| 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 | 31.6 | Very low | 29.4 | Very low | 249 Ų | 249 | 141 Ų | 141 | 100% | 1.227 | 85% | 0.851 | S | S | * | * | 0 | 110.4 | 0 | -73.9 | 171 | 166.7 | 0 | 0 | 105.6 | |||||
| 2 | S | 31.4 | Very low | 29.1 | Very low | 108 Ų | 108 | 133.3 Ų | 133.3 | 76% | 0.755 | 82% | 0.821 | S | S | * | * | cis | -156.9 | 116.9 | 26.7 | 164 | 0 | 0 | 0 | 0 | 105.4 | ||||
| 3 | T | 31.2 | Very low | 29.2 | Very low | 134 Ų | 134 | 136 Ų | 136 | 82% | 0.822 | 83% | 0.827 | S | S | * | * | 59.1 | 88.6 | 80.9 | 63.3 | 0 | 0 | 0 | 0 | 117.7 | |||||
| 4 | G | 26.3 | Very low | 29.4 | Very low | 78 Ų | 78 | 136.6 Ų | 136.6 | 80% | 0.804 | 82% | 0.821 | S | S | * | * | trans | 87.4 | 160.8 | 133 | 0 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 5 | P | 36.1 | Very low | 29.7 | Very low | 121 Ų | 121 | 133.5 Ų | 133.5 | 79% | 0.786 | 81% | 0.809 | S | S | * | * | cis | -126.1 | 154.9 | 4.8 | 36.5 | -19.5 | 0 | 0 | 0 | 116.3 | ||||
| 6 | D | 30.2 | Very low | 30.1 | Very low | 165 Ų | 165 | 132.4 Ų | 132.4 | 88% | 0.882 | 80% | 0.797 | S | S | * | * | trans | -59.1 | 130 | 162.8 | -74 | -58.3 | 0 | 0 | 0 | 112 | ||||
| 7 | V | 28.3 | Very low | 30.6 | Very low | 134 Ų | 134 | 132 Ų | 132 | 81% | 0.812 | 79% | 0.789 | S | S | * | * | trans | -109.8 | 97.3 | 162.3 | 177.7 | 0 | 0 | 0 | 0 | 108 | A9 | V7-A9 PolarHBondContact O-N 3.19Š| ||
| 8 | K | 26.1 | Very low | 30.6 | Very low | 200 Ų | 200 | 126.9 Ų | 126.9 | 87% | 0.87 | 77% | 0.768 | S | S | * | * | trans | -66.3 | 103.3 | 164.7 | -123.1 | 175.9 | -179.2 | 178 | 0 | 107.6 | T10 | K8-T10 PolarHBondContact O-N 3.14Š| ||
| 9 | A | 26.7 | Very low | 30.7 | Very low | 89 Ų | 89 | 125.7 Ų | 125.7 | 74% | 0.736 | 76% | 0.757 | S | S | * | * | trans | -76.4 | 109 | 166.2 | 0 | 0 | 0 | 0 | 0 | 108.4 | V7 V11 | V7-A9 PolarHBondContact O-N 3.19Å; A9-V11 PolarHBondContact O-N 3.31Å; A9-V11 VanDerWaalsContact O-N 3.14Å | ||
| 10 | T | 25.5 | Very low | 31.2 | Very low | 134 Ų | 134 | 124 Ų | 124 | 82% | 0.822 | 74% | 0.743 | S | S | * | * | trans | -58 | 109.8 | 172 | -35.8 | 0 | 0 | 0 | 0 | 108.8 | K8 G12 | K8-T10 PolarHBondContact O-N 3.14Å; T10-G12 PolarHBondContact O-N 2.99Å | ||
| 11 | V | 30.2 | Very low | 31.4 | Very low | 139 Ų | 139 | 122.5 Ų | 122.5 | 84% | 0.842 | 73% | 0.732 | S | S | * | * | trans | -69 | 89.6 | 163.4 | 176.1 | 0 | 0 | 0 | 0 | 105.8 | A9 | A9-V11 PolarHBondContact O-N 3.31Å; A9-V11 VanDerWaalsContact O-N 3.14Å | ||
| 12 | G | 25.9 | Very low | 31.5 | Very low | 48 Ų | 48 | 115.8 Ų | 115.8 | 50% | 0.495 | 70% | 0.699 | S | S | . | * | trans | -71.3 | 131.2 | 164.7 | 0 | 0 | 0 | 0 | 0 | 108.4 | T10 I14 | T10-G12 PolarHBondContact O-N 2.99Å; G12-I14 PolarHBondContact O-N 2.99Å | ||
| 13 | D | 29.8 | Very low | 31.9 | Very low | 169 Ų | 169 | 113.2 Ų | 113.2 | 90% | 0.904 | 68% | 0.684 | S | S | * | * | trans | -52.2 | 95.2 | 171.9 | -72.3 | -48.6 | 0 | 0 | 0 | 110.5 | ||||
| 14 | I | 31.8 | Very low | 32.2 | Very low | 144 Ų | 144 | 113.2 Ų | 113.2 | 74% | 0.738 | 68% | 0.675 | S | S | * | * | trans | -84 | 119.3 | 164.8 | -64.4 | 173.1 | 0 | 0 | 0 | 105.8 | G12 N16 | G12-I14 PolarHBondContact O-N 2.99Å; I14-N16 VanDerWaalsContact C-N 3.28Å; I14-N16 PolarHBondContact O-N 2.92Å | ||
| 15 | S | 34.3 | Very low | 32.8 | Very low | 91 Ų | 91 | 116.8 Ų | 116.8 | 64% | 0.636 | 67% | 0.67 | S | S | * | * | trans | -51.7 | 79.4 | 176.3 | 49.8 | 0 | 0 | 0 | 0 | 113.2 | D17 | S15-D17 VanDerWaalsContact C-N 3.32Š| ||
| 16 | N | 36.4 | Very low | 33 | Very low | 115 Ų | 115 | 119 Ų | 119 | 62% | 0.615 | 67% | 0.67 | S | S | * | * | H | α-helix | trans | -74.2 | -25.4 | 179.7 | -142.1 | 18 | 0 | 0 | 0 | 112 | I14 L20 | I14-N16 VanDerWaalsContact C-N 3.28Å; I14-N16 PolarHBondContact O-N 2.92Å; N16-L20 VanDerWaalsContact O-CD1 3.32Å; N16-L20 WeakPolarHBondContact O-CD1 3.41Å; N16-L20 PolarHBondContact O-N 2.85Å; N16-L20 VanDerWaalsContact O-N 3.16Å |
| 17 | D | 38.5 | Very low | 33.6 | Very low | 126 Ų | 126 | 113.7 Ų | 113.7 | 67% | 0.674 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -71.4 | -31.6 | 178 | -85.4 | -15.2 | 0 | 0 | 0 | 113.2 | S15 N21 | S15-D17 VanDerWaalsContact C-N 3.32Å; D17-N21 VanDerWaalsContact O-CB 3.25Å; D17-N21 WeakPolarHBondContact O-CB 3.35Å; D17-N21 PolarHBondContact O-N 2.89Å; D17-N21 PolarHBondContact O-ND2 2.89Å |
| 18 | G | 29.7 | Very low | 34.2 | Very low | 40 Ų | 40 | 111.2 Ų | 111.2 | 41% | 0.412 | 63% | 0.634 | S | S | . | * | H | α-helix | trans | -70 | -41.6 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | M22 | G18-M22 WeakPolarHBondContact O-CB 3.43Å; G18-M22 PolarHBondContact O-N 3.47Å |
| 19 | N | 34 | Very low | 35.1 | Very low | 104 Ų | 104 | 113.3 Ų | 113.3 | 56% | 0.556 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -77 | -32.1 | 178.9 | -88.1 | -17.1 | 0 | 0 | 0 | 113.1 | A23 | N19-A23 WeakPolarHBondContact O-CB 3.35Å; N19-A23 PolarHBondContact O-N 2.92Å |
| 20 | L | 39.8 | Very low | 36 | Very low | 91 Ų | 91 | 117.8 Ų | 117.8 | 48% | 0.476 | 64% | 0.639 | S | S | . | * | H | α-helix | trans | -67 | -43.4 | 170.8 | -100.9 | 112.7 | 0 | 0 | 0 | 111.3 | N16 A23 Q24 | N16-L20 VanDerWaalsContact O-CD1 3.32Å; N16-L20 WeakPolarHBondContact O-CD1 3.41Å; N16-L20 PolarHBondContact O-N 2.85Å; N16-L20 VanDerWaalsContact O-N 3.16Å; L20-A23 PolarHBondContact O-N 3.05Å; L20-Q24 VanDerWaalsContact O-CB 3.26Å; L20-Q24 WeakPolarHBondContact O-CB 3.48Å; L20-Q24 PolarHBondContact O-N 2.73Å |
| 21 | N | 35.6 | Very low | 37 | Very low | 94 Ų | 94 | 113.5 Ų | 113.5 | 50% | 0.503 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -69.8 | -38 | 179.1 | -70.8 | -26.6 | 0 | 0 | 0 | 112.4 | D17 Q24 E25 | D17-N21 VanDerWaalsContact O-CB 3.25Å; D17-N21 WeakPolarHBondContact O-CB 3.35Å; D17-N21 PolarHBondContact O-N 2.89Å; D17-N21 PolarHBondContact O-ND2 2.89Å; N21-Q24 PolarHBondContact O-N 3.03Å; N21-E25 WeakPolarHBondContact O-CB 3.49Å; N21-E25 PolarHBondContact O-N 3.43Å |
| 22 | M | 34.4 | Very low | 37.8 | Very low | 108 Ų | 108 | 117.2 Ų | 117.2 | 53% | 0.532 | 63% | 0.626 | S | S | . | * | H | α-helix | trans | -64.9 | -40.5 | 171.4 | -103 | 179.7 | 36.1 | 0 | 0 | 112.8 | G18 Q24 E25 E26 | G18-M22 WeakPolarHBondContact O-CB 3.43Å; G18-M22 PolarHBondContact O-N 3.47Å; M22-Q24 PolarHBondContact O-N 3.14Å; M22-E25 PolarHBondContact O-N 2.85Å; M22-E26 PolarHBondContact O-N 3.01Å |
| 23 | A | 39.5 | Very low | 39.5 | Very low | 53 Ų | 53 | 121.1 Ų | 121.1 | 44% | 0.438 | 65% | 0.645 | S | S | . | * | H | α-helix | trans | -67.4 | -27.3 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | N19 L20 C27 | N19-A23 WeakPolarHBondContact O-CB 3.35Å; N19-A23 PolarHBondContact O-N 2.92Å; L20-A23 PolarHBondContact O-N 3.05Å; A23-C27 WeakPolarHBondContact O-CB 3.18Å; A23-C27 PolarHBondContact O-N 3.04Å |
| 24 | Q | 37.7 | Very low | 42 | Very low | 135 Ų | 135 | 113.8 Ų | 113.8 | 63% | 0.631 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -81.6 | -32.4 | 175.9 | -157.5 | 141.6 | -37.1 | 0 | 0 | 112.1 | L20 N21 M22 C27 | L20-Q24 VanDerWaalsContact O-CB 3.26Å; L20-Q24 WeakPolarHBondContact O-CB 3.48Å; L20-Q24 PolarHBondContact O-N 2.73Å; N21-Q24 PolarHBondContact O-N 3.03Å; M22-Q24 PolarHBondContact O-N 3.14Å; Q24-C27 WeakPolarHBondContact O-CB 3.38Å; Q24-C27 PolarHBondContact O-N 2.94Å |
| 25 | E | 39 | Very low | 44.7 | Very low | 152 Ų | 152 | 108.4 Ų | 108.4 | 71% | 0.71 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -72.2 | -39.6 | 172.2 | -82.8 | -175.1 | 148.7 | 0 | 0 | 112.6 | N21 M22 C27 S28 | N21-E25 WeakPolarHBondContact O-CB 3.49Å; N21-E25 PolarHBondContact O-N 3.43Å; M22-E25 PolarHBondContact O-N 2.85Å; E25-C27 PolarHBondContact O-N 3.24Å; E25-S28 PolarHBondContact O-N 3.38Å |
| 26 | E | 39.7 | Very low | 47.3 | Very low | 168 Ų | 168 | 105 Ų | 105 | 79% | 0.785 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -68.6 | -22.5 | 172.6 | -80.6 | -170.2 | 151.2 | 0 | 0 | 113.1 | M22 S28 | M22-E26 PolarHBondContact O-N 3.01Å; E26-S28 VanDerWaalsContact C-N 3.25Å; E26-S28 PolarHBondContact O-N 3.33Å |
| 27 | C | 43.5 | Very low | 49.8 | Very low | 53 Ų | 53 | 102 Ų | 102 | 36% | 0.358 | 54% | 0.536 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -74.4 | -8.2 | 174.4 | -102.1 | 0 | 0 | 0 | 0 | 114.2 | A23 Q24 E25 Y267 | A23-C27 WeakPolarHBondContact O-CB 3.18Å; A23-C27 PolarHBondContact O-N 3.04Å; Q24-C27 WeakPolarHBondContact O-CB 3.38Å; Q24-C27 PolarHBondContact O-N 2.94Å; E25-C27 PolarHBondContact O-N 3.24Å; C27-Y267 HydrophobicContact CB-CD2 4.19Å |
| 28 | S | 40.8 | Very low | 52.3 | Low | 83 Ų | 83 | 97.5 Ų | 97.5 | 58% | 0.58 | 52% | 0.519 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -105.8 | 17.6 | -166.2 | -164.9 | 0 | 0 | 0 | 0 | 114.7 | E25 E26 K30 | E25-S28 PolarHBondContact O-N 3.38Å; E26-S28 VanDerWaalsContact C-N 3.25Å; E26-S28 PolarHBondContact O-N 3.33Å; S28-K30 VanDerWaalsContact C-N 3.32Å; S28-K30 PolarHBondContact O-N 2.99Å |
| 29 | R | 43.2 | Very low | 55.2 | Low | 244 Ų | 244 | 96 Ų | 96 | 92% | 0.921 | 50% | 0.502 | S | S | * | . | trans | -80.3 | 82.9 | 176.4 | -144.1 | 175.1 | -175.7 | -176 | 1 | 110.8 | G31 | R29-G31 VanDerWaalsContact C-N 3.29Å; R29-G31 PolarHBondContact O-N 3.44Å | ||
| 30 | K | 47 | Very low | 58 | Low | 183 Ų | 183 | 91.1 Ų | 91.1 | 80% | 0.796 | 48% | 0.476 | S | S | * | . | trans | -63.5 | 85.6 | 168.5 | -79.5 | -178.1 | 176.1 | 178.5 | 0 | 110.3 | S28 | S28-K30 VanDerWaalsContact C-N 3.32Å; S28-K30 PolarHBondContact O-N 2.99Å | ||
| 31 | G | 45.7 | Very low | 60.5 | Low | 43 Ų | 43 | 91.6 Ų | 91.6 | 44% | 0.443 | 48% | 0.478 | S | S | . | . | trans | -86.8 | 129.2 | 164.9 | 0 | 0 | 0 | 0 | 0 | 110.2 | R29 C33 S34 | R29-G31 VanDerWaalsContact C-N 3.29Å; R29-G31 PolarHBondContact O-N 3.44Å; G31-C33 PolarHBondContact O-N 3.19Å; G31-S34 PolarHBondContact O-N 3.09Å | ||
| 32 | F | 47.2 | Very low | 63.3 | Low | 217 Ų | 217 | 88.9 Ų | 88.9 | 95% | 0.952 | 46% | 0.463 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.9 | -11.5 | 170.1 | -109.3 | -97 | 0 | 0 | 0 | 113.6 | ||
| 33 | C | 61.6 | Low | 66.1 | Low | 131 Ų | 131 | 83.8 Ų | 83.8 | 89% | 0.885 | 44% | 0.438 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -102.2 | 43.8 | 173.9 | -73.8 | 0 | 0 | 0 | 0 | 113.2 | G31 | G31-C33 PolarHBondContact O-N 3.19Š|
| 34 | S | 81.8 | Confident | 68.7 | Low | 15 Ų | 15 | 83 Ų | 83 | 11% | 0.105 | 43% | 0.425 | C | S | . | . | trans | -79.6 | 134.3 | 173.1 | 152.4 | 0 | 0 | 0 | 0 | 110.6 | G31 R36 H37 G38 E264 | G31-S34 PolarHBondContact O-N 3.09Å; S34-R36 PolarHBondContact O-N 3.31Å; S34-R36 PolarHBondContact OG-N 2.75Å; S34-H37 WeakPolarHBondContact CB-ND1 3.33Å; S34-H37 PolarHBondContact O-N 3.14Å; S34-H37 PolarHBondContact OG-ND1 3.12Å; S34-G38 PolarHBondContact O-N 3.16Å; S34-E264 WeakPolarHBondContact CB-OE1 3.43Å; S34-E264 PolarHBondContact OG-OE1 3.31Å | ||
| 35 | V | 88.4 | Confident | 71.4 | Confident | 31 Ų | 31 | 79.9 Ų | 79.9 | 19% | 0.188 | 41% | 0.413 | C | S | . | . | H | α-helix | trans | -58.7 | -34.7 | -179.5 | 174.9 | 0 | 0 | 0 | 0 | 111.1 | H37 G38 L39 W191 H257 I260 E264 | V35-H37 VanDerWaalsContact C-N 3.32Å; V35-H37 PolarHBondContact O-N 2.86Å; V35-G38 PolarHBondContact O-N 3.31Å; V35-L39 PolarHBondContact O-N 3.38Å; V35-W191 HydrophobicContact CG1-CH2 4.18Å; V35-W191 HydrophobicContact CG1-CZ3 3.8Å; V35-H257 VanDerWaalsContact CG1-CE1 3.45Å; V35-H257 WeakPolarHBondContact CG1-CE1 3.38Å; V35-I260 HydrophobicContact CG2-CG1 4.44Å; V35-E264 PolarHBondContact N-OE1 2.87Å; V35-E264 PolarHBondContact N-OE2 3.11Å; V35-E264 VanDerWaalsContact N-OE2 3.13Å |
| 36 | R | 89.7 | Confident | 74 | Confident | 18 Ų | 18 | 72.8 Ų | 72.8 | 7% | 0.068 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -62.3 | -36 | 176.2 | -67 | 172 | -74.5 | 136.9 | -2 | 113.6 | S34 L39 A40 W191 E196 L200 E264 I268 | S34-R36 PolarHBondContact O-N 3.31Å; S34-R36 PolarHBondContact OG-N 2.75Å; R36-L39 WeakPolarHBondContact O-CB 3.35Å; R36-L39 PolarHBondContact O-N 2.96Å; R36-A40 PolarHBondContact O-N 2.77Å; R36-W191 VanDerWaalsContact CD-O 3.26Å; R36-W191 WeakPolarHBondContact CD-O 3.35Å; R36-W191 HydrophobicContact CG-CE3 4.15Å; R36-E196 IonicContact CZ-OE2 2.73Å; R36-E196 IonicContact NH1-OE2 3.03Å; R36-E196 PolarHBondContact NH1-OE2 2.94Å; R36-E196 IonicContact NH2-OE2 2.76Å; R36-L200 HydrophobicContact CB-CD1 4.42Å; R36-L200 HydrophobicContact CB-CD2 4.5Å; R36-E264 WeakPolarHBondContact CG-OE1 3.14Å; R36-E264 IonicContact CZ-OE1 3.69Å; R36-E264 PolarHBondContact N-OE1 3.32Å; R36-E264 IonicContact NE-OE1 2.62Å; R36-E264 PolarHBondContact NE-OE1 2.84Å; R36-E264 IonicContact NH2-OE1 3.97Å; R36-I268 HydrophobicContact CG-CD1 3.93Å |
| 37 | H | 89.2 | Confident | 76.7 | Confident | 54 Ų | 54 | 64.9 Ų | 64.9 | 25% | 0.25 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -73.3 | -38 | 175.8 | -69.5 | 77.8 | 0 | 0 | 0 | 110.8 | S34 V35 L39 A40 L41 | S34-H37 WeakPolarHBondContact CB-ND1 3.33Å; S34-H37 PolarHBondContact O-N 3.14Å; S34-H37 PolarHBondContact OG-ND1 3.12Å; V35-H37 VanDerWaalsContact C-N 3.32Å; V35-H37 PolarHBondContact O-N 2.86Å; H37-L39 VanDerWaalsContact C-N 3.32Å; H37-L39 PolarHBondContact O-N 3.25Å; H37-A40 WeakPolarHBondContact O-CB 3.29Å; H37-A40 PolarHBondContact O-N 3.25Å; H37-L41 WeakPolarHBondContact O-CG 3.42Å; H37-L41 PolarHBondContact O-N 3.34Å |
| 38 | G | 90.6 | Very high | 79.2 | Confident | 31 Ų | 31 | 64.1 Ų | 64.1 | 32% | 0.32 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -58 | -43.6 | 169.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | S34 V35 A40 L41 I42 | S34-G38 PolarHBondContact O-N 3.16Å; V35-G38 PolarHBondContact O-N 3.31Å; G38-A40 VanDerWaalsContact C-N 3.34Å; G38-A40 PolarHBondContact O-N 3.18Å; G38-L41 PolarHBondContact O-N 2.78Å; G38-I42 WeakPolarHBondContact O-CG1 3.5Å; G38-I42 PolarHBondContact O-N 3.11Å |
| 39 | L | 91.4 | Very high | 81.8 | Confident | 9 Ų | 9 | 60.1 Ų | 60.1 | 5% | 0.047 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -59.7 | -42.3 | 173.4 | 177.2 | 63.1 | 0 | 0 | 0 | 112.2 | V35 R36 H37 L41 I42 L43 I187 W188 W191 I250 | V35-L39 PolarHBondContact O-N 3.38Å; R36-L39 WeakPolarHBondContact O-CB 3.35Å; R36-L39 PolarHBondContact O-N 2.96Å; H37-L39 VanDerWaalsContact C-N 3.32Å; H37-L39 PolarHBondContact O-N 3.25Å; L39-L41 VanDerWaalsContact C-N 3.32Å; L39-L41 PolarHBondContact O-N 3.29Å; L39-I42 PolarHBondContact O-N 3.21Å; L39-L43 HydrophobicContact CD1-CD1 4.31Å; L39-L43 HydrophobicContact CG-CD1 4.27Å; L39-L43 PolarHBondContact O-N 3.36Å; L39-I187 HydrophobicContact CD1-CG2 4.3Å; L39-I187 HydrophobicContact CD2-CG2 3.81Å; L39-I187 HydrophobicContact CG-CG2 4.46Å; L39-W188 HydrophobicContact CD2-CZ3 4.18Å; L39-W188 HydrophobicContact CG-CH2 4.29Å; L39-W188 HydrophobicContact CG-CZ3 4.41Å; L39-W191 HydrophobicContact CD2-CB 3.68Å; L39-W191 HydrophobicContact CD2-CD2 3.56Å; L39-W191 HydrophobicContact CD2-CE3 3.8Å; L39-W191 HydrophobicContact CD2-CG 3.53Å; L39-I250 HydrophobicContact CD1-CD1 3.13Å |
| 40 | A | 92.5 | Very high | 84.3 | Confident | 0 Ų | 0 | 48.5 Ų | 48.5 | 0% | 0 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -60.7 | -41.1 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | R36 H37 G38 L43 Q44 W188 L200 I203 | R36-A40 PolarHBondContact O-N 2.77Å; H37-A40 WeakPolarHBondContact O-CB 3.29Å; H37-A40 PolarHBondContact O-N 3.25Å; G38-A40 VanDerWaalsContact C-N 3.34Å; G38-A40 PolarHBondContact O-N 3.18Å; A40-L43 PolarHBondContact O-N 2.76Å; A40-Q44 WeakPolarHBondContact O-CB 3.16Å; A40-Q44 PolarHBondContact O-N 3.11Å; A40-W188 HydrophobicContact CB-CH2 3.73Å; A40-W188 HydrophobicContact CB-CZ2 4.28Å; A40-L200 HydrophobicContact CB-CD2 4.02Å; A40-I203 HydrophobicContact CB-CB 4.16Å; A40-I203 HydrophobicContact CB-CG2 3.83Å |
| 41 | L | 93 | Very high | 86.5 | Confident | 102 Ų | 102 | 42.9 Ų | 42.9 | 53% | 0.534 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -67.7 | -38 | 176.6 | -66 | 176.7 | 0 | 0 | 0 | 112.5 | H37 G38 L39 Q44 L45 I203 | H37-L41 WeakPolarHBondContact O-CG 3.42Å; H37-L41 PolarHBondContact O-N 3.34Å; G38-L41 PolarHBondContact O-N 2.78Å; L39-L41 VanDerWaalsContact C-N 3.32Å; L39-L41 PolarHBondContact O-N 3.29Å; L41-Q44 VanDerWaalsContact CD2-OE1 3.27Å; L41-Q44 VanDerWaalsContact O-CB 3.32Å; L41-Q44 WeakPolarHBondContact O-CB 3.29Å; L41-Q44 PolarHBondContact O-N 2.82Å; L41-L45 PolarHBondContact O-N 3.12Å; L41-I203 HydrophobicContact CD2-CG2 4.22Å |
| 42 | I | 93 | Very high | 88.8 | Confident | 36 Ų | 36 | 40.9 Ų | 40.9 | 19% | 0.185 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -65.3 | -44.2 | 175.1 | -64.2 | 162.4 | 0 | 0 | 0 | 110.3 | G38 L39 Q44 L45 C46 W246 L249 I250 | G38-I42 WeakPolarHBondContact O-CG1 3.5Å; G38-I42 PolarHBondContact O-N 3.11Å; L39-I42 PolarHBondContact O-N 3.21Å; I42-Q44 VanDerWaalsContact C-N 3.29Å; I42-Q44 PolarHBondContact O-N 3.35Å; I42-L45 WeakPolarHBondContact O-CB 3.45Å; I42-L45 PolarHBondContact O-N 3.16Å; I42-C46 PolarHBondContact O-N 3.47Å; I42-C46 PolarHBondContact O-SG 3.32Å; I42-W246 HydrophobicContact CG2-CE3 3.9Å; I42-W246 HydrophobicContact CG2-CZ3 4.13Å; I42-L249 HydrophobicContact CD1-CB 3.73Å; I42-L249 HydrophobicContact CD1-CD1 3.92Å; I42-L249 HydrophobicContact CD1-CG 4.41Å; I42-L249 HydrophobicContact CG1-CD1 4.41Å; I42-I250 HydrophobicContact CB-CD1 4.27Å; I42-I250 HydrophobicContact CD1-CD1 4.12Å; I42-I250 HydrophobicContact CG2-CD1 3.87Å; I42-I250 HydrophobicContact CG2-CG1 4.26Å |
| 43 | L | 93.1 | Very high | 91.1 | Very high | 1 Ų | 1 | 30.5 Ų | 30.5 | 1% | 0.005 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -65.2 | -33.8 | 174.9 | -79 | 167.8 | 0 | 0 | 0 | 112.1 | L39 A40 L45 C46 N47 Q184 I187 W188 A204 W246 | L39-L43 HydrophobicContact CD1-CD1 4.31Å; L39-L43 HydrophobicContact CG-CD1 4.27Å; L39-L43 PolarHBondContact O-N 3.36Å; A40-L43 PolarHBondContact O-N 2.76Å; L43-L45 VanDerWaalsContact C-N 3.34Å; L43-C46 WeakPolarHBondContact O-CB 3.35Å; L43-C46 PolarHBondContact O-N 2.96Å; L43-N47 PolarHBondContact O-N 2.74Å; L43-N47 PolarHBondContact O-ND2 2.78Å; L43-Q184 HydrophobicContact CD2-CB 3.76Å; L43-I187 HydrophobicContact CD2-CD1 4.42Å; L43-W188 HydrophobicContact CB-CZ2 4.49Å; L43-W188 HydrophobicContact CD1-CH2 3.97Å; L43-W188 HydrophobicContact CD1-CZ2 3.31Å; L43-A204 HydrophobicContact CB-CB 3.7Å; L43-W246 HydrophobicContact CD2-CH2 3.7Å; L43-W246 HydrophobicContact CD2-CZ3 3.71Å; L43-W246 HydrophobicContact CG-CH2 4.44Å; L43-W246 HydrophobicContact CG-CZ3 4.24Å |
| 44 | Q | 95 | Very high | 92.5 | Very high | 37 Ų | 37 | 25 Ų | 25 | 17% | 0.173 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -59.1 | -45.6 | 170.6 | -170 | -176.8 | -1.8 | 0 | 0 | 111.3 | A40 L41 I42 C46 N47 F48 I203 A204 S206 G207 | A40-Q44 WeakPolarHBondContact O-CB 3.16Å; A40-Q44 PolarHBondContact O-N 3.11Å; L41-Q44 VanDerWaalsContact CD2-OE1 3.27Å; L41-Q44 VanDerWaalsContact O-CB 3.32Å; L41-Q44 WeakPolarHBondContact O-CB 3.29Å; L41-Q44 PolarHBondContact O-N 2.82Å; I42-Q44 VanDerWaalsContact C-N 3.29Å; I42-Q44 PolarHBondContact O-N 3.35Å; Q44-C46 VanDerWaalsContact C-N 3.33Å; Q44-C46 PolarHBondContact O-N 3.41Å; Q44-N47 PolarHBondContact O-N 3.14Å; Q44-F48 WeakPolarHBondContact O-CB 3.28Å; Q44-F48 PolarHBondContact O-N 3.1Å; Q44-I203 WeakPolarHBondContact CG-O 3.26Å; Q44-A204 WeakPolarHBondContact CA-O 3.33Å; Q44-S206 PolarHBondContact NE2-OG 3.38Å; Q44-G207 WeakPolarHBondContact O-CA 3.32Å |
