PolarHBondContact O-N 2.74Å; E345-I347 PolarHBondContact O-N 3.38Å |
| 346 | T | 65.3 | Low | 68.6 | Low | 0 Ų | 0 | 70 Ų | 70 | 0% | 0 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -64.5 | -39.3 | 178 | -67 | 0 | 0 | 0 | 0 | 112.1 | Y75 R82 I85 R86 G342 L343 K344 | Y75-T346 PolarHBondContact OH-OG1 3.42Å; R82-T346 HydrophobicContact CB-CG2 4.36Å; R82-T346 HydrophobicContact CG-CG2 4.08Å; I85-T346 HydrophobicContact CB-CG2 3.67Å; I85-T346 HydrophobicContact CD1-CG2 4.08Å; I85-T346 HydrophobicContact CG1-CG2 4.5Å; I85-T346 HydrophobicContact CG2-CG2 3.56Å; R86-T346 PolarHBondContact NE-O 3.2Å; R86-T346 PolarHBondContact NH2-O 3.48Å; G342-T346 WeakPolarHBondContact O-CB 3.28Å; G342-T346 PolarHBondContact O-N 3.01Å; G342-T346 PolarHBondContact O-OG1 3.33Å; L343-T346 PolarHBondContact O-N 3.4Å; K344-T346 VanDerWaalsContact C-N 3.31Å |
| 347 | I | 71.9 | Confident | 69.8 | Low | 76 Ų | 76 | 72.3 Ų | 72.3 | 39% | 0.39 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -83.1 | -16.1 | -175.3 | -67.3 | 173.8 | 0 | 0 | 0 | 113.2 | F89 L343 K344 E345 P349 | F89-I347 HydrophobicContact CE2-CD1 3.82Å; F89-I347 HydrophobicContact CE2-CG1 4.13Å; F89-I347 HydrophobicContact CZ-CD1 3.99Å; L343-I347 HydrophobicContact CD1-CD1 3.63Å; L343-I347 HydrophobicContact CD1-CG1 4.15Å; L343-I347 HydrophobicContact CD2-CD1 4.44Å; L343-I347 HydrophobicContact CG-CD1 3.76Å; L343-I347 WeakPolarHBondContact O-CB 3.37Å; L343-I347 VanDerWaalsContact O-CG1 3.31Å; L343-I347 WeakPolarHBondContact O-CG1 3.4Å; L343-I347 PolarHBondContact O-N 2.93Å; K344-I347 PolarHBondContact O-N 3.42Å; E345-I347 PolarHBondContact O-N 3.38Å; I347-P349 WeakPolarHBondContact O-CD 3.39Å |
| 348 | N | 75.5 | Confident | 70.7 | Confident | 87 Ų | 87 | 66.5 Ų | 66.5 | 47% | 0.465 | 37% | 0.366 | S | S | . | . | trans | -59.7 | 119 | -176.9 | -176.5 | -5 | 0 | 0 | 0 | 112.3 | R82 R86 K344 G350 | R82-N348 PolarHBondContact NH2-O 2.83Å; R86-N348 PolarHBondContact NH2-O 2.92Å; K344-N348 PolarHBondContact O-N 2.85Å; N348-G350 PolarHBondContact O-N 3.23Å; N348-G350 PolarHBondContact OD1-N 3.24Å | ||
| 349 | P | 74.7 | Confident | 71 | Confident | 64 Ų | 64 | 63.7 Ų | 63.7 | 42% | 0.416 | 35% | 0.346 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -75.3 | 3.6 | -179 | 32.5 | -37.2 | 0 | 0 | 0 | 114.2 | F124 I347 D351 M352 V353 | F124-P349 HydrophobicContact CE2-CB 4.21Å; I347-P349 WeakPolarHBondContact O-CD 3.39Å; P349-D351 PolarHBondContact O-N 2.9Å; P349-D351 VanDerWaalsContact O-N 3.1Å; P349-M352 WeakPolarHBondContact O-CB 3.24Å; P349-M352 PolarHBondContact O-N 2.75Å; P349-V353 PolarHBondContact O-N 3.13Å |
| 350 | G | 70.5 | Confident | 71.3 | Confident | 28 Ų | 28 | 65.3 Ų | 65.3 | 29% | 0.289 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -50 | -35.9 | -177.2 | 0 | 0 | 0 | 0 | 0 | 114.8 | N348 M352 V353 Q354 | N348-G350 PolarHBondContact O-N 3.23Å; N348-G350 PolarHBondContact OD1-N 3.24Å; G350-M352 VanDerWaalsContact C-N 3.32Å; G350-M352 PolarHBondContact O-N 3.37Å; G350-V353 PolarHBondContact O-N 3.35Å; G350-Q354 PolarHBondContact O-N 3.15Å |