| 45 | L | 94.4 | Very high | 93 | Very high | 70 Ų | 70 | 24.4 Ų | 24.4 | 37% | 0.366 | 13% | 0.127 | S | C | . | . | H | α-helix | trans | -65.7 | -34.1 | 176.5 | -174 | 65.3 | 0 | 0 | 0 | 112.7 | L41 I42 L43 F48 S49 C242 | L41-L45 PolarHBondContact O-N 3.12Å; I42-L45 WeakPolarHBondContact O-CB 3.45Å; I42-L45 PolarHBondContact O-N 3.16Å; L43-L45 VanDerWaalsContact C-N 3.34Å; L45-F48 HydrophobicContact CD1-CD1 4.4Å; L45-F48 WeakPolarHBondContact O-CB 3.42Å; L45-S49 PolarHBondContact O-N 3.01Å; L45-S49 PolarHBondContact O-OG 2.89Å; L45-C242 HydrophobicContact CD2-CB 4.43Å; L45-C242 VanDerWaalsContact CD2-SG 3.53Å; L45-C242 HydrophobicContact CG-CB 4.47Å; L45-C242 WeakPolarHBondContact CG-SG 3.39Å |
| 46 | C | 94.3 | Very high | 93.2 | Very high | 2 Ų | 2 | 23 Ų | 23 | 1% | 0.014 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -65.5 | -50.2 | 173.3 | -63.8 | 0 | 0 | 0 | 0 | 111.3 | I42 L43 Q44 F48 S49 I50 L145 | I42-C46 PolarHBondContact O-N 3.47Å; I42-C46 PolarHBondContact O-SG 3.32Å; L43-C46 WeakPolarHBondContact O-CB 3.35Å; L43-C46 PolarHBondContact O-N 2.96Å; Q44-C46 VanDerWaalsContact C-N 3.33Å; Q44-C46 PolarHBondContact O-N 3.41Å; C46-F48 VanDerWaalsContact C-N 3.28Å; C46-F48 PolarHBondContact O-N 3.24Å; C46-S49 PolarHBondContact O-N 3.19Å; C46-S49 VanDerWaalsContact O-N 3.1Å; C46-I50 WeakPolarHBondContact O-CG1 3.33Å; C46-I50 PolarHBondContact O-N 3.39Å; C46-L145 HydrophobicContact CB-CD2 4.43Å |
| 47 | N | 94.9 | Very high | 93.3 | Very high | 3 Ų | 3 | 22.1 Ų | 22.1 | 2% | 0.016 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -61.9 | -37.6 | 177.1 | -73.5 | -41.2 | 0 | 0 | 0 | 111.6 | L43 Q44 I50 Y51 L181 Q184 A204 | L43-N47 PolarHBondContact O-N 2.74Å; L43-N47 PolarHBondContact O-ND2 2.78Å; Q44-N47 PolarHBondContact O-N 3.14Å; N47-I50 PolarHBondContact O-N 3.35Å; N47-Y51 WeakPolarHBondContact O-CB 3.37Å; N47-Y51 WeakPolarHBondContact O-CD2 3.44Å; N47-Y51 PolarHBondContact O-N 3.45Å; N47-L181 WeakPolarHBondContact OD1-CD2 3.37Å; N47-Q184 PolarHBondContact ND2-OE1 2.92Å; N47-Q184 PolarHBondContact OD1-NE2 3.44Å; N47-Q184 PolarHBondContact OD1-OE1 2.97Å; N47-A204 PolarHBondContact ND2-O 3.48Å |
| 48 | F | 95.6 | Very high | 93.4 | Very high | 36 Ų | 36 | 19.7 Ų | 19.7 | 16% | 0.158 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -56.3 | -49.3 | 170.7 | 173.6 | -87.1 | 0 | 0 | 0 | 112.2 | Q44 L45 C46 I50 Y51 T52 G207 L210 G211 I214 I238 | Q44-F48 WeakPolarHBondContact O-CB 3.28Å; Q44-F48 PolarHBondContact O-N 3.1Å; L45-F48 HydrophobicContact CD1-CD1 4.4Å; L45-F48 WeakPolarHBondContact O-CB 3.42Å; C46-F48 VanDerWaalsContact C-N 3.28Å; C46-F48 PolarHBondContact O-N 3.24Å; F48-I50 PolarHBondContact O-N 3.05Å; F48-Y51 PolarHBondContact O-N 2.9Å; F48-T52 HydrophobicContact CD1-CG2 4.38Å; F48-T52 HydrophobicContact CE1-CG2 3.99Å; F48-T52 HydrophobicContact CE2-CG2 4.27Å; F48-T52 HydrophobicContact CZ-CG2 3.93Å; F48-T52 VanDerWaalsContact O-CG2 3.29Å; F48-T52 WeakPolarHBondContact O-CG2 3.32Å; F48-T52 PolarHBondContact O-N 3.38Å; F48-T52 PolarHBondContact O-OG1 3.41Å; F48-T52 VanDerWaalsContact O-OG1 3.05Å; F48-G207 WeakPolarHBondContact CA-O 3.42Å; F48-L210 HydrophobicContact CD2-CB 3.98Å; F48-L210 HydrophobicContact CE2-CB 4.45Å; F48-G211 VanDerWaalsContact CD2-N 3.32Å; F48-I214 HydrophobicContact CE2-CB 4.04Å; F48-I214 HydrophobicContact CE2-CG1 3.99Å; F48-I214 HydrophobicContact CE2-CG2 4.41Å; F48-I214 HydrophobicContact CZ-CB 4.24Å; F48-I214 HydrophobicContact CZ-CG1 4.47Å; F48-I214 HydrophobicContact CZ-CG2 4.12Å; F48-I238 HydrophobicContact CE1-CG2 4.46Å |
| 49 | S | 95.5 | Very high | 93.5 | Very high | 0 Ų | 0 | 18.3 Ų | 18.3 | 0% | 0 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -64.5 | -40.5 | -179.5 | -59.8 | 0 | 0 | 0 | 0 | 112.5 | L45 C46 T52 Q53 C242 | L45-S49 PolarHBondContact O-N 3.01Å; L45-S49 PolarHBondContact O-OG 2.89Å; C46-S49 PolarHBondContact O-N 3.19Å; C46-S49 VanDerWaalsContact O-N 3.1Å; S49-T52 WeakPolarHBondContact CA-OG1 3.5Å; S49-T52 PolarHBondContact O-OG1 3.29Å; S49-Q53 VanDerWaalsContact O-CD 3.29Å; S49-Q53 WeakPolarHBondContact O-CG 3.21Å; S49-Q53 PolarHBondContact O-N 3.04Å; S49-C242 PolarHBondContact OG-SG 3.46Å; S49-C242 VanDerWaalsContact OG-SG 3.4Å |
| 50 | I | 95.4 | Very high | 93.5 | Very high | 0 Ų | 0 | 17.9 Ų | 17.9 | 0% | 0 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -67.1 | -46.3 | 179 | -65.8 | -66.8 | 0 | 0 | 0 | 111.4 | C46 N47 F48 Q53 Q54 L145 Q177 V180 L181 | C46-I50 WeakPolarHBondContact O-CG1 3.33Å; C46-I50 PolarHBondContact O-N 3.39Å; N47-I50 PolarHBondContact O-N 3.35Å; F48-I50 PolarHBondContact O-N 3.05Å; I50-Q53 PolarHBondContact O-N 2.96Å; I50-Q54 WeakPolarHBondContact O-CB 3.3Å; I50-Q54 PolarHBondContact O-N 3.25Å; I50-L145 HydrophobicContact CD1-CD1 3.88Å; I50-L145 HydrophobicContact CG1-CD1 4.16Å; I50-Q177 HydrophobicContact CD1-CG 4Å; I50-Q177 HydrophobicContact CG2-CB 3.95Å; I50-Q177 HydrophobicContact CG2-CG 3.86Å; I50-V180 HydrophobicContact CD1-CB 4.26Å; I50-V180 HydrophobicContact CD1-CG1 4.26Å; I50-V180 HydrophobicContact CD1-CG2 4.08Å; I50-V180 HydrophobicContact CG1-CB 4.31Å; I50-V180 HydrophobicContact CG1-CG1 3.85Å; I50-L181 HydrophobicContact CG2-CD1 4.44Å; I50-L181 HydrophobicContact CG2-CD2 4.35Å; I50-L181 HydrophobicContact CG2-CG 4.38Å |
| 51 | Y | 93.6 | Very high | 93.5 | Very high | 65 Ų | 65 | 17.9 Ų | 17.9 | 26% | 0.255 | 9% | 0.087 | S | C | . | . | H | α-helix | trans | -73 | -31.5 | -176.9 | -86.6 | -96.2 | 0 | 0 | 0 | 113.3 | N47 F48 Q54 M55 L181 S208 | N47-Y51 WeakPolarHBondContact O-CB 3.37Å; N47-Y51 WeakPolarHBondContact O-CD2 3.44Å; N47-Y51 PolarHBondContact O-N 3.45Å; F48-Y51 PolarHBondContact O-N 2.9Å; Y51-Q54 PolarHBondContact O-N 3.31Å; Y51-M55 PolarHBondContact O-N 3.5Å; Y51-L181 HydrophobicContact CE2-CD1 4.37Å; Y51-L181 HydrophobicContact CE2-CD2 3.79Å; Y51-S208 WeakPolarHBondContact CB-O 3.36Å |
| 52 | T | 94.9 | Very high | 93.3 | Very high | 0 Ų | 0 | 13.6 Ų | 13.6 | 0% | 0 | 7% | 0.065 | C | C | . | . | H | α-helix | trans | -58.9 | -50.6 | 168.4 | 49.9 | 0 | 0 | 0 | 0 | 110.3 | F48 S49 Q54 M55 N56 G211 V215 F235 | F48-T52 HydrophobicContact CD1-CG2 4.38Å; F48-T52 HydrophobicContact CE1-CG2 3.99Å; F48-T52 HydrophobicContact CE2-CG2 4.27Å; F48-T52 HydrophobicContact CZ-CG2 3.93Å; F48-T52 VanDerWaalsContact O-CG2 3.29Å; F48-T52 WeakPolarHBondContact O-CG2 3.32Å; F48-T52 PolarHBondContact O-N 3.38Å; F48-T52 PolarHBondContact O-OG1 3.41Å; F48-T52 VanDerWaalsContact O-OG1 3.05Å; S49-T52 WeakPolarHBondContact CA-OG1 3.5Å; S49-T52 PolarHBondContact O-OG1 3.29Å; T52-Q54 VanDerWaalsContact C-N 3.3Å; T52-Q54 PolarHBondContact O-N 3.42Å; T52-M55 PolarHBondContact O-N 2.92Å; T52-N56 PolarHBondContact O-N 3.48Å; T52-N56 PolarHBondContact O-OD1 3.37Å; T52-G211 VanDerWaalsContact CG2-O 3.28Å; T52-G211 WeakPolarHBondContact CG2-O 3.33Å; T52-V215 HydrophobicContact CG2-CB 4.18Å; T52-F235 HydrophobicContact CG2-CD1 3.71Å; T52-F235 HydrophobicContact CG2-CE1 3.77Å; T52-F235 HydrophobicContact CG2-CG 4.5Å |
| 53 | Q | 94.9 | Very high | 93 | Very high | 0 Ų | 0 | 13 Ų | 13 | 0% | 0 | 7% | 0.066 | C | C | . | . | H | α-helix | trans | -61.5 | -35.6 | 178.8 | -67.2 | 168.6 | 13 | 0 | 0 | 113.6 | S49 I50 S148 S149 T152 F235 | S49-Q53 VanDerWaalsContact O-CD 3.29Å; S49-Q53 WeakPolarHBondContact O-CG 3.21Å; S49-Q53 PolarHBondContact O-N 3.04Å; I50-Q53 PolarHBondContact O-N 2.96Å; Q53-S148 PolarHBondContact OE1-OG 3.32Å; Q53-S149 PolarHBondContact NE2-OG 3.21Å; Q53-T152 HydrophobicContact CG-CG2 4.11Å; Q53-T152 WeakPolarHBondContact CG-OG1 3.47Å; Q53-F235 PolarHBondContact NE2-O 3.42Å |
| 54 | Q | 92.2 | Very high | 92.9 | Very high | 14 Ų | 14 | 13 Ų | 13 | 7% | 0.065 | 7% | 0.065 | C | C | . | . | H | α-helix | trans | -62.7 | -41.9 | 177.2 | 178.9 | 165.9 | 1.1 | 0 | 0 | 112.2 | I50 Y51 T52 L117 M312 | I50-Q54 WeakPolarHBondContact O-CB 3.3Å; I50-Q54 PolarHBondContact O-N 3.25Å; Y51-Q54 PolarHBondContact O-N 3.31Å; T52-Q54 VanDerWaalsContact C-N 3.3Å; T52-Q54 PolarHBondContact O-N 3.42Å; Q54-L117 HydrophobicContact CB-CD2 4.26Å; Q54-L117 HydrophobicContact CG-CD2 3.68Å; Q54-M312 HydrophobicContact CG-CE 4.38Å |
| 55 | M | 90.9 | Very high | 92.5 | Very high | 4 Ų | 4 | 11.9 Ų | 11.9 | 2% | 0.02 | 6% | 0.061 | C | C | . | . | H | α-helix | trans | -92.1 | -14 | -177.1 | -74.1 | -169.8 | 136.1 | 0 | 0 | 115.1 | Y51 T52 L57 S58 S212 V215 L216 M312 F338 | Y51-M55 PolarHBondContact O-N 3.5Å; T52-M55 PolarHBondContact O-N 2.92Å; M55-L57 PolarHBondContact O-N 3.16Å; M55-S58 PolarHBondContact O-N 3.06Å; M55-S58 VanDerWaalsContact O-N 3.08Å; M55-S58 PolarHBondContact O-OG 3.12Å; M55-S212 VanDerWaalsContact SD-CA 3.57Å; M55-S212 WeakPolarHBondContact SD-CB 2.98Å; M55-V215 HydrophobicContact CB-CG1 3.66Å; M55-V215 HydrophobicContact SD-CG1 4.15Å; M55-L216 HydrophobicContact CE-CD1 4.06Å; M55-L216 HydrophobicContact SD-CD1 4.09Å; M55-L216 HydrophobicContact SD-CG 4.21Å; M55-M312 HydrophobicContact CE-CG 3.43Å; M55-M312 VanDerWaalsContact CE-CG 3.43Å; M55-M312 HydrophobicContact CE-SD 4.41Å; M55-M312 HydrophobicContact CG-CG 4.33Å; M55-F338 HydrophobicContact CE-CD1 4.07Å; M55-F338 HydrophobicContact CE-CD2 4.4Å; M55-F338 HydrophobicContact CE-CE1 3.7Å; M55-F338 HydrophobicContact CE-CE2 4.07Å; M55-F338 HydrophobicContact CE-CG 4.43Å; M55-F338 HydrophobicContact CE-CZ 3.74Å |
| 56 | N | 92.6 | Very high | 91.7 | Very high | 0 Ų | 0 | 11.6 Ų | 11.6 | 0% | 0 | 6% | 0.06 | C | C | . | . | H | α-helix | trans | -47.3 | -39.5 | -179.6 | -80.2 | -14.1 | 0 | 0 | 0 | 113.4 | T52 I59 A60 V215 V231 F232 F235 | T52-N56 PolarHBondContact O-N 3.48Å; T52-N56 PolarHBondContact O-OD1 3.37Å; N56-I59 WeakPolarHBondContact O-CG2 3.48Å; N56-A60 WeakPolarHBondContact O-CB 3.45Å; N56-A60 PolarHBondContact O-N 2.93Å; N56-V215 WeakPolarHBondContact OD1-CG2 3.22Å; N56-V231 HydrophobicContact CB-CG1 4.02Å; N56-V231 WeakPolarHBondContact OD1-CG1 3.44Å; N56-F232 HydrophobicContact CB-CD1 4.05Å; N56-F232 HydrophobicContact CB-CE1 3.72Å; N56-F232 HydrophobicContact CB-CZ 4.41Å; N56-F235 WeakPolarHBondContact OD1-CD2 3.19Å |
| 57 | L | 92.6 | Very high | 90 | Very high | 0 Ų | 0 | 16.9 Ų | 16.9 | 0% | 0 | 9% | 0.088 | C | C | . | . | H | α-helix | trans | -78.3 | -29.4 | -173.9 | -157.3 | 130.5 | 0 | 0 | 0 | 113.2 | M55 I59 A60 I61 I113 L114 I155 F232 | M55-L57 PolarHBondContact O-N 3.16Å; L57-I59 VanDerWaalsContact C-N 3.33Å; L57-I59 PolarHBondContact O-N 3.04Å; L57-A60 PolarHBondContact O-N 3.25Å; L57-I61 HydrophobicContact CD2-CD1 3.4Å; L57-I61 VanDerWaalsContact CD2-CD1 3.4Å; L57-I61 HydrophobicContact CD2-CG1 3.76Å; L57-I61 HydrophobicContact CG-CD1 4.42Å; L57-I61 HydrophobicContact CG-CG1 4.29Å; L57-I61 WeakPolarHBondContact O-CG1 3.32Å; L57-I61 PolarHBondContact O-N 2.92Å; L57-I113 HydrophobicContact CD1-CG2 3.91Å; L57-I113 HydrophobicContact CD2-CB 4.41Å; L57-I113 HydrophobicContact CD2-CG2 3.5Å; L57-I113 HydrophobicContact CG-CG2 4.35Å; L57-L114 HydrophobicContact CD2-CD2 3.81Å; L57-L114 HydrophobicContact CD2-CG 4.2Å; L57-I155 HydrophobicContact CD1-CG2 4.46Å; L57-F232 HydrophobicContact CB-CE1 4.45Å; L57-F232 HydrophobicContact CB-CZ 4.41Å; L57-F232 HydrophobicContact CD1-CE1 4.38Å; L57-F232 HydrophobicContact CD1-CZ 4.28Å; L57-F232 HydrophobicContact CG-CZ 4.45Å |
| 58 | S | 91.3 | Very high | 87.5 | Confident | 4 Ų | 4 | 22.3 Ų | 22.3 | 3% | 0.028 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -68.4 | -34.2 | 176.7 | 62.4 | 0 | 0 | 0 | 0 | 112.1 | M55 P62 M312 A313 P316 | M55-S58 PolarHBondContact O-N 3.06Å; M55-S58 VanDerWaalsContact O-N 3.08Å; M55-S58 PolarHBondContact O-OG 3.12Å; S58-P62 WeakPolarHBondContact O-CD 3.36Å; S58-M312 WeakPolarHBondContact CB-O 3.07Å; S58-M312 PolarHBondContact OG-O 3.43Å; S58-A313 WeakPolarHBondContact CB-O 3.23Å; S58-P316 WeakPolarHBondContact O-CB 3.46Å |
| 59 | I | 91.3 | Very high | 84.3 | Confident | 2 Ų | 2 | 23.4 Ų | 23.4 | 1% | 0.01 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -82.1 | -27.9 | 174.1 | -170.6 | 59.1 | 0 | 0 | 0 | 113 | N56 L57 V215 L216 P316 | N56-I59 WeakPolarHBondContact O-CG2 3.48Å; L57-I59 VanDerWaalsContact C-N 3.33Å; L57-I59 PolarHBondContact O-N 3.04Å; I59-V215 HydrophobicContact CG2-CG2 4.36Å; I59-L216 HydrophobicContact CB-CD2 4.45Å; I59-P316 HydrophobicContact CD1-CB 3.86Å; I59-P316 HydrophobicContact CD1-CG 4.36Å |
| 60 | A | 92.3 | Very high | 81.3 | Confident | 0 Ų | 0 | 28.3 Ų | 28.3 | 0% | 0 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -80.5 | -36.4 | -179.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | N56 L57 P62 A63 M64 W228 F232 | N56-A60 WeakPolarHBondContact O-CB 3.45Å; N56-A60 PolarHBondContact O-N 2.93Å; L57-A60 PolarHBondContact O-N 3.25Å; A60-P62 VanDerWaalsContact C-N 3.35Å; A60-A63 CarbonylContact O-C 3.44Å; A60-A63 WeakPolarHBondContact O-CA 3.25Å; A60-A63 WeakPolarHBondContact O-CB 3.43Å; A60-A63 PolarHBondContact O-N 3.23Å; A60-M64 HydrophobicContact CB-CG 4.32Å; A60-M64 HydrophobicContact CB-SD 3.74Å; A60-M64 VanDerWaalsContact O-CG 3.28Å; A60-M64 WeakPolarHBondContact O-CG 3.48Å; A60-M64 PolarHBondContact O-N 3.22Å; A60-W228 HydrophobicContact CB-CB 4.43Å; A60-F232 HydrophobicContact CB-CE2 3.72Å; A60-F232 HydrophobicContact CB-CZ 3.76Å |
| 61 | I | 92.4 | Very high | 78.3 | Confident | 0 Ų | 0 | 34.2 Ų | 34.2 | 0% | 0 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -49.4 | -46.9 | -177.3 | -84.6 | 177.9 | 0 | 0 | 0 | 113.4 | L57 A63 M64 V65 Q110 L114 | L57-I61 HydrophobicContact CD2-CD1 3.4Å; L57-I61 VanDerWaalsContact CD2-CD1 3.4Å; L57-I61 HydrophobicContact CD2-CG1 3.76Å; L57-I61 HydrophobicContact CG-CD1 4.42Å; L57-I61 HydrophobicContact CG-CG1 4.29Å; L57-I61 WeakPolarHBondContact O-CG1 3.32Å; L57-I61 PolarHBondContact O-N 2.92Å; I61-A63 PolarHBondContact O-N 3.46Å; I61-A63 VanDerWaalsContact O-N 3.09Å; I61-M64 PolarHBondContact O-N 3.28Å; I61-V65 HydrophobicContact CG2-CG2 4.26Å; I61-V65 PolarHBondContact O-N 3.48Å; I61-V65 VanDerWaalsContact O-N 3.1Å; I61-Q110 HydrophobicContact CD1-CB 4.23Å; I61-Q110 HydrophobicContact CG2-CB 4.44Å; I61-Q110 HydrophobicContact CG2-CG 4.08Å; I61-Q110 VanDerWaalsContact CG2-OE1 3.3Å; I61-L114 HydrophobicContact CD1-CD1 3.82Å; I61-L114 HydrophobicContact CD1-CD2 3.87Å; I61-L114 HydrophobicContact CD1-CG 3.58Å |
| 62 | P | 88.8 | Confident | 75.2 | Confident | 12 Ų | 12 | 36.9 Ų | 36.9 | 8% | 0.078 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -57.9 | -26.1 | 178.5 | -27.9 | 36.9 | 0 | 0 | 0 | 114.3 | S58 A60 N67 L327 | S58-P62 WeakPolarHBondContact O-CD 3.36Å; A60-P62 VanDerWaalsContact C-N 3.35Å; P62-N67 PolarHBondContact O-ND2 3.24Å; P62-L327 HydrophobicContact CB-CD2 3.9Å |
| 63 | A | 87.8 | Confident | 72.1 | Confident | 23 Ų | 23 | 45.7 Ų | 45.7 | 19% | 0.19 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -92 | -20.8 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113.5 | A60 I61 C223 W228 L327 | A60-A63 CarbonylContact O-C 3.44Å; A60-A63 WeakPolarHBondContact O-CA 3.25Å; A60-A63 WeakPolarHBondContact O-CB 3.43Å; A60-A63 PolarHBondContact O-N 3.23Å; I61-A63 PolarHBondContact O-N 3.46Å; I61-A63 VanDerWaalsContact O-N 3.09Å; A63-C223 HydrophobicContact CB-CB 4.03Å; A63-W228 HydrophobicContact CB-CB 4.11Å; A63-L327 HydrophobicContact CB-CD1 3.66Å; A63-L327 HydrophobicContact CB-CD2 4.12Å |
| 64 | M | 89.2 | Confident | 69.1 | Low | 0 Ų | 0 | 51.1 Ų | 51.1 | 0% | 0 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -84.9 | -18.6 | -179.9 | -67 | 171.1 | 80 | 0 | 0 | 112.9 | A60 I61 A102 Y103 W105 A159 W228 F232 | A60-M64 HydrophobicContact CB-CG 4.32Å; A60-M64 HydrophobicContact CB-SD 3.74Å; A60-M64 VanDerWaalsContact O-CG 3.28Å; A60-M64 WeakPolarHBondContact O-CG 3.48Å; A60-M64 PolarHBondContact O-N 3.22Å; I61-M64 PolarHBondContact O-N 3.28Å; M64-A102 CarbonylContact O-C 3.59Å; M64-A102 WeakPolarHBondContact O-CA 3.33Å; M64-Y103 HydrophobicContact CB-CD2 4.31Å; M64-Y103 HydrophobicContact CE-CE2 4.2Å; M64-Y103 WeakPolarHBondContact O-CD2 3.44Å; M64-Y103 PolarHBondContact O-N 3.02Å; M64-W105 HydrophobicContact CB-CZ3 4.03Å; M64-W105 HydrophobicContact CE-CH2 3.39Å; M64-W105 HydrophobicContact CE-CZ3 3.58Å; M64-W105 HydrophobicContact SD-CZ3 4.22Å; M64-A159 HydrophobicContact CE-CB 4.03Å; M64-W228 HydrophobicContact CE-CD2 4.36Å; M64-W228 HydrophobicContact CE-CE3 3.94Å; M64-W228 HydrophobicContact CE-CH2 3.82Å; M64-W228 HydrophobicContact CE-CZ2 4.22Å; M64-W228 HydrophobicContact CE-CZ3 3.65Å; M64-W228 HydrophobicContact CG-CB 4.24Å; M64-W228 HydrophobicContact CG-CD2 3.45Å; M64-W228 VanDerWaalsContact CG-CD2 3.45Å; M64-W228 HydrophobicContact CG-CE3 3.84Å; M64-W228 HydrophobicContact CG-CG 3.62Å; M64-W228 HydrophobicContact CG-CZ2 4.35Å; M64-W228 HydrophobicContact CG-CZ3 4.43Å; M64-W228 HydrophobicContact SD-CD2 4.25Å; M64-W228 HydrophobicContact SD-CE3 4Å; M64-W228 HydrophobicContact SD-CZ3 4.32Å; M64-F232 HydrophobicContact SD-CE2 4.31Å; M64-F232 HydrophobicContact SD-CZ 4.46Å |
| 65 | V | 88.1 | Confident | 66.2 | Low | 15 Ų | 15 | 58.1 Ų | 58.1 | 9% | 0.091 | 35% | 0.35 | C | S | . | . | B | Isolated β-bridge | trans | -105.7 | 139.2 | -175 | 179.8 | 0 | 0 | 0 | 0 | 111.2 | I61 N67 Y103 W105 Q110 | I61-V65 HydrophobicContact CG2-CG2 4.26Å; I61-V65 PolarHBondContact O-N 3.48Å; I61-V65 VanDerWaalsContact O-N 3.1Å; V65-N67 PolarHBondContact O-N 3.09Å; V65-Y103 WeakPolarHBondContact CA-O 3.48Å; V65-W105 HydrophobicContact CG2-CB 4.16Å; V65-W105 HydrophobicContact CG2-CE3 3.94Å; V65-Q110 HydrophobicContact CG2-CG 4.14Å |
| 66 | N | 76.1 | Confident | 63.3 | Low | 64 Ų | 64 | 63 Ų | 63 | 34% | 0.342 | 39% | 0.391 | S | S | . | . | trans | -77 | 87.3 | 177.1 | -167.5 | 4 | 0 | 0 | 0 | 111.5 | T68 A102 Y103 | N66-T68 PolarHBondContact O-N 3.45Å; N66-T68 VanDerWaalsContact O-N 3.11Å; N66-T68 PolarHBondContact OD1-N 3.03Å; N66-T68 PolarHBondContact OD1-OG1 3.07Å; N66-A102 HydrophobicContact CB-CB 4.17Å; N66-Y103 PolarHBondContact N-O 3.49Å | ||
| 67 | N | 59.2 | Low | 60.7 | Low | 112 Ų | 112 | 68.4 Ų | 68.4 | 60% | 0.599 | 43% | 0.429 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -73.3 | 6.3 | 177 | -64.5 | -47.8 | 0 | 0 | 0 | 113.8 | P62 V65 | P62-N67 PolarHBondContact O-ND2 3.24Å; V65-N67 PolarHBondContact O-N 3.09Å |
| 68 | T | 43.1 | Very low | 57.9 | Low | 118 Ų | 118 | 75.7 Ų | 75.7 | 72% | 0.724 | 47% | 0.473 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -118.2 | -0.9 | -171 | -13.5 | 0 | 0 | 0 | 0 | 114 | N66 P70 | N66-T68 PolarHBondContact O-N 3.45Å; N66-T68 VanDerWaalsContact O-N 3.11Å; N66-T68 PolarHBondContact OD1-N 3.03Å; N66-T68 PolarHBondContact OD1-OG1 3.07Å; T68-P70 WeakPolarHBondContact O-CD 3.15Å |
| 69 | A | 28.6 | Very low | 54.9 | Low | 58 Ų | 58 | 82.6 Ų | 82.6 | 48% | 0.479 | 51% | 0.505 | S | S | . | . | trans | -84.1 | 109.2 | 176.3 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 70 | P | 32.5 | Very low | 52.1 | Low | 104 Ų | 104 | 92.2 Ų | 92.2 | 68% | 0.675 | 54% | 0.542 | S | S | * | . | trans | -60.7 | 152.2 | 160.6 | 26.9 | -31.5 | 0 | 0 | 0 | 108.9 | T68 S72 | T68-P70 WeakPolarHBondContact O-CD 3.15Å; P70-S72 PolarHBondContact O-N 3.19Å; P70-S72 VanDerWaalsContact O-N 3.12Å | ||