| 351 | D | 73.6 | Confident | 71.2 | Confident | 29 Ų | 29 | 63.2 Ų | 63.2 | 16% | 0.155 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -64.6 | -37.7 | 179.7 | -30.6 | -46.8 | 0 | 0 | 0 | 111.9 | R82 R86 Y127 P349 V353 Q354 D355 | R82-D351 VanDerWaalsContact CZ-CG 3.42Å; R82-D351 IonicContact CZ-OD1 2.99Å; R82-D351 IonicContact CZ-OD2 2.97Å; R82-D351 IonicContact NE-OD2 2.77Å; R82-D351 IonicContact NH1-OD1 3.5Å; R82-D351 PolarHBondContact NH1-OD1 3.27Å; R82-D351 IonicContact NH1-OD2 2.83Å; R82-D351 PolarHBondContact NH1-OD2 3.07Å; R82-D351 IonicContact NH2-OD1 3.55Å; R82-D351 PolarHBondContact NH2-OD1 3.46Å; R82-D351 IonicContact NH2-OD2 2.86Å; R82-D351 PolarHBondContact NH2-OD2 3.3Å; R86-D351 IonicContact CZ-OD2 3.3Å; R86-D351 VanDerWaalsContact CZ-OD2 3.3Å; R86-D351 IonicContact NH1-OD2 2.93Å; R86-D351 PolarHBondContact NH1-OD2 2.79Å; R86-D351 IonicContact NH2-OD2 2.73Å; R86-D351 PolarHBondContact NH2-OD2 3.12Å; Y127-D351 PolarHBondContact OH-O 3.47Å; P349-D351 PolarHBondContact O-N 2.9Å; P349-D351 VanDerWaalsContact O-N 3.1Å; D351-V353 VanDerWaalsContact C-N 3.3Å; D351-V353 PolarHBondContact O-N 3.21Å; D351-Q354 PolarHBondContact O-N 3.05Å; D351-D355 WeakPolarHBondContact O-CB 3.3Å; D351-D355 PolarHBondContact O-N 3.43Å |
| 352 | M | 76.1 | Confident | 70.6 | Confident | 41 Ų | 41 | 65.9 Ų | 65.9 | 20% | 0.202 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -63.6 | -40.3 | 178.1 | -173.7 | -179.2 | 66.2 | 0 | 0 | 111.1 | F124 Y127 L181 C184 P349 G350 A356 | F124-M352 HydrophobicContact CD2-CE 4.44Å; F124-M352 HydrophobicContact CD2-SD 4.01Å; Y127-M352 HydrophobicContact CD1-CB 3.97Å; Y127-M352 HydrophobicContact CD1-CG 3.82Å; Y127-M352 HydrophobicContact CD1-SD 4.07Å; Y127-M352 HydrophobicContact CD2-CG 4.1Å; Y127-M352 HydrophobicContact CE1-CB 3.52Å; Y127-M352 HydrophobicContact CE1-CG 3.81Å; Y127-M352 HydrophobicContact CE2-CB 4.38Å; Y127-M352 HydrophobicContact CE2-CG 4.08Å; Y127-M352 HydrophobicContact CG-CG 3.98Å; Y127-M352 HydrophobicContact CG-SD 4.2Å; Y127-M352 VanDerWaalsContact CZ-CA 3.5Å; Y127-M352 VanDerWaalsContact OH-CA 3.32Å; Y127-M352 WeakPolarHBondContact OH-CA 3.44Å; Y127-M352 PolarHBondContact OH-N 3.27Å; L181-M352 HydrophobicContact CD2-CG 4.11Å; C184-M352 HydrophobicContact CB-SD 4.1Å; P349-M352 WeakPolarHBondContact O-CB 3.24Å; P349-M352 PolarHBondContact O-N 2.75Å; G350-M352 VanDerWaalsContact C-N 3.32Å; G350-M352 PolarHBondContact O-N 3.37Å; M352-A356 VanDerWaalsContact O-CB 3.32Å; M352-A356 WeakPolarHBondContact O-CB 3.47Å; M352-A356 PolarHBondContact O-N 3.44Å |
| 353 | V | 75.6 | Confident | 69.9 | Low | 79 Ų | 79 | 68.4 Ų | 68.4 | 48% | 0.479 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -68.7 | -42.1 | 177.4 | -180 | 0 | 0 | 0 | 0 | 110.4 | P349 G350 D351 A356 I357 | P349-V353 PolarHBondContact O-N 3.13Å; G350-V353 PolarHBondContact O-N 3.35Å; D351-V353 VanDerWaalsContact C-N 3.3Å; D351-V353 PolarHBondContact O-N 3.21Å; V353-A356 PolarHBondContact O-N 2.99Å; V353-I357 HydrophobicContact CG1-CD1 3.97Å; V353-I357 VanDerWaalsContact O-CG1 3.29Å; V353-I357 WeakPolarHBondContact O-CG1 3.45Å; V353-I357 PolarHBondContact O-N 2.98Å |
| 354 | Q | 74.3 | Confident | 68.7 | Low | 139 Ų | 139 | 69.2 Ų | 69.2 | 65% | 0.65 | 37% | 0.372 | S | S | * | . | H | α-helix | trans | -63.3 | -42.8 | 176.7 | -172.3 | 171.7 | -5.8 | 0 | 0 | 111.7 | G350 D351 I357 H358 | G350-Q354 PolarHBondContact O-N 3.15Å; D351-Q354 PolarHBondContact O-N 3.05Å; Q354-I357 PolarHBondContact O-N 3.46Å; Q354-H358 WeakPolarHBondContact O-CB 3.28Å; Q354-H358 PolarHBondContact O-N 3.48Å |