| 71 | P | 32.5 | Very low | 49.7 | Very low | 123 Ų | 123 | 97.9 Ų | 97.9 | 80% | 0.799 | 58% | 0.578 | S | S | * | * | S | Bend | trans | -52.4 | 125.1 | 170.6 | 22.1 | -30.9 | 0 | 0 | 0 | 108.2 | Q73 | P71-Q73 PolarHBondContact O-N 3.19Š|
| 72 | S | 28.7 | Very low | 47.3 | Very low | 122 Ų | 122 | 102.8 Ų | 102.8 | 85% | 0.853 | 61% | 0.613 | S | S | * | * | trans | -45.4 | 107.8 | -172.3 | 51.6 | 0 | 0 | 0 | 0 | 112.5 | P70 | P70-S72 PolarHBondContact O-N 3.19Å; P70-S72 VanDerWaalsContact O-N 3.12Å | ||
| 73 | Q | 28.6 | Very low | 44.5 | Very low | 184 Ų | 184 | 108.9 Ų | 108.9 | 86% | 0.86 | 65% | 0.65 | S | S | * | * | trans | -115 | 135.8 | 160.3 | -83.4 | -169.5 | -23.7 | 0 | 0 | 109.1 | P71 | P71-Q73 PolarHBondContact O-N 3.19Š| ||
| 74 | P | 31.6 | Very low | 42.5 | Very low | 114 Ų | 114 | 113.9 Ų | 113.9 | 74% | 0.74 | 67% | 0.673 | S | S | * | * | trans | -86.3 | 142.5 | -174.4 | 29.2 | -22.8 | 0 | 0 | 0 | 112.3 | ||||
| 75 | N | 31.4 | Very low | 40.1 | Very low | 162 Ų | 162 | 119.5 Ų | 119.5 | 87% | 0.866 | 71% | 0.712 | S | S | * | * | trans | 71.3 | 110.3 | 158.1 | -57.8 | -19.4 | 0 | 0 | 0 | 118.7 | ||||
| 76 | A | 30.6 | Very low | 38 | Very low | 107 Ų | 107 | 126.5 Ų | 126.5 | 88% | 0.884 | 74% | 0.744 | S | S | * | * | trans | -160.1 | 123.2 | 133.2 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 77 | S | 38.3 | Very low | 36.5 | Very low | 112 Ų | 112 | 126.8 Ų | 126.8 | 78% | 0.783 | 75% | 0.746 | S | S | * | * | trans | -94.4 | 135.9 | 177.8 | 50.5 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 78 | T | 32.8 | Very low | 35.5 | Very low | 153 Ų | 153 | 130.3 Ų | 130.3 | 94% | 0.939 | 75% | 0.752 | S | S | * | * | trans | -158.2 | 137.3 | 146.8 | -8.8 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 79 | E | 29.9 | Very low | 35.4 | Very low | 149 Ų | 149 | 134.9 Ų | 134.9 | 70% | 0.696 | 76% | 0.756 | S | S | * | * | trans | -87.6 | 148.8 | -177 | -82.5 | -176 | 107.4 | 0 | 0 | 115.1 | ||||
| 80 | R | 31.5 | Very low | 36.1 | Very low | 205 Ų | 205 | 136.4 Ų | 136.4 | 77% | 0.774 | 76% | 0.756 | S | S | * | * | trans | 74.5 | 161.2 | 141.5 | -81.5 | -174.7 | -137.4 | -178.6 | 7.1 | 122.9 | ||||
| 81 | P | 41.6 | Very low | 36.7 | Very low | 119 Ų | 119 | 137.3 Ų | 137.3 | 77% | 0.773 | 75% | 0.751 | S | S | * | * | cis | -132.8 | -177.6 | -24.7 | 33.8 | -12.8 | 0 | 0 | 0 | 115.4 | ||||
| 82 | S | 41.6 | Very low | 37.3 | Very low | 103 Ų | 103 | 133.3 Ų | 133.3 | 72% | 0.72 | 73% | 0.725 | S | S | * | * | trans | -70.9 | 157.5 | -166.5 | 49.5 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 83 | T | 31.9 | Very low | 38.2 | Very low | 139 Ų | 139 | 132.1 Ų | 132.1 | 85% | 0.853 | 71% | 0.708 | S | S | * | * | trans | -151.8 | 123.4 | 144.2 | -38.7 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 84 | D | 44 | Very low | 39 | Very low | 129 Ų | 129 | 130.6 Ų | 130.6 | 69% | 0.69 | 70% | 0.699 | S | S | * | * | trans | -72.3 | 148.1 | -171.7 | -77.9 | -57.7 | 0 | 0 | 0 | 116.7 | ||||
| 85 | S | 40 | Very low | 39.5 | Very low | 117 Ų | 117 | 131.1 Ų | 131.1 | 82% | 0.818 | 69% | 0.692 | S | S | * | * | S | Bend | 157.2 | -7.9 | 126.2 | 53.2 | 0 | 0 | 0 | 0 | 112.9 | |||
| 86 | Q | 42.6 | Very low | 40.2 | Very low | 163 Ų | 163 | 128.3 Ų | 128.3 | 76% | 0.762 | 67% | 0.672 | S | S | * | * | S | Bend | trans | -102.7 | 9.3 | 170.2 | -152 | 157.5 | -11.2 | 0 | 0 | 112.2 | N90 | Q86-N90 PolarHBondContact O-ND2 3.22Š|
| 87 | D | 45.6 | Very low | 40.9 | Very low | 70 Ų | 70 | 131.5 Ų | 131.5 | 37% | 0.374 | 67% | 0.666 | S | S | . | * | H | α-helix | trans | -90.2 | -21.6 | -174.7 | -72.2 | -42.3 | 0 | 0 | 0 | 113.1 | W89 N90 E91 | D87-W89 PolarHBondContact O-N 3.35Å; D87-N90 CarbonylContact O-C 3.58Å; D87-N90 PolarHBondContact O-N 2.91Å; D87-E91 HydrophobicContact CB-CG 4.48Å; D87-E91 WeakPolarHBondContact O-CA 3.24Å; D87-E91 WeakPolarHBondContact O-CB 3.47Å; D87-E91 VanDerWaalsContact O-CG 3.31Å; D87-E91 WeakPolarHBondContact O-CG 3.41Å; D87-E91 PolarHBondContact O-N 2.89Å |
| 88 | Y | 38.9 | Very low | 41.5 | Very low | 185 Ų | 185 | 131.5 Ų | 131.5 | 73% | 0.725 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -65.6 | -45.8 | -176.4 | -161.3 | -96 | 0 | 0 | 0 | 112.9 | T92 | Y88-T92 PolarHBondContact O-N 2.79Å; Y88-T92 PolarHBondContact O-OG1 3.49Å |
| 89 | W | 41 | Very low | 42.5 | Very low | 214 Ų | 214 | 131.2 Ų | 131.2 | 81% | 0.811 | 65% | 0.651 | S | S | * | * | H | α-helix | trans | -71 | -34.5 | 175.1 | -77.7 | 103.2 | 0 | 0 | 0 | 112.6 | D87 L93 | D87-W89 PolarHBondContact O-N 3.35Å; W89-L93 WeakPolarHBondContact O-CB 3.37Å; W89-L93 PolarHBondContact O-N 2.86Å |
| 90 | N | 42.3 | Very low | 44.3 | Very low | 91 Ų | 91 | 125.4 Ų | 125.4 | 49% | 0.487 | 63% | 0.628 | S | S | . | * | H | α-helix | trans | -73.6 | -35.4 | 178 | -73.9 | -24.7 | 0 | 0 | 0 | 111.7 | Q86 D87 K94 | Q86-N90 PolarHBondContact O-ND2 3.22Å; D87-N90 CarbonylContact O-C 3.58Å; D87-N90 PolarHBondContact O-N 2.91Å; N90-K94 WeakPolarHBondContact O-CA 3.39Å; N90-K94 WeakPolarHBondContact O-CB 3.2Å; N90-K94 PolarHBondContact O-N 3.43Å |
| 91 | E | 45 | Very low | 46.4 | Very low | 122 Ų | 122 | 118 Ų | 118 | 57% | 0.57 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -71.1 | -41.7 | 173.1 | -79.7 | -160.9 | 148.3 | 0 | 0 | 111.2 | D87 K94 E95 | D87-E91 HydrophobicContact CB-CG 4.48Å; D87-E91 WeakPolarHBondContact O-CA 3.24Å; D87-E91 WeakPolarHBondContact O-CB 3.47Å; D87-E91 VanDerWaalsContact O-CG 3.31Å; D87-E91 WeakPolarHBondContact O-CG 3.41Å; D87-E91 PolarHBondContact O-N 2.89Å; E91-K94 CarbonylContact O-C 3.52Å; E91-K94 PolarHBondContact O-N 3.38Å; E91-E95 VanDerWaalsContact O-CB 3.32Å; E91-E95 WeakPolarHBondContact O-CB 3.19Å; E91-E95 PolarHBondContact O-N 3.01Å |
| 92 | T | 45.4 | Very low | 48.5 | Very low | 40 Ų | 40 | 115.1 Ų | 115.1 | 25% | 0.245 | 59% | 0.593 | C | S | . | * | H | α-helix | trans | -64.9 | -43.9 | 175.3 | -34.5 | 0 | 0 | 0 | 0 | 110.5 | Y88 K94 E95 F96 | Y88-T92 PolarHBondContact O-N 2.79Å; Y88-T92 PolarHBondContact O-OG1 3.49Å; T92-K94 VanDerWaalsContact C-N 3.29Å; T92-K94 PolarHBondContact O-N 2.82Å; T92-E95 PolarHBondContact O-N 2.75Å; T92-F96 HydrophobicContact CG2-CD2 3.96Å; T92-F96 HydrophobicContact CG2-CE2 3.75Å; T92-F96 WeakPolarHBondContact O-CD2 3.14Å; T92-F96 PolarHBondContact O-N 2.95Å |
| 93 | L | 46.6 | Very low | 50.7 | Low | 97 Ų | 97 | 111.6 Ų | 111.6 | 51% | 0.508 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -65.6 | -33.5 | 175.5 | -159.4 | 97.6 | 0 | 0 | 0 | 111.8 | W89 K97 | W89-L93 WeakPolarHBondContact O-CB 3.37Å; W89-L93 PolarHBondContact O-N 2.86Å; L93-K97 VanDerWaalsContact O-CB 3.27Å; L93-K97 WeakPolarHBondContact O-CB 3.38Å; L93-K97 PolarHBondContact O-N 3.22Å |
| 94 | K | 46 | Very low | 53.4 | Low | 152 Ų | 152 | 111.3 Ų | 111.3 | 66% | 0.661 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -72.2 | -41.8 | 175.6 | -164.6 | 175.8 | -171.2 | -175.1 | 0 | 110.5 | N90 E91 T92 K97 T98 | N90-K94 WeakPolarHBondContact O-CA 3.39Å; N90-K94 WeakPolarHBondContact O-CB 3.2Å; N90-K94 PolarHBondContact O-N 3.43Å; E91-K94 CarbonylContact O-C 3.52Å; E91-K94 PolarHBondContact O-N 3.38Å; T92-K94 VanDerWaalsContact C-N 3.29Å; T92-K94 PolarHBondContact O-N 2.82Å; K94-K97 CarbonylContact O-C 3.55Å; K94-K97 WeakPolarHBondContact O-CA 3.15Å; K94-K97 WeakPolarHBondContact O-CB 3.06Å; K94-K97 PolarHBondContact O-N 3.3Å; K94-K97 VanDerWaalsContact O-N 3.14Å; K94-T98 PolarHBondContact O-N 2.98Å; K94-T98 PolarHBondContact O-OG1 2.9Å |
| 95 | E | 43.6 | Very low | 55.7 | Low | 125 Ų | 125 | 106 Ų | 106 | 58% | 0.584 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -59.5 | -45.2 | 171.4 | -87.2 | -171.3 | 142.7 | 0 | 0 | 112.1 | E91 T92 K97 T98 M99 | E91-E95 VanDerWaalsContact O-CB 3.32Å; E91-E95 WeakPolarHBondContact O-CB 3.19Å; E91-E95 PolarHBondContact O-N 3.01Å; T92-E95 PolarHBondContact O-N 2.75Å; E95-K97 VanDerWaalsContact C-N 3.31Å; E95-K97 PolarHBondContact O-N 3.41Å; E95-T98 VanDerWaalsContact CA-OG1 3.26Å; E95-T98 WeakPolarHBondContact CA-OG1 3.43Å; E95-T98 PolarHBondContact O-N 3.49Å; E95-T98 VanDerWaalsContact O-N 3.14Å; E95-T98 PolarHBondContact O-OG1 3.39Å; E95-M99 WeakPolarHBondContact O-CG 3.48Å; E95-M99 PolarHBondContact O-N 3.47Å |
| 96 | F | 44.4 | Very low | 58.2 | Low | 103 Ų | 103 | 102.5 Ų | 102.5 | 45% | 0.452 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -64.4 | -36.5 | 173.3 | -84 | -68.5 | 0 | 0 | 0 | 111.8 | T92 T98 M99 | T92-F96 HydrophobicContact CG2-CD2 3.96Å; T92-F96 HydrophobicContact CG2-CE2 3.75Å; T92-F96 WeakPolarHBondContact O-CD2 3.14Å; T92-F96 PolarHBondContact O-N 2.95Å; F96-T98 VanDerWaalsContact C-N 3.33Å; F96-M99 PolarHBondContact O-N 2.93Å |
| 97 | K | 46.5 | Very low | 60.5 | Low | 173 Ų | 173 | 96.6 Ų | 96.6 | 75% | 0.752 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -70.1 | -27 | 172.8 | -162.2 | 177.5 | -176.9 | -176.4 | 0 | 112.5 | L93 K94 E95 | L93-K97 VanDerWaalsContact O-CB 3.27Å; L93-K97 WeakPolarHBondContact O-CB 3.38Å; L93-K97 PolarHBondContact O-N 3.22Å; K94-K97 CarbonylContact O-C 3.55Å; K94-K97 WeakPolarHBondContact O-CA 3.15Å; K94-K97 WeakPolarHBondContact O-CB 3.06Å; K94-K97 PolarHBondContact O-N 3.3Å; K94-K97 VanDerWaalsContact O-N 3.14Å; E95-K97 VanDerWaalsContact C-N 3.31Å; E95-K97 PolarHBondContact O-N 3.41Å |
| 98 | T | 50.1 | Low | 62.8 | Low | 112 Ų | 112 | 97.1 Ų | 97.1 | 69% | 0.687 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -79.7 | -13.1 | 174.1 | -1.1 | 0 | 0 | 0 | 0 | 114.1 | K94 E95 F96 | K94-T98 PolarHBondContact O-N 2.98Å; K94-T98 PolarHBondContact O-OG1 2.9Å; E95-T98 VanDerWaalsContact CA-OG1 3.26Å; E95-T98 WeakPolarHBondContact CA-OG1 3.43Å; E95-T98 PolarHBondContact O-N 3.49Å; E95-T98 VanDerWaalsContact O-N 3.14Å; E95-T98 PolarHBondContact O-OG1 3.39Å; F96-T98 VanDerWaalsContact C-N 3.33Å |
| 99 | M | 53.8 | Low | 65.4 | Low | 148 Ų | 148 | 91.1 Ų | 91.1 | 73% | 0.729 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -80.8 | -25.9 | -178.2 | -77.9 | -163.5 | -169.5 | 0 | 0 | 114.5 | E95 F96 | E95-M99 WeakPolarHBondContact O-CG 3.48Å; E95-M99 PolarHBondContact O-N 3.47Å; F96-M99 PolarHBondContact O-N 2.93Å |
| 100 | A | 67.4 | Low | 68 | Low | 26 Ų | 26 | 81.7 Ų | 81.7 | 22% | 0.215 | 42% | 0.424 | C | S | . | . | S | Bend | trans | -92.8 | 125.5 | -179.1 | 0 | 0 | 0 | 0 | 0 | 110.7 | A102 | A100-A102 PolarHBondContact O-N 3.32Š|
| 101 | P | 77.1 | Confident | 70.5 | Confident | 51 Ų | 51 | 77.3 Ų | 77.3 | 33% | 0.331 | 40% | 0.4 | S | S | . | . | trans | -64.5 | 136.7 | -179 | 21.6 | -27 | 0 | 0 | 0 | 110.6 | N160 W228 | P101-N160 WeakPolarHBondContact CG-OD1 3.45Å; P101-W228 HydrophobicContact CG-CZ2 4.06Å; P101-W228 PolarHBondContact O-NE1 3.46Å | ||
| 102 | A | 84.3 | Confident | 72.9 | Confident | 57 Ų | 57 | 73.5 Ų | 73.5 | 47% | 0.471 | 39% | 0.385 | S | S | . | . | trans | -105.9 | 143.8 | 171.8 | 0 | 0 | 0 | 0 | 0 | 109.5 | M64 N66 A100 | M64-A102 CarbonylContact O-C 3.59Å; M64-A102 WeakPolarHBondContact O-CA 3.33Å; N66-A102 HydrophobicContact CB-CB 4.17Å; A100-A102 PolarHBondContact O-N 3.32Å | ||
| 103 | Y | 89 | Confident | 75.3 | Confident | 29 Ų | 29 | 71.6 Ų | 71.6 | 11% | 0.114 | 37% | 0.373 | C | S | . | . | B | Isolated β-bridge | trans | -117.5 | 146.7 | -175.8 | -51.7 | -81.4 | 0 | 0 | 0 | 111.6 | M64 V65 N66 W105 A159 N160 W228 | M64-Y103 HydrophobicContact CB-CD2 4.31Å; M64-Y103 HydrophobicContact CE-CE2 4.2Å; M64-Y103 WeakPolarHBondContact O-CD2 3.44Å; M64-Y103 PolarHBondContact O-N 3.02Å; V65-Y103 WeakPolarHBondContact CA-O 3.48Å; N66-Y103 PolarHBondContact N-O 3.49Å; Y103-W105 VanDerWaalsContact C-N 3.25Å; Y103-W105 HydrophobicContact CD1-CZ2 4.11Å; Y103-W105 HydrophobicContact CD2-CD2 4.48Å; Y103-W105 AromaticContact CD2-CE2 3.94Å; Y103-W105 AromaticContact CD2-CH2 3.59Å; Y103-W105 HydrophobicContact CD2-CH2 3.59Å; Y103-W105 AromaticContact CD2-CZ2 3.47Å; Y103-W105 HydrophobicContact CD2-CZ2 3.47Å; Y103-W105 VanDerWaalsContact CD2-CZ2 3.47Å; Y103-W105 HydrophobicContact CD2-CZ3 4.12Å; Y103-W105 AromaticContact CE2-CH2 3.96Å; Y103-W105 HydrophobicContact CE2-CH2 3.96Å; Y103-W105 AromaticContact CE2-CZ2 3.99Å; Y103-W105 HydrophobicContact CE2-CZ2 3.99Å; Y103-W105 HydrophobicContact CG-CD2 4.34Å; Y103-W105 AromaticContact CG-CE2 3.65Å; Y103-W105 HydrophobicContact CG-CH2 4.15Å; Y103-W105 AromaticContact CG-CZ2 3.54Å; Y103-W105 HydrophobicContact CG-CZ2 3.54Å; Y103-W105 AromaticContact CG-NE1 3.89Å; Y103-W105 PolarHBondContact O-N 3.03Å; Y103-A159 HydrophobicContact CE1-CB 4.47Å; Y103-A159 WeakPolarHBondContact CE1-O 3.3Å; Y103-A159 HydrophobicContact CE2-CB 3.82Å; Y103-A159 VanDerWaalsContact OH-C 3.26Å; Y103-A159 VanDerWaalsContact OH-CB 3.29Å; Y103-A159 WeakPolarHBondContact OH-CB 3.36Å; Y103-N160 PolarHBondContact OH-N 3.4Å; Y103-N160 VanDerWaalsContact OH-N 3.15Å; Y103-N160 PolarHBondContact OH-OD1 3.44Å; Y103-W228 HydrophobicContact CE2-CH2 4.05Å; Y103-W228 AromaticContact CE2-CZ2 3.56Å; Y103-W228 HydrophobicContact CE2-CZ2 3.56Å |
| 104 | D | 87.9 | Confident | 77.6 | Confident | 133 Ų | 133 | 67.6 Ų | 67.6 | 71% | 0.711 | 35% | 0.352 | S | S | * | . | trans | -86.9 | 62.8 | 177.3 | -62.3 | -30.6 | 0 | 0 | 0 | 110.7 | ||||
| 105 | W | 92.3 | Very high | 80 | Confident | 19 Ų | 19 | 60.3 Ų | 60.3 | 7% | 0.072 | 32% | 0.321 | C | S | . | . | trans | -90.3 | 119.1 | 177.6 | -60.8 | -21.6 | 0 | 0 | 0 | 111.2 | M64 V65 Y103 I109 Q110 I113 A159 L166 | M64-W105 HydrophobicContact CB-CZ3 4.03Å; M64-W105 HydrophobicContact CE-CH2 3.39Å; M64-W105 HydrophobicContact CE-CZ3 3.58Å; M64-W105 HydrophobicContact SD-CZ3 4.22Å; V65-W105 HydrophobicContact CG2-CB 4.16Å; V65-W105 HydrophobicContact CG2-CE3 3.94Å; Y103-W105 VanDerWaalsContact C-N 3.25Å; Y103-W105 HydrophobicContact CD1-CZ2 4.11Å; Y103-W105 HydrophobicContact CD2-CD2 4.48Å; Y103-W105 AromaticContact CD2-CE2 3.94Å; Y103-W105 AromaticContact CD2-CH2 3.59Å; Y103-W105 HydrophobicContact CD2-CH2 3.59Å; Y103-W105 AromaticContact CD2-CZ2 3.47Å; Y103-W105 HydrophobicContact CD2-CZ2 3.47Å; Y103-W105 VanDerWaalsContact CD2-CZ2 3.47Å; Y103-W105 HydrophobicContact CD2-CZ3 4.12Å; Y103-W105 AromaticContact CE2-CH2 3.96Å; Y103-W105 HydrophobicContact CE2-CH2 3.96Å; Y103-W105 AromaticContact CE2-CZ2 3.99Å; Y103-W105 HydrophobicContact CE2-CZ2 3.99Å; Y103-W105 HydrophobicContact CG-CD2 4.34Å; Y103-W105 AromaticContact CG-CE2 3.65Å; Y103-W105 HydrophobicContact CG-CH2 4.15Å; Y103-W105 AromaticContact CG-CZ2 3.54Å; Y103-W105 HydrophobicContact CG-CZ2 3.54Å; Y103-W105 AromaticContact CG-NE1 3.89Å; Y103-W105 PolarHBondContact O-N 3.03Å; W105-I109 HydrophobicContact CB-CB 4.34Å; W105-I109 HydrophobicContact CB-CG2 4.05Å; W105-I109 HydrophobicContact CG-CG2 4.08Å; W105-Q110 HydrophobicContact CB-CG 4.07Å; W105-Q110 PolarHBondContact O-NE2 2.86Å; W105-I113 HydrophobicContact CD2-CD1 3.97Å; W105-I113 HydrophobicContact CE3-CD1 3.85Å; W105-I113 HydrophobicContact CH2-CD1 4.32Å; W105-I113 HydrophobicContact CZ2-CD1 4.47Å; W105-I113 HydrophobicContact CZ3-CD1 4.03Å; W105-A159 HydrophobicContact CH2-CB 4.06Å; W105-A159 HydrophobicContact CZ2-CB 4.24Å; W105-L166 HydrophobicContact CH2-CD2 3.76Å; W105-L166 HydrophobicContact CZ2-CD2 4.16Å; W105-L166 HydrophobicContact CZ3-CD2 4.49Å | ||
| 106 | S | 91.6 | Very high | 82.5 | Confident | 43 Ų | 43 | 54.4 Ų | 54.4 | 30% | 0.301 | 29% | 0.293 | S | S | . | . | trans | -60.5 | 155.7 | 171.3 | 68.2 | 0 | 0 | 0 | 0 | 111.3 | E108 I109 Q110 | S106-E108 PolarHBondContact O-N 3.32Å; S106-E108 VanDerWaalsContact O-N 3.15Å; S106-I109 PolarHBondContact O-N 3.16Å; S106-I109 WeakPolarHBondContact OG-CG1 3.35Å; S106-I109 PolarHBondContact OG-N 2.95Å; S106-Q110 WeakPolarHBondContact O-CG 3.46Å; S106-Q110 PolarHBondContact O-N 3.32Å | ||
| 107 | P | 91.3 | Very high | 84.8 | Confident | 39 Ų | 39 | 49.7 Ų | 49.7 | 25% | 0.253 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -55.1 | -31.1 | 175.5 | -27.4 | 35.9 | 0 | 0 | 0 | 113.7 | Q110 G111 G448 I451 | P107-Q110 PolarHBondContact O-N 3.34Å; P107-G111 PolarHBondContact O-N 3.39Å; P107-G448 CarbonylContact C-O 3.17Å; P107-G448 WeakPolarHBondContact O-CA 3.4Å; P107-I451 HydrophobicContact CB-CB 3.96Å; P107-I451 HydrophobicContact CB-CG2 3.72Å; P107-I451 HydrophobicContact CG-CG2 4.01Å |
| 108 | E | 93.6 | Very high | 87 | Confident | 81 Ų | 81 | 41.6 Ų | 41.6 | 38% | 0.379 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -60 | -52.1 | 171.2 | -80.4 | 164 | -154.8 | 0 | 0 | 112 | S106 Q110 G111 V112 G448 F449 S452 | S106-E108 PolarHBondContact O-N 3.32Å; S106-E108 VanDerWaalsContact O-N 3.15Å; E108-Q110 VanDerWaalsContact C-N 3.31Å; E108-Q110 PolarHBondContact O-N 3.45Å; E108-G111 PolarHBondContact O-N 3.15Å; E108-G111 VanDerWaalsContact O-N 3.17Å; E108-V112 WeakPolarHBondContact O-CG2 3.49Å; E108-V112 PolarHBondContact O-N 3.31Å; E108-G448 PolarHBondContact N-O 3.21Å; E108-F449 HydrophobicContact CG-CB 4.32Å; E108-F449 HydrophobicContact CG-CD2 4.22Å; E108-S452 VanDerWaalsContact CD-OG 3.31Å; E108-S452 VanDerWaalsContact CG-OG 3.3Å; E108-S452 WeakPolarHBondContact CG-OG 3.24Å; E108-S452 VanDerWaalsContact OE1-CB 3.31Å; E108-S452 WeakPolarHBondContact OE1-CB 3.49Å; E108-S452 PolarHBondContact OE1-OG 3.47Å |
| 109 | I | 94.5 | Very high | 89 | Confident | 58 Ų | 58 | 39.7 Ų | 39.7 | 30% | 0.297 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -61.5 | -43.1 | 178.9 | -68.4 | 168.5 | 0 | 0 | 0 | 110.1 | W105 S106 G111 V112 I113 V163 | W105-I109 HydrophobicContact CB-CB 4.34Å; W105-I109 HydrophobicContact CB-CG2 4.05Å; W105-I109 HydrophobicContact CG-CG2 4.08Å; S106-I109 PolarHBondContact O-N 3.16Å; S106-I109 WeakPolarHBondContact OG-CG1 3.35Å; S106-I109 PolarHBondContact OG-N 2.95Å; I109-G111 VanDerWaalsContact C-N 3.3Å; I109-G111 PolarHBondContact O-N 3.08Å; I109-V112 PolarHBondContact O-N 3.4Å; I109-I113 HydrophobicContact CG2-CD1 3.73Å; I109-I113 HydrophobicContact CG2-CG1 4.23Å; I109-I113 VanDerWaalsContact O-CG1 3.28Å; I109-I113 WeakPolarHBondContact O-CG1 3.24Å; I109-I113 PolarHBondContact O-N 3.21Å; I109-V163 HydrophobicContact CG2-CG1 3.68Å; I109-V163 HydrophobicContact CG2-CG2 4.19Å |
| 110 | Q | 94.7 | Very high | 90.3 | Very high | 16 Ų | 16 | 33 Ų | 33 | 8% | 0.075 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -57.6 | -44.3 | 175.8 | -65.8 | 173.7 | 39.1 | 0 | 0 | 111.5 | I61 V65 W105 S106 P107 E108 I113 L114 | I61-Q110 HydrophobicContact CD1-CB 4.23Å; I61-Q110 HydrophobicContact CG2-CB 4.44Å; I61-Q110 HydrophobicContact CG2-CG 4.08Å; I61-Q110 VanDerWaalsContact CG2-OE1 3.3Å; V65-Q110 HydrophobicContact CG2-CG 4.14Å; W105-Q110 HydrophobicContact CB-CG 4.07Å; W105-Q110 PolarHBondContact O-NE2 2.86Å; S106-Q110 WeakPolarHBondContact O-CG 3.46Å; S106-Q110 PolarHBondContact O-N 3.32Å; P107-Q110 PolarHBondContact O-N 3.34Å; E108-Q110 VanDerWaalsContact C-N 3.31Å; E108-Q110 PolarHBondContact O-N 3.45Å; Q110-I113 PolarHBondContact O-N 3.37Å; Q110-L114 WeakPolarHBondContact O-CB 3.3Å; Q110-L114 VanDerWaalsContact O-CG 3.32Å; Q110-L114 WeakPolarHBondContact O-CG 3.48Å; Q110-L114 PolarHBondContact O-N 3.11Å |