| 355 | D | 71.3 | Confident | 67.7 | Low | 31 Ų | 31 | 67.3 Ų | 67.3 | 17% | 0.166 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -65.8 | -37.3 | 174.8 | -91.7 | -12.6 | 0 | 0 | 0 | 112.6 | Y127 K177 D351 H358 N359 | Y127-D355 HydrophobicContact CE2-CB 4.29Å; Y127-D355 PolarHBondContact OH-OD2 3.23Å; K177-D355 WeakPolarHBondContact CE-OD1 3.33Å; K177-D355 WeakPolarHBondContact CE-OD2 3.45Å; K177-D355 IonicContact NZ-OD1 3.78Å; K177-D355 PolarHBondContact NZ-OD1 2.9Å; K177-D355 IonicContact NZ-OD2 2.61Å; K177-D355 PolarHBondContact NZ-OD2 3.49Å; D351-D355 WeakPolarHBondContact O-CB 3.3Å; D351-D355 PolarHBondContact O-N 3.43Å; D355-H358 PolarHBondContact O-N 2.73Å; D355-N359 WeakPolarHBondContact O-CB 3.42Å; D355-N359 PolarHBondContact O-N 3.34Å |
| 356 | A | 71 | Confident | 66.7 | Low | 31 Ų | 31 | 67.7 Ų | 67.7 | 26% | 0.256 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -62.6 | -48.3 | 172.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | L181 M352 V353 H358 N359 F360 | L181-A356 HydrophobicContact CD2-CB 4.25Å; M352-A356 VanDerWaalsContact O-CB 3.32Å; M352-A356 WeakPolarHBondContact O-CB 3.47Å; M352-A356 PolarHBondContact O-N 3.44Å; V353-A356 PolarHBondContact O-N 2.99Å; A356-H358 VanDerWaalsContact C-N 3.33Å; A356-H358 PolarHBondContact O-N 3.32Å; A356-N359 PolarHBondContact O-N 3.46Å; A356-F360 WeakPolarHBondContact O-CB 3.31Å; A356-F360 VanDerWaalsContact O-CD2 3.31Å; A356-F360 WeakPolarHBondContact O-CD2 3.08Å; A356-F360 PolarHBondContact O-N 2.87Å |
| 357 | I | 75.9 | Confident | 65.9 | Low | 110 Ų | 110 | 75.4 Ų | 75.4 | 56% | 0.564 | 40% | 0.398 | S | S | * | . | H | α-helix | trans | -61.1 | -45.8 | 176.7 | -67.4 | 165.4 | 0 | 0 | 0 | 109.7 | V353 Q354 N359 S361 | V353-I357 HydrophobicContact CG1-CD1 3.97Å; V353-I357 VanDerWaalsContact O-CG1 3.29Å; V353-I357 WeakPolarHBondContact O-CG1 3.45Å; V353-I357 PolarHBondContact O-N 2.98Å; Q354-I357 PolarHBondContact O-N 3.46Å; I357-N359 PolarHBondContact O-N 3.41Å; I357-S361 WeakPolarHBondContact O-CA 3.38Å; I357-S361 WeakPolarHBondContact O-CB 3.49Å; I357-S361 PolarHBondContact O-N 3.41Å; I357-S361 PolarHBondContact O-OG 3.07Å |
| 358 | H | 71.9 | Confident | 64.7 | Low | 61 Ų | 61 | 73.9 Ų | 73.9 | 28% | 0.282 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -59.4 | -47.9 | -180 | -178.7 | -92.4 | 0 | 0 | 0 | 112.5 | Q354 D355 A356 S361 Y364 | Q354-H358 WeakPolarHBondContact O-CB 3.28Å; Q354-H358 PolarHBondContact O-N 3.48Å; D355-H358 PolarHBondContact O-N 2.73Å; A356-H358 VanDerWaalsContact C-N 3.33Å; A356-H358 PolarHBondContact O-N 3.32Å; H358-S361 PolarHBondContact O-OG 3.24Å; H358-Y364 AromaticContact CD2-CE2 3.74Å; H358-Y364 AromaticContact CE1-CD2 3.97Å; H358-Y364 AromaticContact CE1-CE2 3.41Å; H358-Y364 VanDerWaalsContact CE1-CE2 3.41Å; H358-Y364 WeakPolarHBondContact CE1-CE2 3.23Å; H358-Y364 AromaticContact CE1-CZ 3.83Å; H358-Y364 AromaticContact NE2-CD2 3.65Å; H358-Y364 AromaticContact NE2-CE2 2.96Å; H358-Y364 WeakPolarHBondContact NE2-CE2 3.4Å; H358-Y364 AromaticContact NE2-CZ 3.71Å |