| 111 | G | 94.9 | Very high | 91.3 | Very high | 0 Ų | 0 | 31.9 Ų | 31.9 | 0% | 0 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -61.1 | -42.4 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113 | P107 E108 I109 L114 S115 Y314 P444 | P107-G111 PolarHBondContact O-N 3.39Å; E108-G111 PolarHBondContact O-N 3.15Å; E108-G111 VanDerWaalsContact O-N 3.17Å; I109-G111 VanDerWaalsContact C-N 3.3Å; I109-G111 PolarHBondContact O-N 3.08Å; G111-L114 PolarHBondContact O-N 3.28Å; G111-S115 VanDerWaalsContact O-CB 3.29Å; G111-S115 WeakPolarHBondContact O-CB 3.35Å; G111-S115 PolarHBondContact O-N 3.46Å; G111-S115 PolarHBondContact O-OG 2.68Å; G111-Y314 WeakPolarHBondContact CA-OH 3.32Å; G111-P444 WeakPolarHBondContact CA-O 3.38Å |
| 112 | V | 96.8 | Very high | 91.6 | Very high | 41 Ų | 41 | 32.2 Ų | 32.2 | 25% | 0.248 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -63.7 | -43.6 | 174.8 | 173.9 | 0 | 0 | 0 | 0 | 111.4 | E108 I109 S115 S116 Y119 I167 T445 | E108-V112 WeakPolarHBondContact O-CG2 3.49Å; E108-V112 PolarHBondContact O-N 3.31Å; I109-V112 PolarHBondContact O-N 3.4Å; V112-S115 PolarHBondContact O-N 3.18Å; V112-S116 WeakPolarHBondContact O-CB 3.4Å; V112-S116 PolarHBondContact O-N 3.12Å; V112-Y119 HydrophobicContact CG1-CE2 4.2Å; V112-I167 HydrophobicContact CG1-CD1 3.71Å; V112-I167 HydrophobicContact CG1-CG1 4.36Å; V112-T445 HydrophobicContact CG2-CG2 4.02Å |
| 113 | I | 96.1 | Very high | 91.4 | Very high | 0 Ų | 0 | 35.3 Ų | 35.3 | 0% | 0 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -64 | -42.8 | 177.7 | -61.9 | 164.4 | 0 | 0 | 0 | 110.4 | L57 W105 I109 Q110 S116 V163 L166 I167 | L57-I113 HydrophobicContact CD1-CG2 3.91Å; L57-I113 HydrophobicContact CD2-CB 4.41Å; L57-I113 HydrophobicContact CD2-CG2 3.5Å; L57-I113 HydrophobicContact CG-CG2 4.35Å; W105-I113 HydrophobicContact CD2-CD1 3.97Å; W105-I113 HydrophobicContact CE3-CD1 3.85Å; W105-I113 HydrophobicContact CH2-CD1 4.32Å; W105-I113 HydrophobicContact CZ2-CD1 4.47Å; W105-I113 HydrophobicContact CZ3-CD1 4.03Å; I109-I113 HydrophobicContact CG2-CD1 3.73Å; I109-I113 HydrophobicContact CG2-CG1 4.23Å; I109-I113 VanDerWaalsContact O-CG1 3.28Å; I109-I113 WeakPolarHBondContact O-CG1 3.24Å; I109-I113 PolarHBondContact O-N 3.21Å; Q110-I113 PolarHBondContact O-N 3.37Å; I113-S116 PolarHBondContact O-N 2.95Å; I113-S116 PolarHBondContact O-OG 3.22Å; I113-V163 HydrophobicContact CD1-CG1 4.27Å; I113-V163 HydrophobicContact CG1-CG1 4.3Å; I113-L166 HydrophobicContact CD1-CD2 3.99Å; I113-L166 HydrophobicContact CG1-CD2 4.32Å; I113-L166 HydrophobicContact CG2-CD2 3.81Å; I113-L166 HydrophobicContact CG2-CG 4.15Å; I113-I167 HydrophobicContact CG1-CG1 4.32Å |
| 114 | L | 94.6 | Very high | 91.2 | Very high | 13 Ų | 13 | 34.3 Ų | 34.3 | 7% | 0.068 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -62.8 | -41.8 | 176.2 | -73.7 | 162.6 | 0 | 0 | 0 | 111.8 | L57 I61 Q110 G111 A313 Y314 P444 | L57-L114 HydrophobicContact CD2-CD2 3.81Å; L57-L114 HydrophobicContact CD2-CG 4.2Å; I61-L114 HydrophobicContact CD1-CD1 3.82Å; I61-L114 HydrophobicContact CD1-CD2 3.87Å; I61-L114 HydrophobicContact CD1-CG 3.58Å; Q110-L114 WeakPolarHBondContact O-CB 3.3Å; Q110-L114 VanDerWaalsContact O-CG 3.32Å; Q110-L114 WeakPolarHBondContact O-CG 3.48Å; Q110-L114 PolarHBondContact O-N 3.11Å; G111-L114 PolarHBondContact O-N 3.28Å; L114-A313 HydrophobicContact CB-CB 4.31Å; L114-A313 HydrophobicContact CD1-CB 4.17Å; L114-A313 HydrophobicContact CD2-CB 4.24Å; L114-A313 HydrophobicContact CG-CB 4.47Å; L114-Y314 HydrophobicContact CD1-CE1 4.2Å; L114-Y314 HydrophobicContact CD1-CE2 4.23Å; L114-P444 HydrophobicContact CB-CB 3.92Å |
| 115 | S | 95.5 | Very high | 91 | Very high | 0 Ų | 0 | 28.3 Ų | 28.3 | 0% | 0 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -69.7 | -29.7 | 176.5 | -78.6 | 0 | 0 | 0 | 0 | 114.4 | G111 V112 L117 N118 Y119 A441 P444 T445 | G111-S115 VanDerWaalsContact O-CB 3.29Å; G111-S115 WeakPolarHBondContact O-CB 3.35Å; G111-S115 PolarHBondContact O-N 3.46Å; G111-S115 PolarHBondContact O-OG 2.68Å; V112-S115 PolarHBondContact O-N 3.18Å; S115-L117 PolarHBondContact O-N 3.35Å; S115-L117 VanDerWaalsContact O-N 3.11Å; S115-N118 WeakPolarHBondContact O-CA 3.26Å; S115-N118 WeakPolarHBondContact O-CB 3.41Å; S115-N118 PolarHBondContact O-N 3.44Å; S115-Y119 WeakPolarHBondContact CB-OH 3.42Å; S115-Y119 PolarHBondContact O-N 2.71Å; S115-A441 WeakPolarHBondContact CB-O 3.36Å; S115-A441 PolarHBondContact OG-O 3.12Å; S115-P444 WeakPolarHBondContact OG-CB 3.37Å; S115-P444 VanDerWaalsContact OG-CD 3.29Å; S115-P444 WeakPolarHBondContact OG-CD 3.39Å; S115-T445 WeakPolarHBondContact CB-OG1 3.31Å; S115-T445 PolarHBondContact OG-N 3.48Å; S115-T445 PolarHBondContact OG-OG1 2.87Å |
| 116 | S | 95.3 | Very high | 90.4 | Very high | 0 Ų | 0 | 32.2 Ų | 32.2 | 0% | 0 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -59.2 | -29.8 | -168.1 | 62.8 | 0 | 0 | 0 | 0 | 114.7 | V112 I113 N118 Y119 R170 I171 | V112-S116 WeakPolarHBondContact O-CB 3.4Å; V112-S116 PolarHBondContact O-N 3.12Å; I113-S116 PolarHBondContact O-N 2.95Å; I113-S116 PolarHBondContact O-OG 3.22Å; S116-N118 PolarHBondContact O-N 2.99Å; S116-Y119 VanDerWaalsContact CA-CD2 3.48Å; S116-Y119 PolarHBondContact O-N 2.99Å; S116-R170 WeakPolarHBondContact OG-CB 3.44Å; S116-I171 WeakPolarHBondContact O-CG1 3.5Å |
| 117 | L | 93.4 | Very high | 90 | Very high | 4 Ų | 4 | 33.3 Ų | 33.3 | 2% | 0.021 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -58.4 | -38.4 | 171.6 | -171.3 | 77.9 | 0 | 0 | 0 | 111.4 | Q54 S115 S121 Q173 G174 | Q54-L117 HydrophobicContact CB-CD2 4.26Å; Q54-L117 HydrophobicContact CG-CD2 3.68Å; S115-L117 PolarHBondContact O-N 3.35Å; S115-L117 VanDerWaalsContact O-N 3.11Å; L117-S121 PolarHBondContact O-OG 2.92Å; L117-Q173 HydrophobicContact CD1-CB 4.17Å; L117-Q173 HydrophobicContact CD1-CG 3.99Å; L117-G174 WeakPolarHBondContact O-CA 3.38Å |
| 118 | N | 93.4 | Very high | 89.6 | Confident | 4 Ų | 4 | 31.6 Ų | 31.6 | 2% | 0.021 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -83.4 | -20.1 | -178 | -71.8 | -56 | 0 | 0 | 0 | 113.8 | S115 S116 G120 S121 F122 H437 G440 A441 | S115-N118 WeakPolarHBondContact O-CA 3.26Å; S115-N118 WeakPolarHBondContact O-CB 3.41Å; S115-N118 PolarHBondContact O-N 3.44Å; S116-N118 PolarHBondContact O-N 2.99Å; N118-G120 VanDerWaalsContact C-N 3.33Å; N118-G120 PolarHBondContact O-N 3.47Å; N118-S121 PolarHBondContact O-N 3.37Å; N118-S121 VanDerWaalsContact O-N 3.16Å; N118-F122 PolarHBondContact O-N 3.34Å; N118-H437 PolarHBondContact OD1-ND1 3.42Å; N118-G440 VanDerWaalsContact CB-C 3.49Å; N118-G440 VanDerWaalsContact ND2-C 3.29Å; N118-G440 PolarHBondContact ND2-O 3.16Å; N118-A441 HydrophobicContact CB-CB 4Å |
| 119 | Y | 92 | Very high | 88.7 | Confident | 72 Ų | 72 | 29.5 Ų | 29.5 | 28% | 0.282 | 16% | 0.164 | S | C | . | . | H | α-helix | trans | -59.6 | -39.7 | 178.5 | -64.4 | -21.6 | 0 | 0 | 0 | 113 | V112 S115 S116 F122 I171 A441 T445 | V112-Y119 HydrophobicContact CG1-CE2 4.2Å; S115-Y119 WeakPolarHBondContact CB-OH 3.42Å; S115-Y119 PolarHBondContact O-N 2.71Å; S116-Y119 VanDerWaalsContact CA-CD2 3.48Å; S116-Y119 PolarHBondContact O-N 2.99Å; Y119-F122 VanDerWaalsContact O-CD1 3.29Å; Y119-F122 WeakPolarHBondContact O-CD1 3.35Å; Y119-F122 WeakPolarHBondContact O-CE1 3.24Å; Y119-I171 HydrophobicContact CD2-CD1 4.35Å; Y119-I171 HydrophobicContact CD2-CG1 4.42Å; Y119-A441 HydrophobicContact CD1-CB 3.64Å; Y119-A441 HydrophobicContact CE1-CB 4.01Å; Y119-A441 WeakPolarHBondContact CE1-O 3.49Å; Y119-T445 PolarHBondContact OH-OG1 3.38Å |
| 120 | G | 81.1 | Confident | 88.1 | Confident | 7 Ų | 7 | 34.8 Ų | 34.8 | 7% | 0.072 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -84.6 | -25.4 | 174.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | N118 F122 I175 | N118-G120 VanDerWaalsContact C-N 3.33Å; N118-G120 PolarHBondContact O-N 3.47Å; G120-F122 PolarHBondContact O-N 3.35Å; G120-I175 WeakPolarHBondContact O-CG1 3.27Å |
| 121 | S | 87.4 | Confident | 87.6 | Confident | 2 Ų | 2 | 36.1 Ų | 36.1 | 1% | 0.014 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -72.2 | -27.1 | -169.8 | -66.2 | 0 | 0 | 0 | 0 | 114.3 | L117 N118 L123 P125 G174 | L117-S121 PolarHBondContact O-OG 2.92Å; N118-S121 PolarHBondContact O-N 3.37Å; N118-S121 VanDerWaalsContact O-N 3.16Å; S121-L123 PolarHBondContact O-N 2.99Å; S121-P125 VanDerWaalsContact O-CD 3.22Å; S121-P125 WeakPolarHBondContact O-CD 3.39Å; S121-G174 VanDerWaalsContact OG-CA 3.27Å; S121-G174 WeakPolarHBondContact OG-CA 3.31Å; S121-G174 PolarHBondContact OG-O 3.39Å |
| 122 | F | 84.1 | Confident | 87 | Confident | 59 Ų | 59 | 36.3 Ų | 36.3 | 26% | 0.259 | 19% | 0.193 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -76 | -21.6 | -177.2 | 72.8 | -95.7 | 0 | 0 | 0 | 113.9 | N118 Y119 G120 P125 V434 H437 I438 | N118-F122 PolarHBondContact O-N 3.34Å; Y119-F122 VanDerWaalsContact O-CD1 3.29Å; Y119-F122 WeakPolarHBondContact O-CD1 3.35Å; Y119-F122 WeakPolarHBondContact O-CE1 3.24Å; G120-F122 PolarHBondContact O-N 3.35Å; F122-P125 WeakPolarHBondContact O-CD 2.98Å; F122-V434 HydrophobicContact CB-CG1 4.39Å; F122-V434 HydrophobicContact CD2-CG1 4.49Å; F122-V434 WeakPolarHBondContact O-CG2 3.29Å; F122-H437 HydrophobicContact CB-CB 3.54Å; F122-I438 HydrophobicContact CB-CG1 3.9Å; F122-I438 HydrophobicContact CD1-CG1 4.45Å; F122-I438 HydrophobicContact CD2-CD1 4.48Å; F122-I438 HydrophobicContact CD2-CG1 4.04Å; F122-I438 HydrophobicContact CG-CG1 3.89Å |
| 123 | L | 79.7 | Confident | 86.1 | Confident | 121 Ų | 121 | 37.5 Ų | 37.5 | 63% | 0.634 | 21% | 0.213 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -86 | -23.2 | 176.4 | -67.6 | 176.9 | 0 | 0 | 0 | 112.8 | S121 P125 P127 | S121-L123 PolarHBondContact O-N 2.99Å; L123-P125 VanDerWaalsContact C-CD 3.43Å; L123-P127 WeakPolarHBondContact O-CD 3.45Å; L123-P127 WeakPolarHBondContact O-CG 3.22Å |
| 124 | A | 84.1 | Confident | 85.6 | Confident | 8 Ų | 8 | 42.1 Ų | 42.1 | 7% | 0.066 | 24% | 0.237 | C | C | . | . | S | Bend | trans | -72.5 | -28.5 | -173.2 | 0 | 0 | 0 | 0 | 0 | 117.1 | I126 P127 S128 I175 V178 | A124-I126 PolarHBondContact O-N 3.4Å; A124-P127 WeakPolarHBondContact O-CD 3.32Å; A124-P127 WeakPolarHBondContact O-CG 3.49Å; A124-S128 WeakPolarHBondContact O-CB 3.48Å; A124-S128 PolarHBondContact O-N 3.49Å; A124-I175 HydrophobicContact CB-CG2 4.18Å; A124-V178 HydrophobicContact CB-CB 3.82Å; A124-V178 HydrophobicContact CB-CG1 3.62Å |
| 125 | P | 83.9 | Confident | 85.2 | Confident | 8 Ų | 8 | 48 Ų | 48 | 5% | 0.052 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -66 | -42.7 | -169.7 | -20.9 | 31.7 | 0 | 0 | 0 | 113.2 | S121 F122 L123 V178 T182 Q433 V434 | S121-P125 VanDerWaalsContact O-CD 3.22Å; S121-P125 WeakPolarHBondContact O-CD 3.39Å; F122-P125 WeakPolarHBondContact O-CD 2.98Å; L123-P125 VanDerWaalsContact C-CD 3.43Å; P125-V178 HydrophobicContact CB-CG1 4.11Å; P125-V178 HydrophobicContact CG-CG1 3.7Å; P125-T182 HydrophobicContact CB-CG2 4.16Å; P125-Q433 HydrophobicContact CB-CB 4.42Å; P125-Q433 HydrophobicContact CG-CB 4.29Å; P125-V434 HydrophobicContact CG-CG2 4.32Å |
| 126 | I | 80.1 | Confident | 84.7 | Confident | 100 Ų | 100 | 48.8 Ų | 48.8 | 51% | 0.513 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -66.4 | -55.1 | -178.3 | -58.8 | 174.3 | 0 | 0 | 0 | 111.8 | A124 S128 V434 | A124-I126 PolarHBondContact O-N 3.4Å; I126-S128 VanDerWaalsContact C-N 3.31Å; I126-S128 PolarHBondContact O-N 3.16Å; I126-V434 HydrophobicContact CD1-CG2 4.11Å; I126-V434 HydrophobicContact CG1-CG2 4.26Å |
| 127 | P | 83.2 | Confident | 84.4 | Confident | 66 Ų | 66 | 49 Ų | 49 | 43% | 0.429 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -67.6 | -30.1 | 179.6 | 26.5 | -34.7 | 0 | 0 | 0 | 112.7 | L123 A124 G129 Y130 V131 | L123-P127 WeakPolarHBondContact O-CD 3.45Å; L123-P127 WeakPolarHBondContact O-CG 3.22Å; A124-P127 WeakPolarHBondContact O-CD 3.32Å; A124-P127 WeakPolarHBondContact O-CG 3.49Å; P127-G129 VanDerWaalsContact C-N 3.31Å; P127-G129 PolarHBondContact O-N 3.37Å; P127-Y130 WeakPolarHBondContact O-CB 3.45Å; P127-Y130 PolarHBondContact O-N 2.96Å; P127-Y130 VanDerWaalsContact O-N 3.12Å; P127-V131 WeakPolarHBondContact O-CG2 3.41Å; P127-V131 PolarHBondContact O-N 3.46Å |
| 128 | S | 83.1 | Confident | 84.3 | Confident | 3 Ų | 3 | 50.1 Ų | 50.1 | 2% | 0.021 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -56.2 | -42.9 | -179.4 | 174.8 | 0 | 0 | 0 | 0 | 112.9 | A124 I126 Y130 V131 A132 M179 T182 | A124-S128 WeakPolarHBondContact O-CB 3.48Å; A124-S128 PolarHBondContact O-N 3.49Å; I126-S128 VanDerWaalsContact C-N 3.31Å; I126-S128 PolarHBondContact O-N 3.16Å; S128-Y130 VanDerWaalsContact C-N 3.32Å; S128-Y130 PolarHBondContact O-N 3.45Å; S128-V131 PolarHBondContact O-N 3.1Å; S128-A132 WeakPolarHBondContact O-CB 3.4Å; S128-A132 PolarHBondContact O-N 2.82Å; S128-M179 WeakPolarHBondContact OG-CA 3.49Å; S128-T182 VanDerWaalsContact CB-OG1 3.23Å; S128-T182 WeakPolarHBondContact CB-OG1 3.26Å; S128-T182 PolarHBondContact OG-OG1 2.66Å |
| 129 | G | 75.6 | Confident | 84.2 | Confident | 37 Ų | 37 | 56.4 Ų | 56.4 | 38% | 0.381 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -62.3 | -38.6 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | P127 G133 | P127-G129 VanDerWaalsContact C-N 3.31Å; P127-G129 PolarHBondContact O-N 3.37Å; G129-G133 PolarHBondContact O-N 2.93Å; G129-G133 VanDerWaalsContact O-N 3.14Å |
| 130 | Y | 80.3 | Confident | 84.2 | Confident | 169 Ų | 169 | 53.3 Ų | 53.3 | 66% | 0.663 | 29% | 0.29 | S | S | * | . | H | α-helix | trans | -67.9 | -45.5 | 176.5 | -179.7 | -104.9 | 0 | 0 | 0 | 111.8 | P127 S128 A132 G133 I134 | P127-Y130 WeakPolarHBondContact O-CB 3.45Å; P127-Y130 PolarHBondContact O-N 2.96Å; P127-Y130 VanDerWaalsContact O-N 3.12Å; S128-Y130 VanDerWaalsContact C-N 3.32Å; S128-Y130 PolarHBondContact O-N 3.45Å; Y130-A132 VanDerWaalsContact C-N 3.33Å; Y130-A132 PolarHBondContact O-N 3.2Å; Y130-G133 PolarHBondContact O-N 3.12Å; Y130-G133 VanDerWaalsContact O-N 3.09Å; Y130-I134 HydrophobicContact CD1-CD1 3.87Å; Y130-I134 HydrophobicContact CE1-CD1 3.26Å; Y130-I134 HydrophobicContact CE1-CG1 4.46Å; Y130-I134 HydrophobicContact CE2-CD1 4.11Å; Y130-I134 VanDerWaalsContact CZ-CD1 3.41Å; Y130-I134 PolarHBondContact O-N 3.29Å |
| 131 | V | 84.6 | Confident | 84.8 | Confident | 45 Ų | 45 | 53 Ų | 53 | 27% | 0.273 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -61.8 | -41.4 | 177.5 | 177.4 | 0 | 0 | 0 | 0 | 110.8 | P127 S128 G133 I134 F135 V140 | P127-V131 WeakPolarHBondContact O-CG2 3.41Å; P127-V131 PolarHBondContact O-N 3.46Å; S128-V131 PolarHBondContact O-N 3.1Å; V131-G133 VanDerWaalsContact C-N 3.27Å; V131-G133 PolarHBondContact O-N 3.21Å; V131-I134 PolarHBondContact O-N 2.93Å; V131-F135 HydrophobicContact CG1-CD2 3.69Å; V131-F135 HydrophobicContact CG1-CE2 4.25Å; V131-F135 PolarHBondContact O-N 3.26Å; V131-V140 HydrophobicContact CG1-CG2 3.85Å |
| 132 | A | 82.5 | Confident | 85.1 | Confident | 4 Ų | 4 | 52.9 Ų | 52.9 | 3% | 0.033 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -63 | -31.4 | 174.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | S128 Y130 G136 A137 V140 | S128-A132 WeakPolarHBondContact O-CB 3.4Å; S128-A132 PolarHBondContact O-N 2.82Å; Y130-A132 VanDerWaalsContact C-N 3.33Å; Y130-A132 PolarHBondContact O-N 3.2Å; A132-G136 CarbonylContact O-C 3.55Å; A132-G136 WeakPolarHBondContact O-CA 3.44Å; A132-G136 PolarHBondContact O-N 2.95Å; A132-A137 PolarHBondContact O-N 3.22Å; A132-V140 HydrophobicContact CB-CB 4.43Å; A132-V140 HydrophobicContact CB-CG1 4.35Å; A132-V140 HydrophobicContact CB-CG2 4.45Å |
| 133 | G | 78.9 | Confident | 85.5 | Confident | 65 Ų | 65 | 52.1 Ų | 52.1 | 67% | 0.67 | 29% | 0.29 | S | S | * | . | H | α-helix | trans | -69.4 | -35.9 | 174.5 | 0 | 0 | 0 | 0 | 0 | 113.7 | G129 Y130 V131 | G129-G133 PolarHBondContact O-N 2.93Å; G129-G133 VanDerWaalsContact O-N 3.14Å; Y130-G133 PolarHBondContact O-N 3.12Å; Y130-G133 VanDerWaalsContact O-N 3.09Å; V131-G133 VanDerWaalsContact C-N 3.27Å; V131-G133 PolarHBondContact O-N 3.21Å |
| 134 | I | 84.5 | Confident | 86.2 | Confident | 97 Ų | 97 | 46.3 Ų | 46.3 | 50% | 0.497 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -83.3 | -51.9 | -178.6 | -65.4 | 170.2 | 0 | 0 | 0 | 111.8 | Y130 V131 | Y130-I134 HydrophobicContact CD1-CD1 3.87Å; Y130-I134 HydrophobicContact CE1-CD1 3.26Å; Y130-I134 HydrophobicContact CE1-CG1 4.46Å; Y130-I134 HydrophobicContact CE2-CD1 4.11Å; Y130-I134 VanDerWaalsContact CZ-CD1 3.41Å; Y130-I134 PolarHBondContact O-N 3.29Å; V131-I134 PolarHBondContact O-N 2.93Å |
| 135 | F | 85.9 | Confident | 86.8 | Confident | 137 Ų | 137 | 46 Ų | 46 | 60% | 0.601 | 26% | 0.257 | S | S | * | . | H | α-helix | trans | -90.2 | -6.7 | -170.9 | -68.4 | -78.1 | 0 | 0 | 0 | 113.3 | V131 Y139 V140 | V131-F135 HydrophobicContact CG1-CD2 3.69Å; V131-F135 HydrophobicContact CG1-CE2 4.25Å; V131-F135 PolarHBondContact O-N 3.26Å; F135-Y139 VanDerWaalsContact O-CD2 3.29Å; F135-Y139 WeakPolarHBondContact O-CD2 3.36Å; F135-V140 HydrophobicContact CB-CG2 4.1Å |
| 136 | G | 86.3 | Confident | 87.4 | Confident | 16 Ų | 16 | 50.2 Ų | 50.2 | 17% | 0.165 | 27% | 0.274 | C | S | . | . | trans | 85.8 | 140.7 | -172.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | A132 K138 Y139 V140 | A132-G136 CarbonylContact O-C 3.55Å; A132-G136 WeakPolarHBondContact O-CA 3.44Å; A132-G136 PolarHBondContact O-N 2.95Å; G136-K138 VanDerWaalsContact C-N 3.3Å; G136-K138 PolarHBondContact O-N 3.46Å; G136-Y139 PolarHBondContact O-N 3.29Å; G136-V140 WeakPolarHBondContact O-CG2 3.49Å; G136-V140 PolarHBondContact O-N 3.13Å | ||
| 137 | A | 88.1 | Confident | 88.2 | Confident | 6 Ų | 6 | 48.8 Ų | 48.8 | 5% | 0.05 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -67.4 | -32.7 | -176.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | A132 Y139 V140 V141 I187 D252 | A132-A137 PolarHBondContact O-N 3.22Å; A137-Y139 PolarHBondContact O-N 3.45Å; A137-V140 PolarHBondContact O-N 3.32Å; A137-V141 VanDerWaalsContact O-CB 3.24Å; A137-V141 WeakPolarHBondContact O-CB 3.32Å; A137-V141 VanDerWaalsContact O-CG2 3.24Å; A137-V141 WeakPolarHBondContact O-CG2 3.26Å; A137-V141 PolarHBondContact O-N 3.18Å; A137-I187 HydrophobicContact CB-CD1 4.31Å; A137-I187 HydrophobicContact CB-CG1 3.54Å; A137-D252 WeakPolarHBondContact CA-OD1 3.47Å; A137-D252 PolarHBondContact N-OD1 3.45Å |
| 138 | K | 91.1 | Very high | 88.8 | Confident | 26 Ų | 26 | 45.6 Ų | 45.6 | 11% | 0.113 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -53 | -51.6 | 174.3 | 177.5 | -177.6 | 179.9 | 156.4 | 0 | 111.5 | G136 G142 W246 F247 I250 D252 | G136-K138 VanDerWaalsContact C-N 3.3Å; G136-K138 PolarHBondContact O-N 3.46Å; K138-G142 PolarHBondContact O-N 3.44Å; K138-W246 PolarHBondContact O-NE1 2.93Å; K138-F247 WeakPolarHBondContact CE-O 3.44Å; K138-F247 PolarHBondContact NZ-O 3.46Å; K138-I250 HydrophobicContact CB-CG2 4.32Å; K138-I250 WeakPolarHBondContact CD-O 3.24Å; K138-I250 WeakPolarHBondContact CE-O 3.24Å; K138-I250 HydrophobicContact CG-CG2 4.25Å; K138-I250 PolarHBondContact NZ-O 3.18Å; K138-D252 WeakPolarHBondContact CB-OD1 3.38Å; K138-D252 WeakPolarHBondContact CB-OD2 3.42Å; K138-D252 PolarHBondContact N-OD1 2.99Å |
| 139 | Y | 92.2 | Very high | 89.5 | Confident | 137 Ų | 137 | 45.5 Ų | 45.5 | 54% | 0.537 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -74.6 | -41 | -175.6 | -64.8 | -73.9 | 0 | 0 | 0 | 111.7 | F135 G136 A137 A143 F247 | F135-Y139 VanDerWaalsContact O-CD2 3.29Å; F135-Y139 WeakPolarHBondContact O-CD2 3.36Å; G136-Y139 PolarHBondContact O-N 3.29Å; A137-Y139 PolarHBondContact O-N 3.45Å; Y139-A143 WeakPolarHBondContact O-CB 3.38Å; Y139-A143 PolarHBondContact O-N 3.41Å; Y139-F247 HydrophobicContact CD1-CE1 4.31Å |
| 140 | V | 92.3 | Very high | 90.5 | Very high | 7 Ų | 7 | 47.9 Ų | 47.9 | 4% | 0.042 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -64.7 | -48 | 179.6 | 173.4 | 0 | 0 | 0 | 0 | 111.8 | V131 A132 F135 G136 A137 G144 M179 | V131-V140 HydrophobicContact CG1-CG2 3.85Å; A132-V140 HydrophobicContact CB-CB 4.43Å; A132-V140 HydrophobicContact CB-CG1 4.35Å; A132-V140 HydrophobicContact CB-CG2 4.45Å; F135-V140 HydrophobicContact CB-CG2 4.1Å; G136-V140 WeakPolarHBondContact O-CG2 3.49Å; G136-V140 PolarHBondContact O-N 3.13Å; A137-V140 PolarHBondContact O-N 3.32Å; V140-G144 PolarHBondContact O-N 2.98Å; V140-M179 HydrophobicContact CG1-CB 4.36Å; V140-M179 HydrophobicContact CG1-CE 3.79Å |
| 141 | V | 92.2 | Very high | 91.3 | Very high | 0 Ų | 0 | 41 Ų | 41 | 0% | 0 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -68.2 | -42.9 | 178.4 | 174.8 | 0 | 0 | 0 | 0 | 110.8 | A137 G144 L145 V180 G183 W246 | A137-V141 VanDerWaalsContact O-CB 3.24Å; A137-V141 WeakPolarHBondContact O-CB 3.32Å; A137-V141 VanDerWaalsContact O-CG2 3.24Å; A137-V141 WeakPolarHBondContact O-CG2 3.26Å; A137-V141 PolarHBondContact O-N 3.18Å; V141-G144 PolarHBondContact O-N 3.34Å; V141-L145 WeakPolarHBondContact O-CB 3.42Å; V141-L145 PolarHBondContact O-N 2.87Å; V141-V180 HydrophobicContact CG1-CG1 4.11Å; V141-V180 WeakPolarHBondContact O-CG2 3.34Å; V141-G183 VanDerWaalsContact CG2-C 3.48Å; V141-W246 HydrophobicContact CB-CH2 4.17Å; V141-W246 HydrophobicContact CB-CZ2 3.6Å; V141-W246 HydrophobicContact CG1-CH2 3.56Å; V141-W246 HydrophobicContact CG1-CZ2 3.42Å; V141-W246 VanDerWaalsContact CG1-CZ2 3.42Å; V141-W246 HydrophobicContact CG1-CZ3 4.19Å |
| 142 | G | 93.9 | Very high | 91.9 | Very high | 0 Ų | 0 | 38.8 Ų | 38.8 | 0% | 0 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -63 | -47.4 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | K138 L145 F146 C243 W246 | K138-G142 PolarHBondContact O-N 3.44Å; G142-L145 PolarHBondContact O-N 3.23Å; G142-F146 WeakPolarHBondContact O-CB 3.28Å; G142-F146 PolarHBondContact O-N 3.05Å; G142-C243 PolarHBondContact O-SG 2.97Å; G142-W246 VanDerWaalsContact CA-NE1 3.34Å |
| 143 | A | 93.8 | Very high | 92.6 | Very high | 42 Ų | 42 | 41 Ų | 41 | 35% | 0.347 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -64.1 | -42.1 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | Y139 L145 F146 I147 | Y139-A143 WeakPolarHBondContact O-CB 3.38Å; Y139-A143 PolarHBondContact O-N 3.41Å; A143-L145 PolarHBondContact O-N 3.47Å; A143-F146 PolarHBondContact O-N 3.22Å; A143-I147 WeakPolarHBondContact O-CB 3.39Å; A143-I147 WeakPolarHBondContact O-CD1 3.18Å; A143-I147 WeakPolarHBondContact O-CG1 3.47Å; A143-I147 PolarHBondContact O-N 3.44Å |
| 144 | G | 94.6 | Very high | 93.4 | Very high | 0 Ų | 0 | 41.7 Ų | 41.7 | 0% | 0 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -60.5 | -44.1 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | V140 V141 S148 V180 | V140-G144 PolarHBondContact O-N 2.98Å; V141-G144 PolarHBondContact O-N 3.34Å; G144-S148 WeakPolarHBondContact O-CB 3.2Å; G144-S148 PolarHBondContact O-N 2.93Å; G144-V180 VanDerWaalsContact C-CG2 3.45Å |
| 145 | L | 95.6 | Very high | 93.9 | Very high | 0 Ų | 0 | 37.1 Ų | 37.1 | 0% | 0 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -63.8 | -44.3 | 176.5 | 179.3 | 63.1 | 0 | 0 | 0 | 111.4 | C46 I50 V141 G142 A143 S149 V180 C242 C243 | C46-L145 HydrophobicContact CB-CD2 4.43Å; I50-L145 HydrophobicContact CD1-CD1 3.88Å; I50-L145 HydrophobicContact CG1-CD1 4.16Å; V141-L145 WeakPolarHBondContact O-CB 3.42Å; V141-L145 PolarHBondContact O-N 2.87Å; G142-L145 PolarHBondContact O-N 3.23Å; A143-L145 PolarHBondContact O-N 3.47Å; L145-S149 VanDerWaalsContact O-CB 3.24Å; L145-S149 WeakPolarHBondContact O-CB 3.01Å; L145-S149 PolarHBondContact O-N 3.49Å; L145-S149 PolarHBondContact O-OG 2.84Å; L145-V180 HydrophobicContact CB-CG2 4.12Å; L145-C242 HydrophobicContact CD2-CB 4.18Å; L145-C243 HydrophobicContact CD2-CB 4.21Å; L145-C243 HydrophobicContact CG-CB 4.31Å |
| 146 | F | 96.6 | Very high | 94.4 | Very high | 97 Ų | 97 | 30.7 Ų | 30.7 | 43% | 0.425 | 15% | 0.151 | S | C | . | . | H | α-helix | trans | -59.8 | -53.7 | 176.3 | -176.4 | -108.5 | 0 | 0 | 0 | 111.5 | G142 A143 S148 S149 F150 C243 | G142-F146 WeakPolarHBondContact O-CB 3.28Å; G142-F146 PolarHBondContact O-N 3.05Å; A143-F146 PolarHBondContact O-N 3.22Å; F146-S148 PolarHBondContact O-N 3.46Å; F146-S149 PolarHBondContact O-N 3.11Å; F146-F150 HydrophobicContact CE1-CB 4.48Å; F146-F150 HydrophobicContact CZ-CB 4.47Å; F146-F150 HydrophobicContact CZ-CD2 4.28Å; F146-F150 HydrophobicContact CZ-CG 4.45Å; F146-F150 WeakPolarHBondContact O-CB 3.37Å; F146-F150 PolarHBondContact O-N 2.89Å; F146-C243 HydrophobicContact CB-CB 4.46Å; F146-C243 VanDerWaalsContact CB-SG 3.59Å |
| 147 | I | 96.4 | Very high | 94.7 | Very high | 70 Ų | 70 | 34.9 Ų | 34.9 | 36% | 0.359 | 17% | 0.169 | S | C | . | . | H | α-helix | trans | -60 | -48.6 | -177.8 | -67.3 | 164.4 | 0 | 0 | 0 | 109.8 | A143 S149 F150 L151 V172 A176 | A143-I147 WeakPolarHBondContact O-CB 3.39Å; A143-I147 WeakPolarHBondContact O-CD1 3.18Å; A143-I147 WeakPolarHBondContact O-CG1 3.47Å; A143-I147 PolarHBondContact O-N 3.44Å; I147-S149 VanDerWaalsContact C-N 3.33Å; I147-S149 PolarHBondContact O-N 3.32Å; I147-F150 PolarHBondContact O-N 3.15Å; I147-L151 HydrophobicContact CG2-CD1 3.95Å; I147-L151 HydrophobicContact CG2-CG 4.25Å; I147-L151 WeakPolarHBondContact O-CB 3.16Å; I147-L151 WeakPolarHBondContact O-CG 3.49Å; I147-L151 PolarHBondContact O-N 3.45Å; I147-V172 HydrophobicContact CG2-CG1 4.39Å; I147-A176 HydrophobicContact CB-CB 4.02Å; I147-A176 HydrophobicContact CG2-CB 3.83Å |
| 148 | S | 96.4 | Very high | 95 | Very high | 0 Ų | 0 | 34.8 Ų | 34.8 | 0% | 0 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -58.5 | -45.5 | 178.3 | 177.5 | 0 | 0 | 0 | 0 | 112.2 | Q53 G144 F146 T152 Q173 Q177 | Q53-S148 PolarHBondContact OE1-OG 3.32Å; G144-S148 WeakPolarHBondContact O-CB 3.2Å; G144-S148 PolarHBondContact O-N 2.93Å; F146-S148 PolarHBondContact O-N 3.46Å; S148-T152 PolarHBondContact O-N 3.3Å; S148-T152 PolarHBondContact O-OG1 3.33Å; S148-Q173 PolarHBondContact O-NE2 2.88Å; S148-Q177 VanDerWaalsContact OG-CG 3.22Å; S148-Q177 WeakPolarHBondContact OG-CG 3.36Å; S148-Q177 PolarHBondContact OG-NE2 3.41Å |
| 149 | S | 97.4 | Very high | 95 | Very high | 0 Ų | 0 | 33.7 Ų | 33.7 | 0% | 0 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -71.4 | -42.3 | -176.6 | -54.3 | 0 | 0 | 0 | 0 | 112.2 | Q53 L145 F146 I147 T152 L153 G239 | Q53-S149 PolarHBondContact NE2-OG 3.21Å; L145-S149 VanDerWaalsContact O-CB 3.24Å; L145-S149 WeakPolarHBondContact O-CB 3.01Å; L145-S149 PolarHBondContact O-N 3.49Å; L145-S149 PolarHBondContact O-OG 2.84Å; F146-S149 PolarHBondContact O-N 3.11Å; I147-S149 VanDerWaalsContact C-N 3.33Å; I147-S149 PolarHBondContact O-N 3.32Å; S149-T152 VanDerWaalsContact O-CB 3.3Å; S149-T152 WeakPolarHBondContact O-CB 3.29Å; S149-T152 PolarHBondContact O-N 3.43Å; S149-L153 PolarHBondContact O-N 3.14Å; S149-G239 VanDerWaalsContact OG-C 3.29Å; S149-G239 VanDerWaalsContact OG-CA 3.26Å; S149-G239 WeakPolarHBondContact OG-CA 3.03Å |
| 150 | F | 97.3 | Very high | 95 | Very high | 88 Ų | 88 | 31.7 Ų | 31.7 | 39% | 0.386 | 16% | 0.163 | S | C | . | . | H | α-helix | trans | -62.1 | -49.4 | 176 | -175 | -106.3 | 0 | 0 | 0 | 110.4 | F146 I147 T152 L153 F154 | F146-F150 HydrophobicContact CE1-CB 4.48Å; F146-F150 HydrophobicContact CZ-CB 4.47Å; F146-F150 HydrophobicContact CZ-CD2 4.28Å; F146-F150 HydrophobicContact CZ-CG 4.45Å; F146-F150 WeakPolarHBondContact O-CB 3.37Å; F146-F150 PolarHBondContact O-N 2.89Å; I147-F150 PolarHBondContact O-N 3.15Å; F150-T152 PolarHBondContact O-N 3Å; F150-L153 WeakPolarHBondContact O-CB 3.39Å; F150-L153 PolarHBondContact O-N 2.8Å; F150-F154 HydrophobicContact CD1-CD2 4.24Å; F150-F154 HydrophobicContact CD1-CE2 4.01Å; F150-F154 HydrophobicContact CD2-CE2 4.15Å; F150-F154 HydrophobicContact CE1-CD2 4.04Å; F150-F154 AromaticContact CE1-CE2 3.46Å; F150-F154 HydrophobicContact CE1-CE2 3.46Å; F150-F154 VanDerWaalsContact CE1-CE2 3.46Å; F150-F154 HydrophobicContact CE1-CZ 4.17Å; F150-F154 AromaticContact CE2-CE2 3.63Å; F150-F154 HydrophobicContact CE2-CE2 3.63Å; F150-F154 HydrophobicContact CE2-CZ 4.35Å; F150-F154 HydrophobicContact CG-CE2 4.34Å; F150-F154 HydrophobicContact CZ-CD2 4.25Å; F150-F154 AromaticContact CZ-CE2 3.26Å; F150-F154 HydrophobicContact CZ-CE2 3.26Å; F150-F154 AromaticContact CZ-CZ 3.78Å; F150-F154 HydrophobicContact CZ-CZ 3.78Å; F150-F154 WeakPolarHBondContact O-CD2 3.36Å |
| 151 | L | 97.1 | Very high | 94.9 | Very high | 23 Ų | 23 | 34.9 Ų | 34.9 | 12% | 0.12 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -61 | -32 | 176.8 | -68.2 | -172.7 | 0 | 0 | 0 | 112.8 | I147 L153 F154 I155 L169 V172 Q173 | I147-L151 HydrophobicContact CG2-CD1 3.95Å; I147-L151 HydrophobicContact CG2-CG 4.25Å; I147-L151 WeakPolarHBondContact O-CB 3.16Å; I147-L151 WeakPolarHBondContact O-CG 3.49Å; I147-L151 PolarHBondContact O-N 3.45Å; L151-L153 VanDerWaalsContact C-N 3.29Å; L151-L153 PolarHBondContact O-N 3.38Å; L151-F154 PolarHBondContact O-N 2.86Å; L151-F154 VanDerWaalsContact O-N 3.11Å; L151-I155 PolarHBondContact O-N 3.19Å; L151-L169 HydrophobicContact CD2-CD2 3.88Å; L151-V172 HydrophobicContact CD1-CB 3.79Å; L151-V172 HydrophobicContact CD1-CG1 3.62Å; L151-Q173 HydrophobicContact CB-CB 4.48Å; L151-Q173 HydrophobicContact CD1-CB 4.29Å |
| 152 | T | 96.9 | Very high | 94.9 | Very high | 0 Ų | 0 | 36.2 Ų | 36.2 | 0% | 0 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -58.5 | -41.6 | 173.3 | -55.2 | 0 | 0 | 0 | 0 | 111.5 | Q53 S148 S149 F150 F154 I155 Q173 F232 | Q53-T152 HydrophobicContact CG-CG2 4.11Å; Q53-T152 WeakPolarHBondContact CG-OG1 3.47Å; S148-T152 PolarHBondContact O-N 3.3Å; S148-T152 PolarHBondContact O-OG1 3.33Å; S149-T152 VanDerWaalsContact O-CB 3.3Å; S149-T152 WeakPolarHBondContact O-CB 3.29Å; S149-T152 PolarHBondContact O-N 3.43Å; F150-T152 PolarHBondContact O-N 3Å; T152-F154 PolarHBondContact O-N 3.26Å; T152-I155 HydrophobicContact CG2-CD1 4.38Å; T152-I155 WeakPolarHBondContact O-CB 3.47Å; T152-I155 PolarHBondContact O-N 3.33Å; T152-I155 VanDerWaalsContact O-N 3.14Å; T152-Q173 PolarHBondContact OG1-NE2 3.28Å; T152-F232 HydrophobicContact CG2-CB 4.23Å; T152-F232 HydrophobicContact CG2-CD1 4.04Å |
| 153 | L | 97.1 | Very high | 94.9 | Very high | 49 Ų | 49 | 38 Ų | 38 | 26% | 0.257 | 21% | 0.214 | S | C | . | . | H | α-helix | trans | -62.9 | -27.9 | 178.1 | -61.7 | 175.4 | 0 | 0 | 0 | 112.5 | S149 F150 L151 Y233 | S149-L153 PolarHBondContact O-N 3.14Å; F150-L153 WeakPolarHBondContact O-CB 3.39Å; F150-L153 PolarHBondContact O-N 2.8Å; L151-L153 VanDerWaalsContact C-N 3.29Å; L151-L153 PolarHBondContact O-N 3.38Å; L153-Y233 HydrophobicContact CD2-CD1 4.26Å; L153-Y233 WeakPolarHBondContact CD2-O 3.38Å; L153-Y233 WeakPolarHBondContact O-CE1 3.33Å |
| 154 | F | 96.3 | Very high | 94.9 | Very high | 81 Ų | 81 | 39.6 Ų | 39.6 | 36% | 0.355 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -86.2 | -8.3 | 178.8 | -76.6 | -92.2 | 0 | 0 | 0 | 113.8 | F150 L151 T152 L157 A158 L169 | F150-F154 HydrophobicContact CD1-CD2 4.24Å; F150-F154 HydrophobicContact CD1-CE2 4.01Å; F150-F154 HydrophobicContact CD2-CE2 4.15Å; F150-F154 HydrophobicContact CE1-CD2 4.04Å; F150-F154 AromaticContact CE1-CE2 3.46Å; F150-F154 HydrophobicContact CE1-CE2 3.46Å; F150-F154 VanDerWaalsContact CE1-CE2 3.46Å; F150-F154 HydrophobicContact CE1-CZ 4.17Å; F150-F154 AromaticContact CE2-CE2 3.63Å; F150-F154 HydrophobicContact CE2-CE2 3.63Å; F150-F154 HydrophobicContact CE2-CZ 4.35Å; F150-F154 HydrophobicContact CG-CE2 4.34Å; F150-F154 HydrophobicContact CZ-CD2 4.25Å; F150-F154 AromaticContact CZ-CE2 3.26Å; F150-F154 HydrophobicContact CZ-CE2 3.26Å; F150-F154 AromaticContact CZ-CZ 3.78Å; F150-F154 HydrophobicContact CZ-CZ 3.78Å; F150-F154 WeakPolarHBondContact O-CD2 3.36Å; L151-F154 PolarHBondContact O-N 2.86Å; L151-F154 VanDerWaalsContact O-N 3.11Å; T152-F154 PolarHBondContact O-N 3.26Å; F154-L157 HydrophobicContact CD1-CD2 4.04Å; F154-L157 HydrophobicContact CE1-CD2 4.33Å; F154-L157 PolarHBondContact O-N 3.46Å; F154-L157 VanDerWaalsContact O-N 3.16Å; F154-A158 WeakPolarHBondContact O-CB 3.36Å; F154-A158 PolarHBondContact O-N 2.78Å; F154-L169 HydrophobicContact CB-CD1 3.88Å |
| 155 | I | 95.5 | Very high | 94.9 | Very high | 1 Ų | 1 | 43.6 Ų | 43.6 | 1% | 0.005 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -55.5 | -47.2 | -179.5 | -73.5 | 174.6 | 0 | 0 | 0 | 112.3 | L57 L151 T152 L157 A158 A159 L166 F232 | L57-I155 HydrophobicContact CD1-CG2 4.46Å; L151-I155 PolarHBondContact O-N 3.19Å; T152-I155 HydrophobicContact CG2-CD1 4.38Å; T152-I155 WeakPolarHBondContact O-CB 3.47Å; T152-I155 PolarHBondContact O-N 3.33Å; T152-I155 VanDerWaalsContact O-N 3.14Å; I155-L157 VanDerWaalsContact C-N 3.33Å; I155-L157 PolarHBondContact O-N 3.37Å; I155-A158 PolarHBondContact O-N 2.89Å; I155-A159 WeakPolarHBondContact O-CB 3.18Å; I155-A159 PolarHBondContact O-N 2.94Å; I155-L166 HydrophobicContact CB-CD1 4.41Å; I155-L166 HydrophobicContact CG1-CD1 4.35Å; I155-L166 HydrophobicContact CG2-CD1 3.79Å; I155-F232 HydrophobicContact CB-CD1 3.85Å; I155-F232 HydrophobicContact CB-CE1 4.18Å; I155-F232 HydrophobicContact CB-CG 4.17Å; I155-F232 HydrophobicContact CD1-CD1 3.74Å; I155-F232 HydrophobicContact CD1-CE1 3.81Å; I155-F232 HydrophobicContact CG1-CD1 4.37Å; I155-F232 HydrophobicContact CG2-CD1 3.68Å; I155-F232 HydrophobicContact CG2-CD2 4.22Å; I155-F232 HydrophobicContact CG2-CE1 3.55Å; I155-F232 HydrophobicContact CG2-CE2 4.1Å; I155-F232 HydrophobicContact CG2-CG 4.02Å; I155-F232 HydrophobicContact CG2-CZ 3.77Å |
| 156 | P | 94.6 | Very high | 94.9 | Very high | 2 Ų | 2 | 43.6 Ų | 43.6 | 1% | 0.013 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -61.6 | -39.6 | 177.9 | -24.6 | 35.4 | 0 | 0 | 0 | 113.4 | A159 N160 W228 P229 F232 Y233 | P156-A159 PolarHBondContact O-N 2.94Å; P156-N160 PolarHBondContact O-N 3.44Å; P156-N160 PolarHBondContact O-ND2 3.21Å; P156-W228 HydrophobicContact CB-CH2 3.98Å; P156-W228 HydrophobicContact CB-CZ3 3.79Å; P156-W228 HydrophobicContact CG-CZ3 4.03Å; P156-P229 HydrophobicContact CB-CB 3.96Å; P156-P229 HydrophobicContact CG-CB 4.02Å; P156-F232 HydrophobicContact CG-CB 3.81Å; P156-F232 HydrophobicContact CG-CD2 4.03Å; P156-F232 HydrophobicContact CG-CG 4.17Å; P156-Y233 HydrophobicContact CB-CE1 4.41Å; P156-Y233 HydrophobicContact CG-CD1 4.49Å; P156-Y233 HydrophobicContact CG-CE1 3.89Å |
| 157 | L | 93.4 | Very high | 94.9 | Very high | 104 Ų | 104 | 40.7 Ų | 40.7 | 55% | 0.545 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -67 | -40.6 | 177.2 | -175.2 | 62.8 | 0 | 0 | 0 | 111.5 | F154 I155 N160 A161 | F154-L157 HydrophobicContact CD1-CD2 4.04Å; F154-L157 HydrophobicContact CE1-CD2 4.33Å; F154-L157 PolarHBondContact O-N 3.46Å; F154-L157 VanDerWaalsContact O-N 3.16Å; I155-L157 VanDerWaalsContact C-N 3.33Å; I155-L157 PolarHBondContact O-N 3.37Å; L157-N160 PolarHBondContact O-N 2.97Å; L157-A161 PolarHBondContact O-N 3.44Å |
| 158 | A | 94.1 | Very high | 94.9 | Very high | 3 Ų | 3 | 41.2 Ų | 41.2 | 3% | 0.025 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -67.6 | -36.9 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | F154 I155 N160 A161 G162 L165 L166 L169 | F154-A158 WeakPolarHBondContact O-CB 3.36Å; F154-A158 PolarHBondContact O-N 2.78Å; I155-A158 PolarHBondContact O-N 2.89Å; A158-N160 VanDerWaalsContact C-N 3.28Å; A158-N160 PolarHBondContact O-N 3.23Å; A158-A161 PolarHBondContact O-N 3.28Å; A158-G162 PolarHBondContact O-N 3.4Å; A158-G162 VanDerWaalsContact O-O 3.06Å; A158-L165 HydrophobicContact CB-CD2 4.1Å; A158-L165 HydrophobicContact CB-CG 3.98Å; A158-L166 HydrophobicContact CB-CB 4.39Å; A158-L169 HydrophobicContact CB-CD1 3.52Å; A158-L169 HydrophobicContact CB-CG 4.34Å |
| 159 | A | 92.4 | Very high | 94.9 | Very high | 3 Ų | 3 | 42.6 Ų | 42.6 | 3% | 0.025 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -59.8 | -40.1 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | M64 Y103 W105 I155 P156 L166 W228 | M64-A159 HydrophobicContact CE-CB 4.03Å; Y103-A159 HydrophobicContact CE1-CB 4.47Å; Y103-A159 WeakPolarHBondContact CE1-O 3.3Å; Y103-A159 HydrophobicContact CE2-CB 3.82Å; Y103-A159 VanDerWaalsContact OH-C 3.26Å; Y103-A159 VanDerWaalsContact OH-CB 3.29Å; Y103-A159 WeakPolarHBondContact OH-CB 3.36Å; W105-A159 HydrophobicContact CH2-CB 4.06Å; W105-A159 HydrophobicContact CZ2-CB 4.24Å; I155-A159 WeakPolarHBondContact O-CB 3.18Å; I155-A159 PolarHBondContact O-N 2.94Å; P156-A159 PolarHBondContact O-N 2.94Å; A159-L166 HydrophobicContact CB-CD2 4.4Å; A159-W228 HydrophobicContact CB-CH2 4.04Å |
| 160 | N | 90.3 | Very high | 94.8 | Very high | 96 Ų | 96 | 42.8 Ų | 42.8 | 51% | 0.513 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -68.1 | -39 | 174.9 | -74.1 | -42.7 | 0 | 0 | 0 | 112.9 | P101 Y103 P156 L157 A158 | P101-N160 WeakPolarHBondContact CG-OD1 3.45Å; Y103-N160 PolarHBondContact OH-N 3.4Å; Y103-N160 VanDerWaalsContact OH-N 3.15Å; Y103-N160 PolarHBondContact OH-OD1 3.44Å; P156-N160 PolarHBondContact O-N 3.44Å; P156-N160 PolarHBondContact O-ND2 3.21Å; L157-N160 PolarHBondContact O-N 2.97Å; A158-N160 VanDerWaalsContact C-N 3.28Å; A158-N160 PolarHBondContact O-N 3.23Å |
| 161 | A | 91.3 | Very high | 94.7 | Very high | 74 Ų | 74 | 40.9 Ų | 40.9 | 61% | 0.612 | 24% | 0.244 | S | C | * | . | H | α-helix | trans | -75.5 | -29.1 | -177.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | L157 A158 L165 | L157-A161 PolarHBondContact O-N 3.44Å; A158-A161 PolarHBondContact O-N 3.28Å; A161-L165 HydrophobicContact CB-CD2 3.85Å |
| 162 | G | 91.8 | Very high | 94.7 | Very high | 27 Ų | 27 | 42.9 Ų | 42.9 | 28% | 0.278 | 26% | 0.257 | S | S | . | . | trans | 147.2 | 155.1 | 172 | 0 | 0 | 0 | 0 | 0 | 114.6 | A158 A164 L165 L166 | A158-G162 PolarHBondContact O-N 3.4Å; A158-G162 VanDerWaalsContact O-O 3.06Å; G162-A164 VanDerWaalsContact C-N 3.28Å; G162-A164 PolarHBondContact O-N 2.86Å; G162-L165 PolarHBondContact O-N 2.93Å; G162-L165 VanDerWaalsContact O-N 3.15Å; G162-L166 PolarHBondContact O-N 3.38Å | ||
| 163 | V | 93.6 | Very high | 94.6 | Very high | 39 Ų | 39 | 43 Ų | 43 | 24% | 0.236 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -55.9 | -39.6 | -177.3 | 176.9 | 0 | 0 | 0 | 0 | 112.7 | I109 I113 L165 L166 I167 | I109-V163 HydrophobicContact CG2-CG1 3.68Å; I109-V163 HydrophobicContact CG2-CG2 4.19Å; I113-V163 HydrophobicContact CD1-CG1 4.27Å; I113-V163 HydrophobicContact CG1-CG1 4.3Å; V163-L165 PolarHBondContact O-N 2.87Å; V163-L166 WeakPolarHBondContact O-CB 3.45Å; V163-L166 PolarHBondContact O-N 3.13Å; V163-I167 HydrophobicContact CG1-CD1 3.75Å; V163-I167 HydrophobicContact CG1-CG1 4.32Å; V163-I167 WeakPolarHBondContact O-CG1 3.24Å; V163-I167 PolarHBondContact O-N 2.94Å |