| 359 | N | 66.3 | Low | 63.4 | Low | 13 Ų | 13 | 75.6 Ų | 75.6 | 7% | 0.07 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -83.1 | -20.2 | -173.7 | -75.2 | -11.1 | 0 | 0 | 0 | 115.6 | K177 Q178 L181 D355 A356 I357 | K177-N359 WeakPolarHBondContact CB-ND2 3.42Å; K177-N359 WeakPolarHBondContact CD-ND2 3.29Å; K177-N359 WeakPolarHBondContact CE-ND2 3.49Å; K177-N359 WeakPolarHBondContact CG-ND2 3.22Å; Q178-N359 HydrophobicContact CG-CB 4.23Å; Q178-N359 PolarHBondContact NE2-O 2.85Å; L181-N359 HydrophobicContact CD1-CB 4.14Å; D355-N359 WeakPolarHBondContact O-CB 3.42Å; D355-N359 PolarHBondContact O-N 3.34Å; A356-N359 PolarHBondContact O-N 3.46Å; I357-N359 PolarHBondContact O-N 3.41Å |
| 360 | F | 72.6 | Confident | 62 | Low | 114 Ų | 114 | 78 Ų | 78 | 50% | 0.5 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -106.5 | -7.8 | 175.7 | -67.1 | -73.2 | 0 | 0 | 0 | 113.2 | Q178 L181 A356 | Q178-F360 HydrophobicContact CB-CE1 4.47Å; Q178-F360 HydrophobicContact CB-CZ 4.24Å; Q178-F360 HydrophobicContact CG-CE1 4.31Å; Q178-F360 HydrophobicContact CG-CZ 4.32Å; L181-F360 HydrophobicContact CB-CE2 3.77Å; L181-F360 HydrophobicContact CB-CZ 4.4Å; L181-F360 HydrophobicContact CD1-CE2 4.3Å; A356-F360 WeakPolarHBondContact O-CB 3.31Å; A356-F360 VanDerWaalsContact O-CD2 3.31Å; A356-F360 WeakPolarHBondContact O-CD2 3.08Å; A356-F360 PolarHBondContact O-N 2.87Å |
| 361 | S | 65.1 | Low | 60.5 | Low | 38 Ų | 38 | 79.6 Ų | 79.6 | 27% | 0.266 | 41% | 0.41 | S | S | . | . | trans | -70.6 | 133.5 | 178.3 | 64.8 | 0 | 0 | 0 | 0 | 112.3 | I357 H358 A363 | I357-S361 WeakPolarHBondContact O-CA 3.38Å; I357-S361 WeakPolarHBondContact O-CB 3.49Å; I357-S361 PolarHBondContact O-N 3.41Å; I357-S361 PolarHBondContact O-OG 3.07Å; H358-S361 PolarHBondContact O-OG 3.24Å; S361-A363 PolarHBondContact O-N 3.22Å | ||
| 362 | P | 51.4 | Low | 59 | Low | 104 Ų | 104 | 82.5 Ų | 82.5 | 68% | 0.675 | 43% | 0.429 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.5 | -23.4 | 174.9 | -21.2 | 31.2 | 0 | 0 | 0 | 114 | Y364 Q365 | P362-Y364 PolarHBondContact O-N 2.87Å; P362-Q365 PolarHBondContact O-N 3.46Å |
| 363 | A | 50.8 | Low | 57.1 | Low | 54 Ų | 54 | 87.5 Ų | 87.5 | 45% | 0.446 | 45% | 0.452 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -64.3 | -22.9 | -176 | 0 | 0 | 0 | 0 | 0 | 113.4 | S361 Q365 Q366 | S361-A363 PolarHBondContact O-N 3.22Å; A363-Q365 VanDerWaalsContact C-N 3.29Å; A363-Q365 PolarHBondContact O-N 3.23Å; A363-Q366 WeakPolarHBondContact O-CB 3.47Å; A363-Q366 PolarHBondContact O-N 2.99Å |
| 364 | Y | 48.4 | Very low | 55.5 | Low | 71 Ų | 71 | 91.9 Ų | 91.9 | 28% | 0.278 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -69.8 | -26.9 | 178.9 | -146.1 | -82.6 | 0 | 0 | 0 | 113.4 | R174 H358 P362 Q366 Y367 T368 | R174-Y364 VanDerWaalsContact NH2-CD1 3.33Å; H358-Y364 AromaticContact CD2-CE2 3.74Å; H358-Y364 AromaticContact CE1-CD2 3.97Å; H358-Y364 AromaticContact CE1-CE2 3.41Å; H358-Y364 VanDerWaalsContact CE1-CE2 3.41Å; H358-Y364 WeakPolarHBondContact CE1-CE2 3.23Å; H358-Y364 AromaticContact CE1-CZ 3.83Å; H358-Y364 AromaticContact NE2-CD2 3.65Å; H358-Y364 AromaticContact NE2-CE2 2.96Å; H358-Y364 WeakPolarHBondContact NE2-CE2 3.4Å; H358-Y364 AromaticContact NE2-CZ 3.71Å; P362-Y364 PolarHBondContact O-N 2.87Å; Y364-Q366 PolarHBondContact O-N 3.4Å; Y364-Q366 VanDerWaalsContact O-N 3.15Å; Y364-Y367 PolarHBondContact O-N 3.35Å; Y364-Y367 VanDerWaalsContact O-N 3.14Å; Y364-T368 HydrophobicContact CE1-CG2 4.41Å; Y364-T368 PolarHBondContact O-N 3.18Å; Y364-T368 PolarHBondContact O-OG1 3.32Å; Y364-T368 VanDerWaalsContact O-OG1 3.06Å |