| 164 | A | 94.7 | Very high | 94.5 | Very high | 74 Ų | 74 | 40.6 Ų | 40.6 | 61% | 0.612 | 25% | 0.245 | S | C | * | . | H | α-helix | trans | -62 | -42.9 | -179.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | G162 I167 V168 | G162-A164 VanDerWaalsContact C-N 3.28Å; G162-A164 PolarHBondContact O-N 2.86Å; A164-I167 PolarHBondContact O-N 2.69Å; A164-V168 WeakPolarHBondContact O-CG2 3.21Å; A164-V168 PolarHBondContact O-N 3.01Å |
| 165 | L | 95.3 | Very high | 94.4 | Very high | 85 Ų | 85 | 40 Ų | 40 | 45% | 0.445 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -66 | -41.9 | 177.3 | -177.2 | 62.1 | 0 | 0 | 0 | 110.9 | A158 A161 G162 V163 I167 V168 L169 | A158-L165 HydrophobicContact CB-CD2 4.1Å; A158-L165 HydrophobicContact CB-CG 3.98Å; A161-L165 HydrophobicContact CB-CD2 3.85Å; G162-L165 PolarHBondContact O-N 2.93Å; G162-L165 VanDerWaalsContact O-N 3.15Å; V163-L165 PolarHBondContact O-N 2.87Å; L165-I167 VanDerWaalsContact C-N 3.34Å; L165-I167 PolarHBondContact O-N 3.21Å; L165-V168 PolarHBondContact O-N 3.41Å; L165-L169 WeakPolarHBondContact O-CG 3.48Å; L165-L169 PolarHBondContact O-N 2.58Å |
| 166 | L | 95.5 | Very high | 94.4 | Very high | 0 Ų | 0 | 40.1 Ų | 40.1 | 0% | 0 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -57.8 | -45.6 | 175.3 | 178 | 60.3 | 0 | 0 | 0 | 111.7 | W105 I113 I155 A158 A159 G162 V163 L169 R170 | W105-L166 HydrophobicContact CH2-CD2 3.76Å; W105-L166 HydrophobicContact CZ2-CD2 4.16Å; W105-L166 HydrophobicContact CZ3-CD2 4.49Å; I113-L166 HydrophobicContact CD1-CD2 3.99Å; I113-L166 HydrophobicContact CG1-CD2 4.32Å; I113-L166 HydrophobicContact CG2-CD2 3.81Å; I113-L166 HydrophobicContact CG2-CG 4.15Å; I155-L166 HydrophobicContact CB-CD1 4.41Å; I155-L166 HydrophobicContact CG1-CD1 4.35Å; I155-L166 HydrophobicContact CG2-CD1 3.79Å; A158-L166 HydrophobicContact CB-CB 4.39Å; A159-L166 HydrophobicContact CB-CD2 4.4Å; G162-L166 PolarHBondContact O-N 3.38Å; V163-L166 WeakPolarHBondContact O-CB 3.45Å; V163-L166 PolarHBondContact O-N 3.13Å; L166-L169 PolarHBondContact O-N 2.84Å; L166-R170 HydrophobicContact CD1-CG 4.29Å; L166-R170 WeakPolarHBondContact O-CB 3.32Å; L166-R170 WeakPolarHBondContact O-CG 3.48Å; L166-R170 PolarHBondContact O-N 3.37Å |
| 167 | I | 96.3 | Very high | 94.3 | Very high | 35 Ų | 35 | 40.2 Ų | 40.2 | 18% | 0.179 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -61.2 | -47.1 | 176.9 | -70.1 | 166.8 | 0 | 0 | 0 | 110.9 | V112 I113 V163 A164 L165 L169 R170 I171 | V112-I167 HydrophobicContact CG1-CD1 3.71Å; V112-I167 HydrophobicContact CG1-CG1 4.36Å; I113-I167 HydrophobicContact CG1-CG1 4.32Å; V163-I167 HydrophobicContact CG1-CD1 3.75Å; V163-I167 HydrophobicContact CG1-CG1 4.32Å; V163-I167 WeakPolarHBondContact O-CG1 3.24Å; V163-I167 PolarHBondContact O-N 2.94Å; A164-I167 PolarHBondContact O-N 2.69Å; L165-I167 VanDerWaalsContact C-N 3.34Å; L165-I167 PolarHBondContact O-N 3.21Å; I167-L169 VanDerWaalsContact C-N 3.35Å; I167-L169 PolarHBondContact O-N 3.42Å; I167-R170 PolarHBondContact O-N 3.27Å; I167-I171 HydrophobicContact CG2-CD1 3.86Å; I167-I171 HydrophobicContact CG2-CG1 4.44Å; I167-I171 VanDerWaalsContact O-CG1 3.31Å; I167-I171 WeakPolarHBondContact O-CG1 3.36Å; I167-I171 PolarHBondContact O-N 3.23Å |
| 168 | V | 96.2 | Very high | 94.2 | Very high | 81 Ų | 81 | 35.4 Ų | 35.4 | 49% | 0.491 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -60.2 | -45.4 | 179 | 171.5 | 0 | 0 | 0 | 0 | 110.9 | A164 L165 R170 I171 V172 | A164-V168 WeakPolarHBondContact O-CG2 3.21Å; A164-V168 PolarHBondContact O-N 3.01Å; L165-V168 PolarHBondContact O-N 3.41Å; V168-R170 VanDerWaalsContact C-N 3.31Å; V168-R170 PolarHBondContact O-N 3.04Å; V168-I171 PolarHBondContact O-N 3.13Å; V168-V172 WeakPolarHBondContact O-CG2 3.38Å; V168-V172 PolarHBondContact O-N 3.27Å; V168-V172 VanDerWaalsContact O-N 3.13Å |
| 169 | L | 95.9 | Very high | 94.1 | Very high | 29 Ų | 29 | 37.6 Ų | 37.6 | 15% | 0.152 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -60 | -41.9 | 176.5 | -72.3 | -165.4 | 0 | 0 | 0 | 112 | L151 F154 A158 L165 L166 I167 V172 Q173 | L151-L169 HydrophobicContact CD2-CD2 3.88Å; F154-L169 HydrophobicContact CB-CD1 3.88Å; A158-L169 HydrophobicContact CB-CD1 3.52Å; A158-L169 HydrophobicContact CB-CG 4.34Å; L165-L169 WeakPolarHBondContact O-CG 3.48Å; L165-L169 PolarHBondContact O-N 2.58Å; L166-L169 PolarHBondContact O-N 2.84Å; I167-L169 VanDerWaalsContact C-N 3.35Å; I167-L169 PolarHBondContact O-N 3.42Å; L169-V172 PolarHBondContact O-N 3.22Å; L169-Q173 VanDerWaalsContact O-CB 3.24Å; L169-Q173 WeakPolarHBondContact O-CB 3.4Å; L169-Q173 PolarHBondContact O-N 3.23Å |
| 170 | R | 95.2 | Very high | 94 | Very high | 4 Ų | 4 | 37.5 Ų | 37.5 | 2% | 0.015 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -66 | -37.9 | 178.8 | -70.1 | -73.3 | -80.6 | 168.4 | -8.4 | 112.3 | S116 L166 I167 V168 Q173 G174 | S116-R170 WeakPolarHBondContact OG-CB 3.44Å; L166-R170 HydrophobicContact CD1-CG 4.29Å; L166-R170 WeakPolarHBondContact O-CB 3.32Å; L166-R170 WeakPolarHBondContact O-CG 3.48Å; L166-R170 PolarHBondContact O-N 3.37Å; I167-R170 PolarHBondContact O-N 3.27Å; V168-R170 VanDerWaalsContact C-N 3.31Å; V168-R170 PolarHBondContact O-N 3.04Å; R170-Q173 PolarHBondContact O-N 2.95Å; R170-G174 PolarHBondContact O-N 3.19Å |
| 171 | I | 96.1 | Very high | 93.9 | Very high | 49 Ų | 49 | 34 Ų | 34 | 25% | 0.251 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -61.4 | -49.3 | 175.3 | -68.7 | 168.1 | 0 | 0 | 0 | 110.6 | S116 Y119 I167 V168 Q173 G174 I175 | S116-I171 WeakPolarHBondContact O-CG1 3.5Å; Y119-I171 HydrophobicContact CD2-CD1 4.35Å; Y119-I171 HydrophobicContact CD2-CG1 4.42Å; I167-I171 HydrophobicContact CG2-CD1 3.86Å; I167-I171 HydrophobicContact CG2-CG1 4.44Å; I167-I171 VanDerWaalsContact O-CG1 3.31Å; I167-I171 WeakPolarHBondContact O-CG1 3.36Å; I167-I171 PolarHBondContact O-N 3.23Å; V168-I171 PolarHBondContact O-N 3.13Å; I171-Q173 VanDerWaalsContact C-N 3.33Å; I171-Q173 PolarHBondContact O-N 3.2Å; I171-G174 PolarHBondContact O-N 3.24Å; I171-I175 HydrophobicContact CG2-CD1 4.45Å; I171-I175 PolarHBondContact O-N 3.5Å |
| 172 | V | 95.9 | Very high | 93.7 | Very high | 65 Ų | 65 | 31.2 Ų | 31.2 | 39% | 0.394 | 19% | 0.188 | S | C | . | . | H | α-helix | trans | -65.2 | -40.3 | 179.4 | -178.8 | 0 | 0 | 0 | 0 | 110.9 | I147 L151 V168 L169 G174 I175 A176 | I147-V172 HydrophobicContact CG2-CG1 4.39Å; L151-V172 HydrophobicContact CD1-CB 3.79Å; L151-V172 HydrophobicContact CD1-CG1 3.62Å; V168-V172 WeakPolarHBondContact O-CG2 3.38Å; V168-V172 PolarHBondContact O-N 3.27Å; V168-V172 VanDerWaalsContact O-N 3.13Å; L169-V172 PolarHBondContact O-N 3.22Å; V172-G174 VanDerWaalsContact C-N 3.33Å; V172-G174 PolarHBondContact O-N 3.4Å; V172-I175 PolarHBondContact O-N 3.4Å; V172-A176 PolarHBondContact O-N 3.44Å; V172-A176 VanDerWaalsContact O-N 3.15Å |
| 173 | Q | 95.6 | Very high | 93.4 | Very high | 1 Ų | 1 | 30 Ų | 30 | 1% | 0.005 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -57.4 | -45.5 | 173.7 | -175.8 | -177.7 | 25.8 | 0 | 0 | 111.3 | L117 S148 L151 T152 L169 R170 I171 I175 A176 Q177 | L117-Q173 HydrophobicContact CD1-CB 4.17Å; L117-Q173 HydrophobicContact CD1-CG 3.99Å; S148-Q173 PolarHBondContact O-NE2 2.88Å; L151-Q173 HydrophobicContact CB-CB 4.48Å; L151-Q173 HydrophobicContact CD1-CB 4.29Å; T152-Q173 PolarHBondContact OG1-NE2 3.28Å; L169-Q173 VanDerWaalsContact O-CB 3.24Å; L169-Q173 WeakPolarHBondContact O-CB 3.4Å; L169-Q173 PolarHBondContact O-N 3.23Å; R170-Q173 PolarHBondContact O-N 2.95Å; I171-Q173 VanDerWaalsContact C-N 3.33Å; I171-Q173 PolarHBondContact O-N 3.2Å; Q173-I175 PolarHBondContact O-N 3.18Å; Q173-A176 WeakPolarHBondContact O-CB 3.38Å; Q173-A176 PolarHBondContact O-N 2.93Å; Q173-Q177 HydrophobicContact CG-CG 4.45Å; Q173-Q177 WeakPolarHBondContact O-CG 3.16Å; Q173-Q177 PolarHBondContact O-N 2.9Å |
| 174 | G | 94.8 | Very high | 93 | Very high | 0 Ų | 0 | 28.8 Ų | 28.8 | 0% | 0 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -60.6 | -45.1 | 179.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | L117 S121 R170 I171 V172 A176 Q177 V178 | L117-G174 WeakPolarHBondContact O-CA 3.38Å; S121-G174 VanDerWaalsContact OG-CA 3.27Å; S121-G174 WeakPolarHBondContact OG-CA 3.31Å; S121-G174 PolarHBondContact OG-O 3.39Å; R170-G174 PolarHBondContact O-N 3.19Å; I171-G174 PolarHBondContact O-N 3.24Å; V172-G174 VanDerWaalsContact C-N 3.33Å; V172-G174 PolarHBondContact O-N 3.4Å; G174-A176 VanDerWaalsContact C-N 3.31Å; G174-A176 PolarHBondContact O-N 3.02Å; G174-Q177 PolarHBondContact O-N 3Å; G174-V178 PolarHBondContact O-N 3.48Å |
| 175 | I | 94 | Very high | 92.5 | Very high | 67 Ų | 67 | 30.9 Ų | 30.9 | 34% | 0.344 | 16% | 0.159 | S | C | . | . | H | α-helix | trans | -56.5 | -47.9 | 174.7 | -64.6 | 166.7 | 0 | 0 | 0 | 110.3 | G120 A124 I171 V172 Q173 Q177 V178 M179 | G120-I175 WeakPolarHBondContact O-CG1 3.27Å; A124-I175 HydrophobicContact CB-CG2 4.18Å; I171-I175 HydrophobicContact CG2-CD1 4.45Å; I171-I175 PolarHBondContact O-N 3.5Å; V172-I175 PolarHBondContact O-N 3.4Å; Q173-I175 PolarHBondContact O-N 3.18Å; I175-Q177 PolarHBondContact O-N 3.01Å; I175-V178 PolarHBondContact O-N 3.22Å; I175-M179 HydrophobicContact CG2-SD 4.21Å; I175-M179 WeakPolarHBondContact O-CG 3.36Å; I175-M179 PolarHBondContact O-N 3.3Å; I175-M179 VanDerWaalsContact O-N 3.08Å |
| 176 | A | 94.4 | Very high | 91.9 | Very high | 4 Ų | 4 | 28.6 Ų | 28.6 | 3% | 0.033 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -62.7 | -40.2 | 179.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | I147 V172 Q173 G174 M179 V180 | I147-A176 HydrophobicContact CB-CB 4.02Å; I147-A176 HydrophobicContact CG2-CB 3.83Å; V172-A176 PolarHBondContact O-N 3.44Å; V172-A176 VanDerWaalsContact O-N 3.15Å; Q173-A176 WeakPolarHBondContact O-CB 3.38Å; Q173-A176 PolarHBondContact O-N 2.93Å; G174-A176 VanDerWaalsContact C-N 3.31Å; G174-A176 PolarHBondContact O-N 3.02Å; A176-M179 WeakPolarHBondContact O-CB 3.32Å; A176-M179 PolarHBondContact O-N 3.4Å; A176-V180 WeakPolarHBondContact O-CG2 3.35Å; A176-V180 PolarHBondContact O-N 3.19Å |
| 177 | Q | 93.6 | Very high | 91.5 | Very high | 5 Ų | 5 | 28.7 Ų | 28.7 | 2% | 0.023 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -63.8 | -43.4 | 176.6 | -70.4 | -174.3 | -8.7 | 0 | 0 | 112.2 | I50 S148 Q173 G174 I175 M179 V180 L181 | I50-Q177 HydrophobicContact CD1-CG 4Å; I50-Q177 HydrophobicContact CG2-CB 3.95Å; I50-Q177 HydrophobicContact CG2-CG 3.86Å; S148-Q177 VanDerWaalsContact OG-CG 3.22Å; S148-Q177 WeakPolarHBondContact OG-CG 3.36Å; S148-Q177 PolarHBondContact OG-NE2 3.41Å; Q173-Q177 HydrophobicContact CG-CG 4.45Å; Q173-Q177 WeakPolarHBondContact O-CG 3.16Å; Q173-Q177 PolarHBondContact O-N 2.9Å; G174-Q177 PolarHBondContact O-N 3Å; I175-Q177 PolarHBondContact O-N 3.01Å; Q177-M179 VanDerWaalsContact C-N 3.29Å; Q177-M179 PolarHBondContact O-N 3.33Å; Q177-V180 WeakPolarHBondContact O-CB 3.36Å; Q177-V180 PolarHBondContact O-N 3.21Å; Q177-L181 WeakPolarHBondContact O-CG 3.44Å; Q177-L181 PolarHBondContact O-N 3.29Å |
| 178 | V | 91.5 | Very high | 91.1 | Very high | 3 Ų | 3 | 27.2 Ų | 27.2 | 2% | 0.018 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -63.4 | -37.8 | 176.8 | 171.8 | 0 | 0 | 0 | 0 | 111.6 | A124 P125 G174 I175 V180 L181 T182 | A124-V178 HydrophobicContact CB-CB 3.82Å; A124-V178 HydrophobicContact CB-CG1 3.62Å; P125-V178 HydrophobicContact CB-CG1 4.11Å; P125-V178 HydrophobicContact CG-CG1 3.7Å; G174-V178 PolarHBondContact O-N 3.48Å; I175-V178 PolarHBondContact O-N 3.22Å; V178-V180 VanDerWaalsContact C-N 3.29Å; V178-V180 PolarHBondContact O-N 2.92Å; V178-L181 PolarHBondContact O-N 2.62Å; V178-T182 HydrophobicContact CG1-CG2 4.15Å; V178-T182 WeakPolarHBondContact O-CB 3.47Å; V178-T182 PolarHBondContact O-N 3.25Å; V178-T182 PolarHBondContact O-OG1 3.3Å |
| 179 | M | 91.1 | Very high | 90.5 | Very high | 49 Ų | 49 | 27.6 Ų | 27.6 | 24% | 0.241 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -59.9 | -39.5 | 175.4 | -70.2 | 173.4 | 66.5 | 0 | 0 | 112.3 | S128 V140 I175 A176 Q177 G183 | S128-M179 WeakPolarHBondContact OG-CA 3.49Å; V140-M179 HydrophobicContact CG1-CB 4.36Å; V140-M179 HydrophobicContact CG1-CE 3.79Å; I175-M179 HydrophobicContact CG2-SD 4.21Å; I175-M179 WeakPolarHBondContact O-CG 3.36Å; I175-M179 PolarHBondContact O-N 3.3Å; I175-M179 VanDerWaalsContact O-N 3.08Å; A176-M179 WeakPolarHBondContact O-CB 3.32Å; A176-M179 PolarHBondContact O-N 3.4Å; Q177-M179 VanDerWaalsContact C-N 3.29Å; Q177-M179 PolarHBondContact O-N 3.33Å; M179-G183 WeakPolarHBondContact O-CA 3.43Å; M179-G183 PolarHBondContact O-N 3.32Å |
| 180 | V | 91.6 | Very high | 89.9 | Confident | 1 Ų | 1 | 30.1 Ų | 30.1 | 1% | 0.006 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -64.2 | -52.5 | 174 | 173.2 | 0 | 0 | 0 | 0 | 111.1 | I50 V141 G144 L145 A176 Q177 V178 T182 G183 Q184 | I50-V180 HydrophobicContact CD1-CB 4.26Å; I50-V180 HydrophobicContact CD1-CG1 4.26Å; I50-V180 HydrophobicContact CD1-CG2 4.08Å; I50-V180 HydrophobicContact CG1-CB 4.31Å; I50-V180 HydrophobicContact CG1-CG1 3.85Å; V141-V180 HydrophobicContact CG1-CG1 4.11Å; V141-V180 WeakPolarHBondContact O-CG2 3.34Å; G144-V180 VanDerWaalsContact C-CG2 3.45Å; L145-V180 HydrophobicContact CB-CG2 4.12Å; A176-V180 WeakPolarHBondContact O-CG2 3.35Å; A176-V180 PolarHBondContact O-N 3.19Å; Q177-V180 WeakPolarHBondContact O-CB 3.36Å; Q177-V180 PolarHBondContact O-N 3.21Å; V178-V180 VanDerWaalsContact C-N 3.29Å; V178-V180 PolarHBondContact O-N 2.92Å; V180-T182 VanDerWaalsContact C-N 3.28Å; V180-T182 PolarHBondContact O-N 3.01Å; V180-G183 PolarHBondContact O-N 3.34Å; V180-Q184 PolarHBondContact O-N 3.02Å |
| 181 | L | 87.8 | Confident | 89.7 | Confident | 22 Ų | 22 | 30 Ų | 30 | 12% | 0.115 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -65.9 | -29.8 | -173 | -67 | 175.4 | 0 | 0 | 0 | 113.3 | N47 I50 Y51 Q177 V178 Q184 Y185 | N47-L181 WeakPolarHBondContact OD1-CD2 3.37Å; I50-L181 HydrophobicContact CG2-CD1 4.44Å; I50-L181 HydrophobicContact CG2-CD2 4.35Å; I50-L181 HydrophobicContact CG2-CG 4.38Å; Y51-L181 HydrophobicContact CE2-CD1 4.37Å; Y51-L181 HydrophobicContact CE2-CD2 3.79Å; Q177-L181 WeakPolarHBondContact O-CG 3.44Å; Q177-L181 PolarHBondContact O-N 3.29Å; V178-L181 PolarHBondContact O-N 2.62Å; L181-Q184 VanDerWaalsContact O-CG 3.29Å; L181-Q184 WeakPolarHBondContact O-CG 3.29Å; L181-Q184 PolarHBondContact O-NE2 3.39Å; L181-Y185 WeakPolarHBondContact O-CD2 3.42Å; L181-Y185 WeakPolarHBondContact O-CE2 3.36Å |
| 182 | T | 86.5 | Confident | 89.2 | Confident | 16 Ų | 16 | 27.7 Ų | 27.7 | 10% | 0.098 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -91.8 | -40.1 | 177.4 | 53.6 | 0 | 0 | 0 | 0 | 112.3 | P125 S128 V178 V180 Q184 Y185 | P125-T182 HydrophobicContact CB-CG2 4.16Å; S128-T182 VanDerWaalsContact CB-OG1 3.23Å; S128-T182 WeakPolarHBondContact CB-OG1 3.26Å; S128-T182 PolarHBondContact OG-OG1 2.66Å; V178-T182 HydrophobicContact CG1-CG2 4.15Å; V178-T182 WeakPolarHBondContact O-CB 3.47Å; V178-T182 PolarHBondContact O-N 3.25Å; V178-T182 PolarHBondContact O-OG1 3.3Å; V180-T182 VanDerWaalsContact C-N 3.28Å; V180-T182 PolarHBondContact O-N 3.01Å; T182-Q184 VanDerWaalsContact C-N 3.28Å; T182-Q184 PolarHBondContact O-N 3.31Å; T182-Y185 PolarHBondContact O-N 3.03Å |
| 183 | G | 85.2 | Confident | 88.8 | Confident | 0 Ų | 0 | 24.7 Ų | 24.7 | 0% | 0 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -63.2 | -30.8 | -179.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | V141 M179 V180 Y185 S186 | V141-G183 VanDerWaalsContact CG2-C 3.48Å; M179-G183 WeakPolarHBondContact O-CA 3.43Å; M179-G183 PolarHBondContact O-N 3.32Å; V180-G183 PolarHBondContact O-N 3.34Å; G183-Y185 PolarHBondContact O-N 2.79Å; G183-S186 WeakPolarHBondContact O-CB 3.44Å; G183-S186 PolarHBondContact O-N 2.64Å; G183-S186 VanDerWaalsContact O-N 3.12Å |
| 184 | Q | 86.6 | Confident | 88.1 | Confident | 15 Ų | 15 | 27 Ų | 27 | 7% | 0.07 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -60.2 | -27.3 | 176.5 | 63.9 | -179.9 | -21 | 0 | 0 | 113.7 | L43 N47 V180 L181 T182 S186 I187 W188 | L43-Q184 HydrophobicContact CD2-CB 3.76Å; N47-Q184 PolarHBondContact ND2-OE1 2.92Å; N47-Q184 PolarHBondContact OD1-NE2 3.44Å; N47-Q184 PolarHBondContact OD1-OE1 2.97Å; V180-Q184 PolarHBondContact O-N 3.02Å; L181-Q184 VanDerWaalsContact O-CG 3.29Å; L181-Q184 WeakPolarHBondContact O-CG 3.29Å; L181-Q184 PolarHBondContact O-NE2 3.39Å; T182-Q184 VanDerWaalsContact C-N 3.28Å; T182-Q184 PolarHBondContact O-N 3.31Å; Q184-S186 VanDerWaalsContact C-N 3.3Å; Q184-S186 PolarHBondContact O-N 3.4Å; Q184-I187 WeakPolarHBondContact O-CB 3.46Å; Q184-I187 PolarHBondContact O-N 3.13Å; Q184-W188 VanDerWaalsContact O-CD1 3.28Å; Q184-W188 PolarHBondContact O-N 3.23Å |
| 185 | Y | 83.4 | Confident | 87.4 | Confident | 117 Ų | 117 | 34.9 Ų | 34.9 | 46% | 0.459 | 18% | 0.181 | S | C | . | . | H | α-helix | trans | -67.4 | -32.9 | 177.7 | -71.9 | -73.8 | 0 | 0 | 0 | 112.2 | L181 T182 G183 I187 W188 V189 | L181-Y185 WeakPolarHBondContact O-CD2 3.42Å; L181-Y185 WeakPolarHBondContact O-CE2 3.36Å; T182-Y185 PolarHBondContact O-N 3.03Å; G183-Y185 PolarHBondContact O-N 2.79Å; Y185-I187 PolarHBondContact O-N 3.33Å; Y185-W188 PolarHBondContact O-N 2.85Å; Y185-W188 VanDerWaalsContact O-N 3.11Å; Y185-V189 WeakPolarHBondContact O-CG2 3.42Å; Y185-V189 PolarHBondContact O-N 3.06Å; Y185-V189 VanDerWaalsContact O-N 3.12Å |
| 186 | S | 82.9 | Confident | 86.9 | Confident | 38 Ų | 38 | 33 Ų | 33 | 27% | 0.266 | 17% | 0.171 | S | C | . | . | H | α-helix | trans | -64.2 | -30 | 175.4 | -59.4 | 0 | 0 | 0 | 0 | 112.4 | G183 Q184 | G183-S186 WeakPolarHBondContact O-CB 3.44Å; G183-S186 PolarHBondContact O-N 2.64Å; G183-S186 VanDerWaalsContact O-N 3.12Å; Q184-S186 VanDerWaalsContact C-N 3.3Å; Q184-S186 PolarHBondContact O-N 3.4Å |
| 187 | I | 87.4 | Confident | 86.4 | Confident | 1 Ų | 1 | 36.1 Ų | 36.1 | 1% | 0.005 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -66.1 | -46.2 | 172.8 | -58.2 | 176.4 | 0 | 0 | 0 | 109.4 | L39 L43 A137 Q184 Y185 V189 K190 W191 W246 I250 | L39-I187 HydrophobicContact CD1-CG2 4.3Å; L39-I187 HydrophobicContact CD2-CG2 3.81Å; L39-I187 HydrophobicContact CG-CG2 4.46Å; L43-I187 HydrophobicContact CD2-CD1 4.42Å; A137-I187 HydrophobicContact CB-CD1 4.31Å; A137-I187 HydrophobicContact CB-CG1 3.54Å; Q184-I187 WeakPolarHBondContact O-CB 3.46Å; Q184-I187 PolarHBondContact O-N 3.13Å; Y185-I187 PolarHBondContact O-N 3.33Å; I187-V189 VanDerWaalsContact C-N 3.26Å; I187-V189 PolarHBondContact O-N 2.8Å; I187-K190 PolarHBondContact O-N 3.49Å; I187-W191 HydrophobicContact CG2-CB 4.45Å; I187-W191 HydrophobicContact CG2-CG 4.17Å; I187-W191 WeakPolarHBondContact O-CB 3.33Å; I187-W191 PolarHBondContact O-N 3.36Å; I187-W246 HydrophobicContact CD1-CH2 3.56Å; I187-W246 HydrophobicContact CD1-CZ2 3.84Å; I187-I250 HydrophobicContact CD1-CG2 4.48Å |
| 188 | W | 87.6 | Confident | 85.9 | Confident | 5 Ų | 5 | 40 Ų | 40 | 2% | 0.019 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -64.5 | -28.1 | -179.5 | -66.5 | 125.3 | 0 | 0 | 0 | 114.3 | L39 A40 L43 Q184 Y185 K190 A192 L200 T201 A204 | L39-W188 HydrophobicContact CD2-CZ3 4.18Å; L39-W188 HydrophobicContact CG-CH2 4.29Å; L39-W188 HydrophobicContact CG-CZ3 4.41Å; A40-W188 HydrophobicContact CB-CH2 3.73Å; A40-W188 HydrophobicContact CB-CZ2 4.28Å; L43-W188 HydrophobicContact CB-CZ2 4.49Å; L43-W188 HydrophobicContact CD1-CH2 3.97Å; L43-W188 HydrophobicContact CD1-CZ2 3.31Å; Q184-W188 VanDerWaalsContact O-CD1 3.28Å; Q184-W188 PolarHBondContact O-N 3.23Å; Y185-W188 PolarHBondContact O-N 2.85Å; Y185-W188 VanDerWaalsContact O-N 3.11Å; W188-K190 PolarHBondContact O-N 3.31Å; W188-A192 HydrophobicContact CB-CB 4.31Å; W188-A192 HydrophobicContact CD2-CB 4.47Å; W188-A192 HydrophobicContact CE3-CB 3.72Å; W188-A192 HydrophobicContact CZ3-CB 4.48Å; W188-A192 WeakPolarHBondContact O-CB 3.23Å; W188-A192 PolarHBondContact O-N 3.31Å; W188-L200 HydrophobicContact CE3-CB 4.17Å; W188-L200 HydrophobicContact CE3-CD1 4.46Å; W188-L200 HydrophobicContact CH2-CB 3.81Å; W188-L200 HydrophobicContact CZ2-CB 4.36Å; W188-L200 HydrophobicContact CZ3-CB 3.71Å; W188-L200 HydrophobicContact CZ3-CD1 3.99Å; W188-L200 HydrophobicContact CZ3-CD2 4.49Å; W188-L200 HydrophobicContact CZ3-CG 4.28Å; W188-T201 HydrophobicContact CB-CG2 4.44Å; W188-T201 HydrophobicContact CD2-CG2 4.3Å; W188-T201 HydrophobicContact CG-CG2 3.88Å; W188-A204 HydrophobicContact CZ2-CB 3.81Å |
| 189 | V | 83.1 | Confident | 85.7 | Confident | 88 Ų | 88 | 45 Ų | 45 | 53% | 0.533 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -58.7 | -38.4 | 172.7 | 172.8 | 0 | 0 | 0 | 0 | 111.3 | Y185 I187 L272 | Y185-V189 WeakPolarHBondContact O-CG2 3.42Å; Y185-V189 PolarHBondContact O-N 3.06Å; Y185-V189 VanDerWaalsContact O-N 3.12Å; I187-V189 VanDerWaalsContact C-N 3.26Å; I187-V189 PolarHBondContact O-N 2.8Å; V189-L272 WeakPolarHBondContact O-CD2 3.44Å |
| 190 | K | 84.6 | Confident | 85.7 | Confident | 82 Ų | 82 | 42.6 Ų | 42.6 | 36% | 0.357 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -93.3 | -25.2 | -177.4 | -64.5 | -179.6 | 167.2 | -158.6 | 0 | 114.3 | I187 W188 D252 D253 L272 | I187-K190 PolarHBondContact O-N 3.49Å; W188-K190 PolarHBondContact O-N 3.31Å; K190-D252 VanDerWaalsContact CD-O 3.26Å; K190-D252 WeakPolarHBondContact CD-O 3.48Å; K190-D253 WeakPolarHBondContact CD-OD1 3.19Å; K190-D253 WeakPolarHBondContact CE-OD1 3.42Å; K190-D253 IonicContact NZ-OD1 3.34Å; K190-D253 PolarHBondContact NZ-OD1 3.11Å; K190-D253 IonicContact NZ-OD2 3.72Å; K190-D253 PolarHBondContact NZ-OD2 3.28Å; K190-L272 VanDerWaalsContact O-CD1 3.28Å; K190-L272 WeakPolarHBondContact O-CD1 3.34Å |
| 191 | W | 89.1 | Confident | 85.5 | Confident | 3 Ų | 3 | 44.4 Ų | 44.4 | 1% | 0.011 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -108.8 | -23.5 | -170.5 | -79.1 | 86.7 | 0 | 0 | 0 | 115.1 | V35 R36 L39 I187 P193 Y251 D252 P254 H257 I260 | V35-W191 HydrophobicContact CG1-CH2 4.18Å; V35-W191 HydrophobicContact CG1-CZ3 3.8Å; R36-W191 VanDerWaalsContact CD-O 3.26Å; R36-W191 WeakPolarHBondContact CD-O 3.35Å; R36-W191 HydrophobicContact CG-CE3 4.15Å; L39-W191 HydrophobicContact CD2-CB 3.68Å; L39-W191 HydrophobicContact CD2-CD2 3.56Å; L39-W191 HydrophobicContact CD2-CE3 3.8Å; L39-W191 HydrophobicContact CD2-CG 3.53Å; I187-W191 HydrophobicContact CG2-CB 4.45Å; I187-W191 HydrophobicContact CG2-CG 4.17Å; I187-W191 WeakPolarHBondContact O-CB 3.33Å; I187-W191 PolarHBondContact O-N 3.36Å; W191-P193 WeakPolarHBondContact O-CD 3.22Å; W191-Y251 WeakPolarHBondContact CZ2-O 3.43Å; W191-Y251 PolarHBondContact NE1-O 3.03Å; W191-D252 PolarHBondContact NE1-O 3.25Å; W191-D252 VanDerWaalsContact NE1-O 3.14Å; W191-P254 HydrophobicContact CD2-CB 4.21Å; W191-P254 HydrophobicContact CE3-CB 4.15Å; W191-P254 HydrophobicContact CH2-CB 4.07Å; W191-P254 HydrophobicContact CZ2-CB 4.11Å; W191-P254 HydrophobicContact CZ3-CB 4.08Å; W191-H257 HydrophobicContact CH2-CB 3.72Å; W191-H257 AromaticContact CH2-CD2 3.55Å; W191-H257 AromaticContact CH2-CG 3.74Å; W191-H257 HydrophobicContact CZ2-CB 4.26Å; W191-I260 HydrophobicContact CZ3-CD1 4.21Å |
| 192 | A | 87.7 | Confident | 85.5 | Confident | 0 Ų | 0 | 47.7 Ų | 47.7 | 0% | 0 | 25% | 0.253 | C | S | . | . | trans | -101.8 | 114.2 | -176.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | W188 R197 L200 | W188-A192 HydrophobicContact CB-CB 4.31Å; W188-A192 HydrophobicContact CD2-CB 4.47Å; W188-A192 HydrophobicContact CE3-CB 3.72Å; W188-A192 HydrophobicContact CZ3-CB 4.48Å; W188-A192 WeakPolarHBondContact O-CB 3.23Å; W188-A192 PolarHBondContact O-N 3.31Å; A192-R197 HydrophobicContact CB-CB 3.86Å; A192-R197 HydrophobicContact CB-CG 3.81Å; A192-R197 PolarHBondContact O-NE 2.86Å; A192-R197 PolarHBondContact O-NH2 2.95Å; A192-L200 HydrophobicContact CB-CD1 3.78Å | ||
| 193 | P | 87 | Confident | 85.7 | Confident | 1 Ų | 1 | 49.1 Ų | 49.1 | 1% | 0.006 | 26% | 0.259 | C | S | . | . | trans | -55.4 | 144.7 | 165.5 | -25.6 | 36.4 | 0 | 0 | 0 | 111.1 | W191 L195 E196 R197 Y267 I268 | W191-P193 WeakPolarHBondContact O-CD 3.22Å; P193-L195 VanDerWaalsContact C-N 3.31Å; P193-L195 PolarHBondContact O-N 3.47Å; P193-E196 PolarHBondContact O-N 2.94Å; P193-E196 VanDerWaalsContact O-N 3.1Å; P193-R197 WeakPolarHBondContact O-CB 3.46Å; P193-R197 PolarHBondContact O-N 2.92Å; P193-Y267 HydrophobicContact CB-CE1 4Å; P193-Y267 HydrophobicContact CG-CD1 4.07Å; P193-Y267 HydrophobicContact CG-CE1 3.54Å; P193-I268 HydrophobicContact CG-CG1 4.35Å | ||
| 194 | P | 79.9 | Confident | 86.1 | Confident | 51 Ų | 51 | 49.1 Ų | 49.1 | 33% | 0.331 | 26% | 0.259 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -58.1 | -39.8 | -170.2 | -27 | 36.6 | 0 | 0 | 0 | 114.2 | E196 Q275 | P194-E196 VanDerWaalsContact C-N 3.32Å; P194-E196 PolarHBondContact O-N 3.04Å; P194-Q275 VanDerWaalsContact CG-CD 3.47Å; P194-Q275 HydrophobicContact CG-CG 4.25Å |
| 195 | L | 80.3 | Confident | 86.3 | Confident | 164 Ų | 164 | 49.8 Ų | 49.8 | 86% | 0.859 | 27% | 0.27 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.4 | -29.1 | -178.6 | -65.7 | 173.4 | 0 | 0 | 0 | 113.1 | P193 | P193-L195 VanDerWaalsContact C-N 3.31Å; P193-L195 PolarHBondContact O-N 3.47Å |
| 196 | E | 84.4 | Confident | 86.6 | Confident | 28 Ų | 28 | 45.8 Ų | 45.8 | 13% | 0.131 | 26% | 0.26 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -104.6 | -7 | -176.6 | -60.7 | -174.6 | 169.7 | 0 | 0 | 112.5 | R36 P193 P194 S198 Q199 L200 | R36-E196 IonicContact CZ-OE2 2.73Å; R36-E196 IonicContact NH1-OE2 3.03Å; R36-E196 PolarHBondContact NH1-OE2 2.94Å; R36-E196 IonicContact NH2-OE2 2.76Å; P193-E196 PolarHBondContact O-N 2.94Å; P193-E196 VanDerWaalsContact O-N 3.1Å; P194-E196 VanDerWaalsContact C-N 3.32Å; P194-E196 PolarHBondContact O-N 3.04Å; E196-S198 PolarHBondContact O-N 3.28Å; E196-Q199 WeakPolarHBondContact O-CB 3.23Å; E196-Q199 PolarHBondContact O-N 3.48Å; E196-Q199 VanDerWaalsContact O-N 3.13Å; E196-L200 HydrophobicContact CB-CD1 4.46Å; E196-L200 PolarHBondContact O-N 3.17Å |
| 197 | R | 84.1 | Confident | 87.1 | Confident | 69 Ų | 69 | 44 Ų | 44 | 26% | 0.26 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -56.4 | -46.6 | -174.2 | -175.3 | 177.4 | -67.9 | 169.6 | 3.1 | 112.7 | A192 P193 Q199 L200 T201 Q275 | A192-R197 HydrophobicContact CB-CB 3.86Å; A192-R197 HydrophobicContact CB-CG 3.81Å; A192-R197 PolarHBondContact O-NE 2.86Å; A192-R197 PolarHBondContact O-NH2 2.95Å; P193-R197 WeakPolarHBondContact O-CB 3.46Å; P193-R197 PolarHBondContact O-N 2.92Å; R197-Q199 VanDerWaalsContact C-N 3.31Å; R197-Q199 PolarHBondContact O-N 2.98Å; R197-L200 PolarHBondContact O-N 3.4Å; R197-T201 HydrophobicContact CG-CG2 4.34Å; R197-T201 WeakPolarHBondContact O-CG2 3.39Å; R197-T201 PolarHBondContact O-N 2.9Å; R197-T201 PolarHBondContact O-OG1 2.97Å; R197-Q275 VanDerWaalsContact NH2-OE1 3.16Å |
| 198 | S | 83 | Confident | 87.3 | Confident | 86 Ų | 86 | 45 Ų | 45 | 60% | 0.601 | 25% | 0.254 | S | S | * | . | H | α-helix | trans | -59.1 | -43 | 179 | -177.8 | 0 | 0 | 0 | 0 | 112.1 | E196 T201 T202 | E196-S198 PolarHBondContact O-N 3.28Å; S198-T201 WeakPolarHBondContact CA-OG1 3.2Å; S198-T201 PolarHBondContact O-OG1 2.94Å; S198-T202 WeakPolarHBondContact O-CB 3.36Å; S198-T202 PolarHBondContact O-N 3.46Å; S198-T202 PolarHBondContact O-OG1 3Å |
| 199 | Q | 87.6 | Confident | 87.4 | Confident | 108 Ų | 108 | 48.5 Ų | 48.5 | 51% | 0.505 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -64.1 | -48.7 | 178.3 | -176.1 | -177.4 | -7.1 | 0 | 0 | 111.1 | E196 R197 T201 T202 I203 | E196-Q199 WeakPolarHBondContact O-CB 3.23Å; E196-Q199 PolarHBondContact O-N 3.48Å; E196-Q199 VanDerWaalsContact O-N 3.13Å; R197-Q199 VanDerWaalsContact C-N 3.31Å; R197-Q199 PolarHBondContact O-N 2.98Å; Q199-T201 PolarHBondContact O-N 3.33Å; Q199-T202 PolarHBondContact O-N 3Å; Q199-I203 HydrophobicContact CG-CD1 4.1Å; Q199-I203 WeakPolarHBondContact O-CG1 3.45Å; Q199-I203 PolarHBondContact O-N 3.37Å |
| 200 | L | 89.3 | Confident | 87.8 | Confident | 0 Ų | 0 | 48.3 Ų | 48.3 | 0% | 0 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -62.4 | -43.4 | 179.9 | -68.2 | 170.4 | 0 | 0 | 0 | 112 | R36 A40 W188 A192 E196 R197 T202 I203 A204 | R36-L200 HydrophobicContact CB-CD1 4.42Å; R36-L200 HydrophobicContact CB-CD2 4.5Å; A40-L200 HydrophobicContact CB-CD2 4.02Å; W188-L200 HydrophobicContact CE3-CB 4.17Å; W188-L200 HydrophobicContact CE3-CD1 4.46Å; W188-L200 HydrophobicContact CH2-CB 3.81Å; W188-L200 HydrophobicContact CZ2-CB 4.36Å; W188-L200 HydrophobicContact CZ3-CB 3.71Å; W188-L200 HydrophobicContact CZ3-CD1 3.99Å; W188-L200 HydrophobicContact CZ3-CD2 4.49Å; W188-L200 HydrophobicContact CZ3-CG 4.28Å; A192-L200 HydrophobicContact CB-CD1 3.78Å; E196-L200 HydrophobicContact CB-CD1 4.46Å; E196-L200 PolarHBondContact O-N 3.17Å; R197-L200 PolarHBondContact O-N 3.4Å; L200-T202 VanDerWaalsContact C-N 3.3Å; L200-T202 PolarHBondContact O-N 3.24Å; L200-I203 PolarHBondContact O-N 3.37Å; L200-A204 PolarHBondContact O-N 2.85Å |
| 201 | T | 87.3 | Confident | 88.2 | Confident | 38 Ų | 38 | 44.4 Ų | 44.4 | 23% | 0.233 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -65.7 | -33.4 | 176.2 | 52.5 | 0 | 0 | 0 | 0 | 112.3 | W188 R197 S198 Q199 G205 | W188-T201 HydrophobicContact CB-CG2 4.44Å; W188-T201 HydrophobicContact CD2-CG2 4.3Å; W188-T201 HydrophobicContact CG-CG2 3.88Å; R197-T201 HydrophobicContact CG-CG2 4.34Å; R197-T201 WeakPolarHBondContact O-CG2 3.39Å; R197-T201 PolarHBondContact O-N 2.9Å; R197-T201 PolarHBondContact O-OG1 2.97Å; S198-T201 WeakPolarHBondContact CA-OG1 3.2Å; S198-T201 PolarHBondContact O-OG1 2.94Å; Q199-T201 PolarHBondContact O-N 3.33Å; T201-G205 PolarHBondContact O-N 3.28Å |
| 202 | T | 88.8 | Confident | 88.3 | Confident | 91 Ų | 91 | 44.9 Ų | 44.9 | 56% | 0.558 | 25% | 0.254 | S | S | * | . | H | α-helix | trans | -71.6 | -42.5 | 177.7 | -58.6 | 0 | 0 | 0 | 0 | 111.3 | S198 Q199 L200 A204 G205 S206 | S198-T202 WeakPolarHBondContact O-CB 3.36Å; S198-T202 PolarHBondContact O-N 3.46Å; S198-T202 PolarHBondContact O-OG1 3Å; Q199-T202 PolarHBondContact O-N 3Å; L200-T202 VanDerWaalsContact C-N 3.3Å; L200-T202 PolarHBondContact O-N 3.24Å; T202-A204 PolarHBondContact O-N 3.13Å; T202-G205 PolarHBondContact O-N 3.25Å; T202-S206 PolarHBondContact O-N 3.08Å |
| 203 | I | 91.6 | Very high | 88.5 | Confident | 46 Ų | 46 | 48.3 Ų | 48.3 | 24% | 0.236 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -58 | -50.7 | 174.1 | -68.3 | 166.4 | 0 | 0 | 0 | 109.7 | A40 L41 Q44 Q199 L200 G205 S206 | A40-I203 HydrophobicContact CB-CB 4.16Å; A40-I203 HydrophobicContact CB-CG2 3.83Å; L41-I203 HydrophobicContact CD2-CG2 4.22Å; Q44-I203 WeakPolarHBondContact CG-O 3.26Å; Q199-I203 HydrophobicContact CG-CD1 4.1Å; Q199-I203 WeakPolarHBondContact O-CG1 3.45Å; Q199-I203 PolarHBondContact O-N 3.37Å; L200-I203 PolarHBondContact O-N 3.37Å; I203-G205 PolarHBondContact O-N 3.29Å; I203-S206 PolarHBondContact O-N 2.86Å; I203-S206 PolarHBondContact O-OG 3.44Å |
| 204 | A | 92.6 | Very high | 88.8 | Confident | 1 Ų | 1 | 50.9 Ų | 50.9 | 1% | 0.008 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -61.7 | -41.8 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | L43 Q44 N47 W188 L200 T202 S206 G207 | L43-A204 HydrophobicContact CB-CB 3.7Å; Q44-A204 WeakPolarHBondContact CA-O 3.33Å; N47-A204 PolarHBondContact ND2-O 3.48Å; W188-A204 HydrophobicContact CZ2-CB 3.81Å; L200-A204 PolarHBondContact O-N 2.85Å; T202-A204 PolarHBondContact O-N 3.13Å; A204-S206 VanDerWaalsContact C-N 3.32Å; A204-S206 PolarHBondContact O-N 3.23Å; A204-G207 PolarHBondContact O-N 3.18Å |
| 205 | G | 89.9 | Confident | 89.5 | Confident | 29 Ų | 29 | 48.5 Ų | 48.5 | 30% | 0.299 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -65 | -33 | 179.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | T201 T202 I203 G207 S208 | T201-G205 PolarHBondContact O-N 3.28Å; T202-G205 PolarHBondContact O-N 3.25Å; I203-G205 PolarHBondContact O-N 3.29Å; G205-G207 PolarHBondContact O-N 2.88Å; G205-S208 WeakPolarHBondContact O-CB 3.47Å; G205-S208 PolarHBondContact O-N 3.42Å; G205-S208 PolarHBondContact O-OG 3.17Å |
| 206 | S | 91.1 | Very high | 90 | Very high | 33 Ų | 33 | 40.7 Ų | 40.7 | 23% | 0.231 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -58.2 | -21.7 | -179.2 | 74.3 | 0 | 0 | 0 | 0 | 113.9 | Q44 T202 I203 A204 S208 M209 L210 | Q44-S206 PolarHBondContact NE2-OG 3.38Å; T202-S206 PolarHBondContact O-N 3.08Å; I203-S206 PolarHBondContact O-N 2.86Å; I203-S206 PolarHBondContact O-OG 3.44Å; A204-S206 VanDerWaalsContact C-N 3.32Å; A204-S206 PolarHBondContact O-N 3.23Å; S206-S208 PolarHBondContact O-N 3.09Å; S206-M209 PolarHBondContact O-N 3.45Å; S206-L210 PolarHBondContact O-N 3.06Å; S206-L210 VanDerWaalsContact O-N 3.13Å |
| 207 | G | 93.1 | Very high | 90.3 | Very high | 0 Ų | 0 | 42.6 Ų | 42.6 | 0% | 0 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -57.9 | -36 | 173.6 | 0 | 0 | 0 | 0 | 0 | 113 | Q44 F48 A204 G205 M209 L210 G211 | Q44-G207 WeakPolarHBondContact O-CA 3.32Å; F48-G207 WeakPolarHBondContact CA-O 3.42Å; A204-G207 PolarHBondContact O-N 3.18Å; G205-G207 PolarHBondContact O-N 2.88Å; G207-M209 VanDerWaalsContact C-N 3.35Å; G207-M209 PolarHBondContact O-N 3.05Å; G207-L210 PolarHBondContact O-N 2.73Å; G207-G211 PolarHBondContact O-N 3.24Å |
| 208 | S | 91.3 | Very high | 90.7 | Very high | 23 Ų | 23 | 41.4 Ų | 41.4 | 16% | 0.161 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -59.9 | -43.1 | 177.8 | 61 | 0 | 0 | 0 | 0 | 113.1 | Y51 G205 S206 S212 | Y51-S208 WeakPolarHBondContact CB-O 3.36Å; G205-S208 WeakPolarHBondContact O-CB 3.47Å; G205-S208 PolarHBondContact O-N 3.42Å; G205-S208 PolarHBondContact O-OG 3.17Å; S206-S208 PolarHBondContact O-N 3.09Å; S208-S212 WeakPolarHBondContact O-CB 3.37Å; S208-S212 PolarHBondContact O-N 2.89Å; S208-S212 PolarHBondContact O-OG 3.42Å |
| 209 | M | 89.7 | Confident | 91 | Very high | 78 Ų | 78 | 37.3 Ų | 37.3 | 38% | 0.384 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -69.7 | -47.1 | 179.4 | -57.2 | 159.4 | 76.8 | 0 | 0 | 110.3 | S206 G207 G211 S212 F213 C342 | S206-M209 PolarHBondContact O-N 3.45Å; G207-M209 VanDerWaalsContact C-N 3.35Å; G207-M209 PolarHBondContact O-N 3.05Å; M209-G211 VanDerWaalsContact C-N 3.31Å; M209-G211 PolarHBondContact O-N 3.36Å; M209-S212 PolarHBondContact O-N 3.35Å; M209-F213 WeakPolarHBondContact O-CB 3.43Å; M209-F213 PolarHBondContact O-N 2.95Å; M209-C342 HydrophobicContact CE-CB 3.21Å; M209-C342 WeakPolarHBondContact CE-SG 3.38Å |
| 210 | L | 92 | Very high | 91 | Very high | 83 Ų | 83 | 32.2 Ų | 32.2 | 44% | 0.435 | 18% | 0.184 | S | C | . | . | H | α-helix | trans | -60.3 | -42.5 | 176.3 | -71.8 | 173.3 | 0 | 0 | 0 | 111.5 | F48 S206 G207 F213 I214 | F48-L210 HydrophobicContact CD2-CB 3.98Å; F48-L210 HydrophobicContact CE2-CB 4.45Å; S206-L210 PolarHBondContact O-N 3.06Å; S206-L210 VanDerWaalsContact O-N 3.13Å; G207-L210 PolarHBondContact O-N 2.73Å; L210-F213 PolarHBondContact O-N 3.37Å; L210-I214 WeakPolarHBondContact O-CB 3.47Å; L210-I214 VanDerWaalsContact O-CG1 3.25Å; L210-I214 WeakPolarHBondContact O-CG1 3.18Å; L210-I214 PolarHBondContact O-N 2.98Å |
| 211 | G | 93.7 | Very high | 91 | Very high | 0 Ų | 0 | 35.6 Ų | 35.6 | 0% | 0 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -61.6 | -51.1 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | F48 T52 G207 M209 F213 I214 V215 | F48-G211 VanDerWaalsContact CD2-N 3.32Å; T52-G211 VanDerWaalsContact CG2-O 3.28Å; T52-G211 WeakPolarHBondContact CG2-O 3.33Å; G207-G211 PolarHBondContact O-N 3.24Å; M209-G211 VanDerWaalsContact C-N 3.31Å; M209-G211 PolarHBondContact O-N 3.36Å; G211-F213 VanDerWaalsContact C-N 3.31Å; G211-F213 PolarHBondContact O-N 3.39Å; G211-I214 PolarHBondContact O-N 2.8Å; G211-V215 VanDerWaalsContact O-CG1 3.25Å; G211-V215 WeakPolarHBondContact O-CG1 3.37Å; G211-V215 PolarHBondContact O-N 3.45Å |
| 212 | S | 91.1 | Very high | 91.2 | Very high | 13 Ų | 13 | 34.8 Ų | 34.8 | 9% | 0.091 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -58.4 | -41.1 | 177.7 | -57.8 | 0 | 0 | 0 | 0 | 112.5 | M55 S208 M209 V215 L216 | M55-S212 VanDerWaalsContact SD-CA 3.57Å; M55-S212 WeakPolarHBondContact SD-CB 2.98Å; S208-S212 WeakPolarHBondContact O-CB 3.37Å; S208-S212 PolarHBondContact O-N 2.89Å; S208-S212 PolarHBondContact O-OG 3.42Å; M209-S212 PolarHBondContact O-N 3.35Å; S212-V215 VanDerWaalsContact O-CG1 3.28Å; S212-V215 WeakPolarHBondContact O-CG1 3.4Å; S212-L216 WeakPolarHBondContact O-CD1 3.49Å; S212-L216 VanDerWaalsContact O-CG 3.27Å; S212-L216 WeakPolarHBondContact O-CG 3.44Å; S212-L216 PolarHBondContact O-N 3.31Å |
| 213 | F | 91.4 | Very high | 91.2 | Very high | 73 Ų | 73 | 31 Ų | 31 | 32% | 0.32 | 17% | 0.173 | S | C | . | . | H | α-helix | trans | -65.9 | -49.4 | 176.7 | 175.5 | -109.1 | 0 | 0 | 0 | 112.4 | M209 L210 G211 L216 L217 A335 V339 | M209-F213 WeakPolarHBondContact O-CB 3.43Å; M209-F213 PolarHBondContact O-N 2.95Å; L210-F213 PolarHBondContact O-N 3.37Å; G211-F213 VanDerWaalsContact C-N 3.31Å; G211-F213 PolarHBondContact O-N 3.39Å; F213-L216 PolarHBondContact O-N 3.11Å; F213-L217 HydrophobicContact CE1-CD1 4.19Å; F213-L217 HydrophobicContact CE2-CD1 4.22Å; F213-L217 HydrophobicContact CZ-CD1 3.69Å; F213-L217 WeakPolarHBondContact O-CB 3.27Å; F213-L217 PolarHBondContact O-N 3.26Å; F213-A335 HydrophobicContact CD2-CB 3.9Å; F213-A335 HydrophobicContact CE2-CB 4.08Å; F213-V339 HydrophobicContact CB-CG2 4.48Å; F213-V339 HydrophobicContact CD2-CG2 3.27Å; F213-V339 HydrophobicContact CE2-CG2 3.73Å; F213-V339 HydrophobicContact CG-CG2 4.12Å |
| 214 | I | 93.8 | Very high | 90.9 | Very high | 55 Ų | 55 | 32 Ų | 32 | 28% | 0.282 | 18% | 0.177 | S | C | . | . | H | α-helix | trans | -66.4 | -41.5 | -176.4 | -68.7 | -64 | 0 | 0 | 0 | 111.6 | F48 L210 G211 L217 V218 F235 | F48-I214 HydrophobicContact CE2-CB 4.04Å; F48-I214 HydrophobicContact CE2-CG1 3.99Å; F48-I214 HydrophobicContact CE2-CG2 4.41Å; F48-I214 HydrophobicContact CZ-CB 4.24Å; F48-I214 HydrophobicContact CZ-CG1 4.47Å; F48-I214 HydrophobicContact CZ-CG2 4.12Å; L210-I214 WeakPolarHBondContact O-CB 3.47Å; L210-I214 VanDerWaalsContact O-CG1 3.25Å; L210-I214 WeakPolarHBondContact O-CG1 3.18Å; L210-I214 PolarHBondContact O-N 2.98Å; G211-I214 PolarHBondContact O-N 2.8Å; I214-L217 PolarHBondContact O-N 2.91Å; I214-V218 HydrophobicContact CG2-CG2 4.1Å; I214-V218 VanDerWaalsContact O-CB 3.29Å; I214-V218 WeakPolarHBondContact O-CB 3.42Å; I214-V218 WeakPolarHBondContact O-CG2 3.35Å; I214-V218 PolarHBondContact O-N 3.13Å; I214-F235 HydrophobicContact CG2-CE1 4.19Å; I214-F235 HydrophobicContact CG2-CZ 4.31Å |