| 365 | Q | 51.1 | Low | 54 | Low | 126 Ų | 126 | 91.3 Ų | 91.3 | 59% | 0.589 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -58 | -31.6 | 177 | -66.5 | -176.6 | -8.4 | 0 | 0 | 111.1 | P362 A363 T368 Q369 | P362-Q365 PolarHBondContact O-N 3.46Å; A363-Q365 VanDerWaalsContact C-N 3.29Å; A363-Q365 PolarHBondContact O-N 3.23Å; Q365-T368 PolarHBondContact O-OG1 3.11Å; Q365-Q369 WeakPolarHBondContact O-CB 3.37Å; Q365-Q369 WeakPolarHBondContact O-CG 3.15Å; Q365-Q369 PolarHBondContact O-N 3.19Å |
| 366 | Q | 46.8 | Very low | 52.2 | Low | 126 Ų | 126 | 93.8 Ų | 93.8 | 59% | 0.589 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -69.8 | -38.8 | 179.1 | -64.3 | 176.3 | -31.9 | 0 | 0 | 112.5 | A363 Y364 Q369 Q370 | A363-Q366 WeakPolarHBondContact O-CB 3.47Å; A363-Q366 PolarHBondContact O-N 2.99Å; Y364-Q366 PolarHBondContact O-N 3.4Å; Y364-Q366 VanDerWaalsContact O-N 3.15Å; Q366-Q369 PolarHBondContact O-N 3.48Å; Q366-Q370 WeakPolarHBondContact O-CB 3.25Å; Q366-Q370 VanDerWaalsContact O-CG 3.32Å; Q366-Q370 WeakPolarHBondContact O-CG 3.4Å; Q366-Q370 PolarHBondContact O-N 3.14Å |
| 367 | Y | 48.3 | Very low | 50.3 | Low | 161 Ų | 161 | 100.7 Ų | 100.7 | 63% | 0.631 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -68.4 | -41.2 | 176.3 | -79.9 | -81.4 | 0 | 0 | 0 | 112.7 | Y364 S371 | Y364-Y367 PolarHBondContact O-N 3.35Å; Y364-Y367 VanDerWaalsContact O-N 3.14Å; Y367-S371 PolarHBondContact O-N 3.21Å; Y367-S371 PolarHBondContact O-OG 3.06Å |
| 368 | T | 47.8 | Very low | 48.3 | Very low | 44 Ų | 44 | 100.7 Ų | 100.7 | 27% | 0.27 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -69.6 | -31.5 | 174.7 | 28.9 | 0 | 0 | 0 | 0 | 113.2 | Y364 Q365 S371 T372 | Y364-T368 HydrophobicContact CE1-CG2 4.41Å; Y364-T368 PolarHBondContact O-N 3.18Å; Y364-T368 PolarHBondContact O-OG1 3.32Å; Y364-T368 VanDerWaalsContact O-OG1 3.06Å; Q365-T368 PolarHBondContact O-OG1 3.11Å; T368-S371 WeakPolarHBondContact CA-OG 3.27Å; T368-S371 PolarHBondContact O-OG 3.18Å; T368-T372 WeakPolarHBondContact O-CB 3.49Å; T368-T372 PolarHBondContact O-N 2.92Å; T368-T372 VanDerWaalsContact O-N 3.12Å; T368-T372 PolarHBondContact O-OG1 3.25Å |
| 369 | Q | 48 | Very low | 46.5 | Very low | 124 Ų | 124 | 103.7 Ų | 103.7 | 58% | 0.579 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -74.2 | -37.3 | 175.4 | -74.7 | 175 | 13.8 | 0 | 0 | 112.2 | Q365 Q366 T372 Q373 | Q365-Q369 WeakPolarHBondContact O-CB 3.37Å; Q365-Q369 WeakPolarHBondContact O-CG 3.15Å; Q365-Q369 PolarHBondContact O-N 3.19Å; Q366-Q369 PolarHBondContact O-N 3.48Å; Q369-T372 PolarHBondContact O-N 3.3Å; Q369-Q373 PolarHBondContact O-N 2.93Å |
| 370 | Q | 44.3 | Very low | 44.9 | Very low | 115 Ų | 115 | 109.2 Ų | 109.2 | 54% | 0.537 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -66.6 | -45.1 | 174.8 | -78.1 | 173.9 | -15.1 | 0 | 0 | 112.2 | Q366 T372 Q373 E374 | Q366-Q370 WeakPolarHBondContact O-CB 3.25Å; Q366-Q370 VanDerWaalsContact O-CG 3.32Å; Q366-Q370 WeakPolarHBondContact O-CG 3.4Å; Q366-Q370 PolarHBondContact O-N 3.14Å; Q370-T372 VanDerWaalsContact C-N 3.3Å; Q370-T372 PolarHBondContact O-N 2.92Å; Q370-Q373 PolarHBondContact O-N 3.4Å; Q370-Q373 VanDerWaalsContact O-N 3.15Å; Q370-E374 PolarHBondContact O-N 3.33Å |
| 371 | S | 39.6 | Very low | 43.1 | Very low | 60 Ų | 60 | 111.8 Ų | 111.8 | 42% | 0.42 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -67 | -28.7 | 175.7 | 44.3 | 0 | 0 | 0 | 0 | 113.2 | Y367 T368 V375 | Y367-S371 PolarHBondContact O-N 3.21Å; Y367-S371 PolarHBondContact O-OG 3.06Å; T368-S371 WeakPolarHBondContact CA-OG 3.27Å; T368-S371 PolarHBondContact O-OG 3.18Å; S371-V375 VanDerWaalsContact O-CG2 3.3Å; S371-V375 WeakPolarHBondContact O-CG2 3.31Å |
| 372 | T | 42 | Very low | 41.4 | Very low | 90 Ų | 90 | 113.2 Ų | 113.2 | 55% | 0.552 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -74.3 | -33.7 | 171.7 | -53.5 | 0 | 0 | 0 | 0 | 111.8 | T368 Q369 Q370 S376 | T368-T372 WeakPolarHBondContact O-CB 3.49Å; T368-T372 PolarHBondContact O-N 2.92Å; T368-T372 VanDerWaalsContact O-N 3.12Å; T368-T372 PolarHBondContact O-OG1 3.25Å; Q369-T372 PolarHBondContact O-N 3.3Å; Q370-T372 VanDerWaalsContact C-N 3.3Å; Q370-T372 PolarHBondContact O-N 2.92Å; T372-S376 PolarHBondContact O-N 3.36Å; T372-S376 PolarHBondContact O-OG 3.26Å |
| 373 | Q | 37.2 | Very low | 40.4 | Very low | 147 Ų | 147 | 118.8 Ų | 118.8 | 69% | 0.687 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -71.1 | -36.7 | 175.5 | -92.3 | -178.6 | -14.5 | 0 | 0 | 113.3 | Q369 Q370 V375 S376 | Q369-Q373 PolarHBondContact O-N 2.93Å; Q370-Q373 PolarHBondContact O-N 3.4Å; Q370-Q373 VanDerWaalsContact O-N 3.15Å; Q373-V375 VanDerWaalsContact C-N 3.29Å; Q373-V375 PolarHBondContact O-N 3.23Å; Q373-S376 PolarHBondContact O-N 3.17Å |
| 374 | E | 41.2 | Very low | 39.8 | Very low | 170 Ų | 170 | 123.2 Ų | 123.2 | 79% | 0.794 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -66.5 | -29.5 | 176.1 | -74.6 | -168.8 | 151.4 | 0 | 0 | 112.9 | Q370 S376 | Q370-E374 PolarHBondContact O-N 3.33Å; E374-S376 VanDerWaalsContact C-N 3.32Å |
| 375 | V | 42.9 | Very low | 38.8 | Very low | 128 Ų | 128 | 124.4 Ų | 124.4 | 78% | 0.776 | 69% | 0.688 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.3 | -11.7 | 177.9 | 179.1 | 0 | 0 | 0 | 0 | 112.6 | S371 Q373 | S371-V375 VanDerWaalsContact O-CG2 3.3Å; S371-V375 WeakPolarHBondContact O-CG2 3.31Å; Q373-V375 VanDerWaalsContact C-N 3.29Å; Q373-V375 PolarHBondContact O-N 3.23Å |
| 376 | S | 33.3 | Very low | 37.9 | Very low | 83 Ų | 83 | 125.2 Ų | 125.2 | 58% | 0.58 | 70% | 0.702 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.9 | 3.8 | -172.7 | -55.8 | 0 | 0 | 0 | 0 | 115.6 | T372 Q373 E374 P378 | T372-S376 PolarHBondContact O-N 3.36Å; T372-S376 PolarHBondContact O-OG 3.26Å; Q373-S376 PolarHBondContact O-N 3.17Å; E374-S376 VanDerWaalsContact C-N 3.32Å; S376-P378 VanDerWaalsContact O-CD 3.26Å; S376-P378 WeakPolarHBondContact O-CD 3.13Å |
| 377 | Q | 31.4 | Very low | 36.9 | Very low | 175 Ų | 175 | 123.2 Ų | 123.2 | 82% | 0.818 | 71% | 0.714 | S | S | * | * | trans | -83.1 | 114.2 | 173.8 | -78.2 | -166.3 | 5.1 | 0 | 0 | 111.1 | S379 | Q377-S379 PolarHBondContact O-N 3.46Š| ||
| 378 | P | 32.9 | Very low | 35.9 | Very low | 111 Ų | 111 | 122.9 Ų | 122.9 | 72% | 0.721 | 72% | 0.723 | S | S | * | * | trans | -76.9 | 116.3 | 167.6 | 2.8 | 16.7 | 0 | 0 | 0 | 108 | S376 T380 | S376-P378 VanDerWaalsContact O-CD 3.26Å; S376-P378 WeakPolarHBondContact O-CD 3.13Å; P378-T380 PolarHBondContact O-N 3.38Å | ||
| 379 | S | 35.9 | Very low | 34.9 | Very low | 123 Ų | 123 | 129.6 Ų | 129.6 | 86% | 0.86 | 75% | 0.749 | S | S | * | * | trans | -60.1 | 108.3 | 166 | 179.9 | 0 | 0 | 0 | 0 | 109.1 | Q377 | Q377-S379 PolarHBondContact O-N 3.46Š| ||
| 380 | T | 31.7 | Very low | 33.9 | Very low | 129 Ų | 129 | 129 Ų | 129 | 79% | 0.791 | 76% | 0.758 | S | S | * | * | trans | -131.8 | 109.9 | 164.3 | -24.3 | 0 | 0 | 0 | 0 | 108.7 | P378 | P378-T380 PolarHBondContact O-N 3.38Š| ||
| 381 | N | 34.3 | Very low | 33 | Very low | 168 Ų | 168 | 128.3 Ų | 128.3 | 90% | 0.898 | 77% | 0.767 | S | S | * | * | trans | -68.8 | 138.3 | -179.1 | -125.1 | -8.7 | 0 | 0 | 0 | 111.4 | ||||
| 382 | G | 30.8 | Very low | 32.5 | Very low | 68 Ų | 68 | 136.8 Ų | 136.8 | 70% | 0.701 | 79% | 0.789 | S | S | * | * | trans | 150.4 | 110.3 | 154.2 | 0 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 383 | K | 29.3 | Very low | 31.9 | Very low | 221 Ų | 221 | 142.5 Ų | 142.5 | 96% | 0.961 | 81% | 0.807 | S | S | * | * | trans | 88.3 | 133.5 | 149.7 | -67.4 | -177.3 | 176.3 | 177.8 | 0 | 120.9 | ||||
| 384 | V | 38.2 | Very low | 31.5 | Very low | 147 Ų | 147 | 140.3 Ų | 140.3 | 89% | 0.891 | 81% | 0.807 | S | S | * | * | trans | -72.7 | 133.5 | 176.4 | 177.2 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 385 | A | 28.3 | Very low | 31 | Very low | 96 Ų | 96 | 139.6 Ų | 139.6 | 79% | 0.793 | 81% | 0.809 | S | S | * | * | trans | -161.7 | 138.6 | 148.2 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 386 | T | 31.1 | Very low | 30.4 | Very low | 144 Ų | 144 | 142.4 Ų | 142.4 | 88% | 0.883 | 81% | 0.811 | S | S | * | * | trans | -59.2 | 145.7 | 178.9 | 44.9 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 387 | G | 27 | Very low | 30.5 | Very low | 83 Ų | 83 | 145.5 Ų | 145.5 | 86% | 0.856 | 82% | 0.819 | S | S | * | * | trans | 177.1 | 134.1 | 166 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 388 | N | 26.1 | Very low | 30.5 | Very low | 154 Ų | 154 | 144.3 Ų | 144.3 | 82% | 0.824 | 82% | 0.816 | S | S | * | * | trans | -93.9 | 164.1 | -158.3 | -149.6 | 2.1 | 0 | 0 | 0 | 113.8 | ||||
| 389 | K | 28.4 | Very low | 30.4 | Very low | 185 Ų | 185 | 146.1 Ų | 146.1 | 80% | 0.804 | 82% | 0.818 | S | S | * | * | trans | 84.7 | 107.3 | 155 | -75.7 | -179.1 | 176.4 | 178.3 | 0 | 121.6 | ||||
| 390 | S | 25 | Very low | 30.2 | Very low | 111 Ų | 111 | 147.4 Ų | 147.4 | 78% | 0.776 | 81% | 0.814 | S | S | * | * | 111.9 | 114.2 | 107.2 | -164.9 | 0 | 0 | 0 | 0 | 118.6 | |||||
| 391 | S | 27.2 | Very low | 30.2 | Very low | 102 Ų | 102 | 147 Ų | 147 | 71% | 0.713 | 81% | 0.812 | S | S | * | * | trans | 69.3 | 106.9 | 139.9 | -169.2 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 392 | R | 28.2 | Very low | 30.3 | Very low | 238 Ų | 238 | 143.3 Ų | 143.3 | 90% | 0.898 | 80% | 0.799 | S | S | * | * | -171.7 | 133 | 81.7 | -134 | 165.9 | 177.1 | 162.9 | -3.6 | 111.8 | |||||
| 393 | K | 28.9 | Very low | 30.8 | Very low | 210 Ų | 210 | 147.1 Ų | 147.1 | 91% | 0.913 | 80% | 0.803 | S | S | * | * | trans | -8.1 | 131.9 | 164 | -101.9 | 172 | 169.8 | -179.6 | 0 | 119.5 | ||||
| 394 | S | 30.2 | Very low | 31.2 | Very low | 100 Ų | 100 | 144.7 Ų | 144.7 | 70% | 0.699 | 80% | 0.801 | S | S | * | * | trans | -53.2 | 170.7 | 161.5 | -47.2 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 395 | D | 29.9 | Very low | 31.4 | Very low | 156 Ų | 156 | 146.4 Ų | 146.4 | 83% | 0.834 | 80% | 0.799 | S | S | * | * | trans | 104.6 | 116.5 | 153 | -51.3 | -27.4 | 0 | 0 | 0 | 113.1 | ||||
| 396 | K | 30.4 | Very low | 31.8 | Very low | 186 Ų | 186 | 155.6 Ų | 155.6 | 81% | 0.809 | 82% | 0.821 | S | S | * | * | cis | -157.9 | 120.3 | 41.7 | -133 | 169.8 | -176.9 | 178.7 | 0 | 110.2 | ||||
| 397 | I | 35.7 | Very low | 31.8 | Very low | 149 Ų | 149 | 156.2 Ų | 156.2 | 76% | 0.764 | 82% | 0.818 | S | S | * | * | trans | -78.2 | 125.8 | 159.7 | -69 | 166.7 | 0 | 0 | 0 | 106.3 | L399 | I397-L399 HydrophobicContact CG2-CB 4.45Å; I397-L399 HydrophobicContact CG2-CD1 3.84Å; I397-L399 HydrophobicContact CG2-CG 4.01Å | ||
| 398 | M | 30.3 | Very low | 32 | Very low | 150 Ų | 150 | 160 Ų | 160 | 74% | 0.739 | 82% | 0.816 | S | S | * | * | trans | -128 | 82.8 | 160.1 | -159.7 | -176.7 | -67.5 | 0 | 0 | 107.2 | I400 | M398-I400 HydrophobicContact CG-CG1 4.47Å; M398-I400 PolarHBondContact O-N 3.44Å | ||
| 399 | L | 32.5 | Very low | 32.4 | Very low | 148 Ų | 148 | 160.3 Ų | 160.3 | 78% | 0.775 | 82% | 0.816 | S | S | * | * | trans | -62.5 | 117.6 | 155.2 | -80.5 | 152.9 | 0 | 0 | 0 | 106.6 | I397 | I397-L399 HydrophobicContact CG2-CB 4.45Å; I397-L399 HydrophobicContact CG2-CD1 3.84Å; I397-L399 HydrophobicContact CG2-CG 4.01Å | ||
| 400 | I | 31.8 | Very low | 32.6 | Very low | 151 Ų | 151 | 158.9 Ų | 158.9 | 77% | 0.774 | 82% | 0.817 | S | S | * | * | trans | -97.8 | 107.2 | 152.8 | -67.3 | -178.7 | 0 | 0 | 0 | 105.6 | M398 | M398-I400 HydrophobicContact CG-CG1 4.47Å; M398-I400 PolarHBondContact O-N 3.44Å | ||
| 401 | T | 31.7 | Very low | 33.1 | Very low | 120 Ų | 120 | 161.9 Ų | 161.9 | 74% | 0.736 | 82% | 0.819 | S | S | * | * | trans | -65.9 | 138.8 | 174.4 | 173.2 | 0 | 0 | 0 | 0 | 110 | ||||
| 402 | S | 36 | Very low | 33.5 | Very low | 90 Ų | 90 | 165.9 Ų | 165.9 | 63% | 0.629 | 83% | 0.826 | S | S | * | * | trans | -62 | 160.6 | 157.9 | -44.8 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 403 | D | 39.8 | Very low | 33.9 | Very low | 148 Ų | 148 | 160.7 Ų | 160.7 | 79% | 0.791 | 82% | 0.821 | S | S | * | * | trans | 84.4 | 110.7 | 162 | -50.2 | -21.1 | 0 | 0 | 0 | 117.3 | ||||
| 404 | D | 39.1 | Very low | 34.2 | Very low | 170 Ų | 170 | 156.9 Ų | 156.9 | 91% | 0.909 | 81% | 0.814 | S | S | * | * | -157 | 125.4 | 120.5 | -92.5 | -31 | 0 | 0 | 0 | 109.9 | |||||
| 405 | E | 40.9 | Very low | 34.6 | Very low | 183 Ų | 183 | 161.7 Ų | 161.7 | 86% | 0.855 | 82% | 0.824 | S | S | * | * | trans | -59.8 | 143.9 | 169.8 | -66.1 | 169.3 | 114.1 | 0 | 0 | 111.7 | ||||
| 406 | F | 36.8 | Very low | 35 | Very low | 289 Ų | 289 | 162.2 Ų | 162.2 | 100% | 1.268 | 82% | 0.823 | S | S | * | * | -168.5 | 0 | 128 | -100 | -68.4 | 0 | 0 | 0 | 111 |
Retrieved 406 of 406 residues in 1142.3 ms
(Link to these results)