| 215 | V | 94.3 | Very high | 90.6 | Very high | 0 Ų | 0 | 35 Ų | 35 | 0% | 0 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -65.3 | -39.1 | 178 | 64.3 | 0 | 0 | 0 | 0 | 112.4 | T52 M55 N56 I59 G211 S212 G219 F235 | T52-V215 HydrophobicContact CG2-CB 4.18Å; M55-V215 HydrophobicContact CB-CG1 3.66Å; M55-V215 HydrophobicContact SD-CG1 4.15Å; N56-V215 WeakPolarHBondContact OD1-CG2 3.22Å; I59-V215 HydrophobicContact CG2-CG2 4.36Å; G211-V215 VanDerWaalsContact O-CG1 3.25Å; G211-V215 WeakPolarHBondContact O-CG1 3.37Å; G211-V215 PolarHBondContact O-N 3.45Å; S212-V215 VanDerWaalsContact O-CG1 3.28Å; S212-V215 WeakPolarHBondContact O-CG1 3.4Å; V215-G219 WeakPolarHBondContact O-CA 3.35Å; V215-G219 PolarHBondContact O-N 3.38Å; V215-F235 HydrophobicContact CB-CE2 4.17Å; V215-F235 HydrophobicContact CB-CZ 4.13Å; V215-F235 HydrophobicContact CG2-CD2 4.2Å; V215-F235 HydrophobicContact CG2-CE2 3.85Å; V215-F235 HydrophobicContact CG2-CZ 4.33Å |
| 216 | L | 90.8 | Very high | 90.4 | Very high | 1 Ų | 1 | 37 Ų | 37 | 1% | 0.005 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -68.3 | -42.2 | 177.4 | -69.8 | 173 | 0 | 0 | 0 | 111.2 | M55 I59 S212 F213 P316 G331 A335 F338 | M55-L216 HydrophobicContact CE-CD1 4.06Å; M55-L216 HydrophobicContact SD-CD1 4.09Å; M55-L216 HydrophobicContact SD-CG 4.21Å; I59-L216 HydrophobicContact CB-CD2 4.45Å; S212-L216 WeakPolarHBondContact O-CD1 3.49Å; S212-L216 VanDerWaalsContact O-CG 3.27Å; S212-L216 WeakPolarHBondContact O-CG 3.44Å; S212-L216 PolarHBondContact O-N 3.31Å; F213-L216 PolarHBondContact O-N 3.11Å; L216-P316 HydrophobicContact CD2-CG 4.11Å; L216-G331 CarbonylContact C-O 3.42Å; L216-G331 CarbonylContact O-C 3.44Å; L216-G331 WeakPolarHBondContact O-CA 3.42Å; L216-A335 HydrophobicContact CB-CB 3.97Å; L216-F338 HydrophobicContact CD1-CD2 3.54Å; L216-F338 HydrophobicContact CD1-CE2 3.73Å; L216-F338 HydrophobicContact CD1-CG 4.43Å |
| 217 | L | 90 | Very high | 90.3 | Very high | 67 Ų | 67 | 35.8 Ų | 35.8 | 35% | 0.351 | 19% | 0.191 | S | C | . | . | H | α-helix | trans | -68.9 | -47.8 | -179.7 | -173.6 | 142.3 | 0 | 0 | 0 | 112.7 | F213 I214 | F213-L217 HydrophobicContact CE1-CD1 4.19Å; F213-L217 HydrophobicContact CE2-CD1 4.22Å; F213-L217 HydrophobicContact CZ-CD1 3.69Å; F213-L217 WeakPolarHBondContact O-CB 3.27Å; F213-L217 PolarHBondContact O-N 3.26Å; I214-L217 PolarHBondContact O-N 2.91Å |
| 218 | V | 92.2 | Very high | 90.2 | Very high | 45 Ų | 45 | 35.9 Ų | 35.9 | 27% | 0.273 | 19% | 0.191 | S | C | . | . | H | α-helix | trans | -86.9 | -35.4 | -175.2 | -178.5 | 0 | 0 | 0 | 0 | 111.3 | I214 G220 L221 L222 | I214-V218 HydrophobicContact CG2-CG2 4.1Å; I214-V218 VanDerWaalsContact O-CB 3.29Å; I214-V218 WeakPolarHBondContact O-CB 3.42Å; I214-V218 WeakPolarHBondContact O-CG2 3.35Å; I214-V218 PolarHBondContact O-N 3.13Å; V218-G220 PolarHBondContact O-N 2.73Å; V218-L221 WeakPolarHBondContact O-CB 3.5Å; V218-L221 PolarHBondContact O-N 3.16Å; V218-L221 VanDerWaalsContact O-N 3.16Å; V218-L222 HydrophobicContact CG1-CD1 3.75Å; V218-L222 HydrophobicContact CG1-CD2 4.46Å; V218-L222 HydrophobicContact CG1-CG 3.88Å; V218-L222 WeakPolarHBondContact O-CG 3.34Å; V218-L222 PolarHBondContact O-N 3.02Å |
| 219 | G | 90.6 | Very high | 90.4 | Very high | 0 Ų | 0 | 35.8 Ų | 35.8 | 0% | 0 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -60.7 | -44.2 | -176.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | V215 L221 L222 C223 | V215-G219 WeakPolarHBondContact O-CA 3.35Å; V215-G219 PolarHBondContact O-N 3.38Å; G219-L221 VanDerWaalsContact C-N 3.3Å; G219-L221 PolarHBondContact O-N 3.12Å; G219-L222 PolarHBondContact O-N 3.14Å; G219-C223 WeakPolarHBondContact O-CB 3.3Å; G219-C223 PolarHBondContact O-N 3.48Å; G219-C223 PolarHBondContact O-SG 3.44Å |
| 220 | G | 87.6 | Confident | 90.6 | Very high | 0 Ų | 0 | 37.6 Ų | 37.6 | 0% | 0 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -62.3 | -37.5 | 176 | 0 | 0 | 0 | 0 | 0 | 112.9 | V218 Q224 L327 | V218-G220 PolarHBondContact O-N 2.73Å; G220-Q224 PolarHBondContact O-N 2.86Å; G220-L327 WeakPolarHBondContact CA-O 3.43Å |
| 221 | L | 89.6 | Confident | 90.7 | Very high | 71 Ų | 71 | 33.7 Ų | 33.7 | 37% | 0.372 | 17% | 0.173 | S | C | . | . | H | α-helix | trans | -66.2 | -47.9 | 175.2 | -180 | 67.5 | 0 | 0 | 0 | 111.3 | V218 G219 C223 Q224 T225 R328 | V218-L221 WeakPolarHBondContact O-CB 3.5Å; V218-L221 PolarHBondContact O-N 3.16Å; V218-L221 VanDerWaalsContact O-N 3.16Å; G219-L221 VanDerWaalsContact C-N 3.3Å; G219-L221 PolarHBondContact O-N 3.12Å; L221-C223 PolarHBondContact O-N 3.28Å; L221-Q224 PolarHBondContact O-N 3.16Å; L221-Q224 VanDerWaalsContact O-N 3.15Å; L221-T225 HydrophobicContact CD1-CG2 3.96Å; L221-T225 HydrophobicContact CG-CG2 4.46Å; L221-T225 PolarHBondContact O-N 3.11Å; L221-T225 PolarHBondContact O-OG1 3.01Å; L221-R328 HydrophobicContact CD1-CG 4.26Å |
| 222 | L | 91.1 | Very high | 90.8 | Very high | 21 Ų | 21 | 33.7 Ų | 33.7 | 11% | 0.11 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -61 | -44.3 | 178.7 | -66.2 | 171 | 0 | 0 | 0 | 111.5 | V218 G219 Q224 T225 I226 G227 V231 I234 | V218-L222 HydrophobicContact CG1-CD1 3.75Å; V218-L222 HydrophobicContact CG1-CD2 4.46Å; V218-L222 HydrophobicContact CG1-CG 3.88Å; V218-L222 WeakPolarHBondContact O-CG 3.34Å; V218-L222 PolarHBondContact O-N 3.02Å; G219-L222 PolarHBondContact O-N 3.14Å; L222-Q224 PolarHBondContact O-N 3.26Å; L222-T225 PolarHBondContact O-N 2.9Å; L222-I226 HydrophobicContact CB-CD1 4.44Å; L222-I226 HydrophobicContact CB-CG1 4.31Å; L222-I226 HydrophobicContact CD2-CD1 3.57Å; L222-I226 HydrophobicContact CD2-CG1 4.19Å; L222-I226 VanDerWaalsContact O-CG1 3.3Å; L222-I226 WeakPolarHBondContact O-CG1 3.24Å; L222-I226 PolarHBondContact O-N 3.25Å; L222-G227 PolarHBondContact O-N 3.47Å; L222-V231 HydrophobicContact CB-CG2 3.88Å; L222-V231 HydrophobicContact CD1-CG2 4.23Å; L222-I234 HydrophobicContact CD1-CD1 3.79Å; L222-I234 HydrophobicContact CD2-CD1 3.87Å; L222-I234 HydrophobicContact CG-CD1 4.49Å |
| 223 | C | 88.3 | Confident | 91.1 | Very high | 11 Ų | 11 | 37.9 Ų | 37.9 | 7% | 0.074 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -56.6 | -36 | 176.1 | -74.6 | 0 | 0 | 0 | 0 | 112.4 | A63 G219 L221 L327 | A63-C223 HydrophobicContact CB-CB 4.03Å; G219-C223 WeakPolarHBondContact O-CB 3.3Å; G219-C223 PolarHBondContact O-N 3.48Å; G219-C223 PolarHBondContact O-SG 3.44Å; L221-C223 PolarHBondContact O-N 3.28Å; C223-L327 HydrophobicContact CB-CD1 4.25Å |
| 224 | Q | 84.3 | Confident | 91.3 | Very high | 69 Ų | 69 | 37.6 Ų | 37.6 | 32% | 0.322 | 19% | 0.188 | S | C | . | . | H | α-helix | trans | -82.5 | -36.2 | -178.2 | -175 | 167.6 | -14.3 | 0 | 0 | 113.7 | G220 L221 L222 L327 R328 | G220-Q224 PolarHBondContact O-N 2.86Å; L221-Q224 PolarHBondContact O-N 3.16Å; L221-Q224 VanDerWaalsContact O-N 3.15Å; L222-Q224 PolarHBondContact O-N 3.26Å; Q224-L327 HydrophobicContact CB-CB 4.31Å; Q224-R328 VanDerWaalsContact OE1-N 3.07Å |
| 225 | T | 86.2 | Confident | 91.4 | Very high | 64 Ų | 64 | 35.2 Ų | 35.2 | 39% | 0.393 | 18% | 0.176 | S | C | . | . | H | α-helix | trans | -92.9 | -44.3 | -171.5 | 55.8 | 0 | 0 | 0 | 0 | 113.8 | L221 L222 | L221-T225 HydrophobicContact CD1-CG2 3.96Å; L221-T225 HydrophobicContact CG-CG2 4.46Å; L221-T225 PolarHBondContact O-N 3.11Å; L221-T225 PolarHBondContact O-OG1 3.01Å; L222-T225 PolarHBondContact O-N 2.9Å |
| 226 | I | 87.3 | Confident | 91.5 | Very high | 70 Ų | 70 | 35.2 Ų | 35.2 | 36% | 0.359 | 18% | 0.176 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -120.4 | -9.7 | -173 | 61.1 | 173.8 | 0 | 0 | 0 | 112.9 | L222 Y230 | L222-I226 HydrophobicContact CB-CD1 4.44Å; L222-I226 HydrophobicContact CB-CG1 4.31Å; L222-I226 HydrophobicContact CD2-CD1 3.57Å; L222-I226 HydrophobicContact CD2-CG1 4.19Å; L222-I226 VanDerWaalsContact O-CG1 3.3Å; L222-I226 WeakPolarHBondContact O-CG1 3.24Å; L222-I226 PolarHBondContact O-N 3.25Å; I226-Y230 HydrophobicContact CB-CD2 4.06Å; I226-Y230 HydrophobicContact CB-CE2 4.4Å; I226-Y230 VanDerWaalsContact CD1-CB 3.41Å; I226-Y230 HydrophobicContact CD1-CD1 4.03Å; I226-Y230 HydrophobicContact CD1-CD2 3.96Å; I226-Y230 HydrophobicContact CD1-CG 3.54Å; I226-Y230 HydrophobicContact CG1-CD2 3.91Å; I226-Y230 HydrophobicContact CG1-CG 3.99Å; I226-Y230 VanDerWaalsContact O-CD2 3.25Å; I226-Y230 WeakPolarHBondContact O-CD2 3.47Å; I226-Y230 WeakPolarHBondContact O-CE2 3.46Å |
| 227 | G | 88.5 | Confident | 91.8 | Very high | 7 Ų | 7 | 36.6 Ų | 36.6 | 7% | 0.072 | 19% | 0.191 | C | C | . | . | trans | 102.6 | 154.5 | 178.5 | 0 | 0 | 0 | 0 | 0 | 113.6 | L222 Y230 | L222-G227 PolarHBondContact O-N 3.47Å; G227-Y230 PolarHBondContact O-N 2.97Å | ||
| 228 | W | 91.7 | Very high | 92 | Very high | 3 Ų | 3 | 36.3 Ų | 36.3 | 1% | 0.011 | 19% | 0.189 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -59.3 | -30.7 | -176.3 | 68 | -103.4 | 0 | 0 | 0 | 115.7 | A60 A63 M64 P101 Y103 P156 A159 Y230 V231 F232 | A60-W228 HydrophobicContact CB-CB 4.43Å; A63-W228 HydrophobicContact CB-CB 4.11Å; M64-W228 HydrophobicContact CE-CD2 4.36Å; M64-W228 HydrophobicContact CE-CE3 3.94Å; M64-W228 HydrophobicContact CE-CH2 3.82Å; M64-W228 HydrophobicContact CE-CZ2 4.22Å; M64-W228 HydrophobicContact CE-CZ3 3.65Å; M64-W228 HydrophobicContact CG-CB 4.24Å; M64-W228 HydrophobicContact CG-CD2 3.45Å; M64-W228 VanDerWaalsContact CG-CD2 3.45Å; M64-W228 HydrophobicContact CG-CE3 3.84Å; M64-W228 HydrophobicContact CG-CG 3.62Å; M64-W228 HydrophobicContact CG-CZ2 4.35Å; M64-W228 HydrophobicContact CG-CZ3 4.43Å; M64-W228 HydrophobicContact SD-CD2 4.25Å; M64-W228 HydrophobicContact SD-CE3 4Å; M64-W228 HydrophobicContact SD-CZ3 4.32Å; P101-W228 HydrophobicContact CG-CZ2 4.06Å; P101-W228 PolarHBondContact O-NE1 3.46Å; Y103-W228 HydrophobicContact CE2-CH2 4.05Å; Y103-W228 AromaticContact CE2-CZ2 3.56Å; Y103-W228 HydrophobicContact CE2-CZ2 3.56Å; P156-W228 HydrophobicContact CB-CH2 3.98Å; P156-W228 HydrophobicContact CB-CZ3 3.79Å; P156-W228 HydrophobicContact CG-CZ3 4.03Å; A159-W228 HydrophobicContact CB-CH2 4.04Å; W228-Y230 PolarHBondContact O-N 3.41Å; W228-V231 WeakPolarHBondContact O-CB 3.47Å; W228-V231 PolarHBondContact O-N 3.32Å; W228-F232 AromaticContact CE3-CD2 3.91Å; W228-F232 HydrophobicContact CE3-CD2 3.91Å; W228-F232 AromaticContact CE3-CE2 3.67Å; W228-F232 HydrophobicContact CE3-CE2 3.67Å; W228-F232 HydrophobicContact CZ3-CD2 4.09Å; W228-F232 AromaticContact CZ3-CE2 3.99Å; W228-F232 HydrophobicContact CZ3-CE2 3.99Å |
| 229 | P | 94.5 | Very high | 92.2 | Very high | 20 Ų | 20 | 34.2 Ų | 34.2 | 13% | 0.13 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -59.5 | -32.6 | -178.4 | -28 | 38.3 | 0 | 0 | 0 | 113.3 | P156 V231 F232 Y233 | P156-P229 HydrophobicContact CB-CB 3.96Å; P156-P229 HydrophobicContact CG-CB 4.02Å; P229-V231 VanDerWaalsContact C-N 3.28Å; P229-V231 PolarHBondContact O-N 3.24Å; P229-F232 WeakPolarHBondContact O-CB 3.26Å; P229-F232 PolarHBondContact O-N 3.22Å; P229-F232 VanDerWaalsContact O-N 3.1Å; P229-Y233 HydrophobicContact CB-CD2 4.39Å; P229-Y233 HydrophobicContact CB-CE2 3.84Å; P229-Y233 WeakPolarHBondContact O-CD2 3.47Å; P229-Y233 PolarHBondContact O-N 3.21Å; P229-Y233 VanDerWaalsContact O-N 3.17Å |
| 230 | Y | 93.6 | Very high | 92.4 | Very high | 117 Ų | 117 | 35.4 Ų | 35.4 | 46% | 0.459 | 18% | 0.184 | S | C | . | . | H | α-helix | trans | -68.7 | -24.2 | -177.1 | -73.9 | -84.9 | 0 | 0 | 0 | 113.9 | I226 G227 W228 F232 Y233 I234 | I226-Y230 HydrophobicContact CB-CD2 4.06Å; I226-Y230 HydrophobicContact CB-CE2 4.4Å; I226-Y230 VanDerWaalsContact CD1-CB 3.41Å; I226-Y230 HydrophobicContact CD1-CD1 4.03Å; I226-Y230 HydrophobicContact CD1-CD2 3.96Å; I226-Y230 HydrophobicContact CD1-CG 3.54Å; I226-Y230 HydrophobicContact CG1-CD2 3.91Å; I226-Y230 HydrophobicContact CG1-CG 3.99Å; I226-Y230 VanDerWaalsContact O-CD2 3.25Å; I226-Y230 WeakPolarHBondContact O-CD2 3.47Å; I226-Y230 WeakPolarHBondContact O-CE2 3.46Å; G227-Y230 PolarHBondContact O-N 2.97Å; W228-Y230 PolarHBondContact O-N 3.41Å; Y230-F232 PolarHBondContact O-N 2.95Å; Y230-Y233 HydrophobicContact CD1-CD2 4.29Å; Y230-Y233 PolarHBondContact O-N 3.22Å; Y230-I234 WeakPolarHBondContact O-CB 3.48Å; Y230-I234 VanDerWaalsContact O-CG1 3.26Å; Y230-I234 WeakPolarHBondContact O-CG1 3.22Å; Y230-I234 PolarHBondContact O-N 2.9Å |
| 231 | V | 94.4 | Very high | 92.8 | Very high | 0 Ų | 0 | 37.8 Ų | 37.8 | 0% | 0 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -57.5 | -44.4 | 171.3 | 179.5 | 0 | 0 | 0 | 0 | 109.4 | N56 L222 W228 P229 F235 | N56-V231 HydrophobicContact CB-CG1 4.02Å; N56-V231 WeakPolarHBondContact OD1-CG1 3.44Å; L222-V231 HydrophobicContact CB-CG2 3.88Å; L222-V231 HydrophobicContact CD1-CG2 4.23Å; W228-V231 WeakPolarHBondContact O-CB 3.47Å; W228-V231 PolarHBondContact O-N 3.32Å; P229-V231 VanDerWaalsContact C-N 3.28Å; P229-V231 PolarHBondContact O-N 3.24Å; V231-F235 HydrophobicContact CG1-CD2 3.92Å; V231-F235 HydrophobicContact CG1-CE2 4.13Å; V231-F235 WeakPolarHBondContact O-CD2 3.39Å; V231-F235 PolarHBondContact O-N 3.34Å |
| 232 | F | 96.3 | Very high | 93 | Very high | 0 Ų | 0 | 34.9 Ų | 34.9 | 0% | 0 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -71.6 | -42.1 | 179 | -60.4 | -77.6 | 0 | 0 | 0 | 112.5 | N56 L57 A60 M64 T152 I155 P156 W228 P229 Y230 G236 | N56-F232 HydrophobicContact CB-CD1 4.05Å; N56-F232 HydrophobicContact CB-CE1 3.72Å; N56-F232 HydrophobicContact CB-CZ 4.41Å; L57-F232 HydrophobicContact CB-CE1 4.45Å; L57-F232 HydrophobicContact CB-CZ 4.41Å; L57-F232 HydrophobicContact CD1-CE1 4.38Å; L57-F232 HydrophobicContact CD1-CZ 4.28Å; L57-F232 HydrophobicContact CG-CZ 4.45Å; A60-F232 HydrophobicContact CB-CE2 3.72Å; A60-F232 HydrophobicContact CB-CZ 3.76Å; M64-F232 HydrophobicContact SD-CE2 4.31Å; M64-F232 HydrophobicContact SD-CZ 4.46Å; T152-F232 HydrophobicContact CG2-CB 4.23Å; T152-F232 HydrophobicContact CG2-CD1 4.04Å; I155-F232 HydrophobicContact CB-CD1 3.85Å; I155-F232 HydrophobicContact CB-CE1 4.18Å; I155-F232 HydrophobicContact CB-CG 4.17Å; I155-F232 HydrophobicContact CD1-CD1 3.74Å; I155-F232 HydrophobicContact CD1-CE1 3.81Å; I155-F232 HydrophobicContact CG1-CD1 4.37Å; I155-F232 HydrophobicContact CG2-CD1 3.68Å; I155-F232 HydrophobicContact CG2-CD2 4.22Å; I155-F232 HydrophobicContact CG2-CE1 3.55Å; I155-F232 HydrophobicContact CG2-CE2 4.1Å; I155-F232 HydrophobicContact CG2-CG 4.02Å; I155-F232 HydrophobicContact CG2-CZ 3.77Å; P156-F232 HydrophobicContact CG-CB 3.81Å; P156-F232 HydrophobicContact CG-CD2 4.03Å; P156-F232 HydrophobicContact CG-CG 4.17Å; W228-F232 AromaticContact CE3-CD2 3.91Å; W228-F232 HydrophobicContact CE3-CD2 3.91Å; W228-F232 AromaticContact CE3-CE2 3.67Å; W228-F232 HydrophobicContact CE3-CE2 3.67Å; W228-F232 HydrophobicContact CZ3-CD2 4.09Å; W228-F232 AromaticContact CZ3-CE2 3.99Å; W228-F232 HydrophobicContact CZ3-CE2 3.99Å; P229-F232 WeakPolarHBondContact O-CB 3.26Å; P229-F232 PolarHBondContact O-N 3.22Å; P229-F232 VanDerWaalsContact O-N 3.1Å; Y230-F232 PolarHBondContact O-N 2.95Å; F232-G236 WeakPolarHBondContact O-CA 3.4Å; F232-G236 PolarHBondContact O-N 2.86Å |
| 233 | Y | 96.3 | Very high | 93 | Very high | 102 Ų | 102 | 34 Ų | 34 | 40% | 0.4 | 18% | 0.184 | S | C | . | . | H | α-helix | trans | -65 | -43.3 | 178.9 | -61.3 | -39.8 | 0 | 0 | 0 | 113.1 | L153 P156 P229 Y230 G237 | L153-Y233 HydrophobicContact CD2-CD1 4.26Å; L153-Y233 WeakPolarHBondContact CD2-O 3.38Å; L153-Y233 WeakPolarHBondContact O-CE1 3.33Å; P156-Y233 HydrophobicContact CB-CE1 4.41Å; P156-Y233 HydrophobicContact CG-CD1 4.49Å; P156-Y233 HydrophobicContact CG-CE1 3.89Å; P229-Y233 HydrophobicContact CB-CD2 4.39Å; P229-Y233 HydrophobicContact CB-CE2 3.84Å; P229-Y233 WeakPolarHBondContact O-CD2 3.47Å; P229-Y233 PolarHBondContact O-N 3.21Å; P229-Y233 VanDerWaalsContact O-N 3.17Å; Y230-Y233 HydrophobicContact CD1-CD2 4.29Å; Y230-Y233 PolarHBondContact O-N 3.22Å; Y233-G237 WeakPolarHBondContact O-CA 3.49Å; Y233-G237 PolarHBondContact O-N 3.15Å |
| 234 | I | 96.1 | Very high | 93.2 | Very high | 67 Ų | 67 | 39.9 Ų | 39.9 | 34% | 0.344 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -68.1 | -54.8 | -178.8 | -68.2 | 167.1 | 0 | 0 | 0 | 110.3 | L222 Y230 G237 I238 | L222-I234 HydrophobicContact CD1-CD1 3.79Å; L222-I234 HydrophobicContact CD2-CD1 3.87Å; L222-I234 HydrophobicContact CG-CD1 4.49Å; Y230-I234 WeakPolarHBondContact O-CB 3.48Å; Y230-I234 VanDerWaalsContact O-CG1 3.26Å; Y230-I234 WeakPolarHBondContact O-CG1 3.22Å; Y230-I234 PolarHBondContact O-N 2.9Å; I234-G237 PolarHBondContact O-N 3.45Å; I234-I238 HydrophobicContact CG2-CD1 3.94Å; I234-I238 VanDerWaalsContact O-CG1 3.29Å; I234-I238 WeakPolarHBondContact O-CG1 3.48Å; I234-I238 PolarHBondContact O-N 3.23Å |
| 235 | F | 95.8 | Very high | 93.4 | Very high | 5 Ų | 5 | 41.1 Ų | 41.1 | 2% | 0.022 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -73.4 | -30 | -176.6 | -68.4 | -63.7 | 0 | 0 | 0 | 113.2 | T52 Q53 N56 I214 V215 V231 I238 G239 | T52-F235 HydrophobicContact CG2-CD1 3.71Å; T52-F235 HydrophobicContact CG2-CE1 3.77Å; T52-F235 HydrophobicContact CG2-CG 4.5Å; Q53-F235 PolarHBondContact NE2-O 3.42Å; N56-F235 WeakPolarHBondContact OD1-CD2 3.19Å; I214-F235 HydrophobicContact CG2-CE1 4.19Å; I214-F235 HydrophobicContact CG2-CZ 4.31Å; V215-F235 HydrophobicContact CB-CE2 4.17Å; V215-F235 HydrophobicContact CB-CZ 4.13Å; V215-F235 HydrophobicContact CG2-CD2 4.2Å; V215-F235 HydrophobicContact CG2-CE2 3.85Å; V215-F235 HydrophobicContact CG2-CZ 4.33Å; V231-F235 HydrophobicContact CG1-CD2 3.92Å; V231-F235 HydrophobicContact CG1-CE2 4.13Å; V231-F235 WeakPolarHBondContact O-CD2 3.39Å; V231-F235 PolarHBondContact O-N 3.34Å; F235-I238 HydrophobicContact CD1-CD1 4.15Å; F235-G239 PolarHBondContact O-N 3.21Å; F235-G239 VanDerWaalsContact O-N 3.14Å |
| 236 | G | 96.4 | Very high | 93.7 | Very high | 0 Ų | 0 | 38 Ų | 38 | 0% | 0 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -67.1 | -40.8 | 168.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | F232 G239 C240 | F232-G236 WeakPolarHBondContact O-CA 3.4Å; F232-G236 PolarHBondContact O-N 2.86Å; G236-G239 PolarHBondContact O-N 2.92Å; G236-C240 PolarHBondContact O-N 3.28Å; G236-C240 PolarHBondContact O-SG 3.49Å |
| 237 | G | 96.8 | Very high | 93.9 | Very high | 30 Ų | 30 | 38.4 Ų | 38.4 | 31% | 0.309 | 20% | 0.203 | S | C | . | . | H | α-helix | trans | -65.7 | -43.9 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | Y233 I234 G239 C240 A241 | Y233-G237 WeakPolarHBondContact O-CA 3.49Å; Y233-G237 PolarHBondContact O-N 3.15Å; I234-G237 PolarHBondContact O-N 3.45Å; G237-G239 VanDerWaalsContact C-N 3.32Å; G237-G239 PolarHBondContact O-N 3.42Å; G237-C240 PolarHBondContact O-N 3.31Å; G237-A241 PolarHBondContact O-N 2.9Å |
| 238 | I | 95.8 | Very high | 93.9 | Very high | 61 Ų | 61 | 41.7 Ų | 41.7 | 31% | 0.313 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -56.4 | -48.1 | 172.7 | -69.8 | 165.5 | 0 | 0 | 0 | 109.9 | F48 I234 F235 C240 A241 C242 | F48-I238 HydrophobicContact CE1-CG2 4.46Å; I234-I238 HydrophobicContact CG2-CD1 3.94Å; I234-I238 VanDerWaalsContact O-CG1 3.29Å; I234-I238 WeakPolarHBondContact O-CG1 3.48Å; I234-I238 PolarHBondContact O-N 3.23Å; F235-I238 HydrophobicContact CD1-CD1 4.15Å; I238-C240 VanDerWaalsContact C-N 3.34Å; I238-C240 PolarHBondContact O-N 2.75Å; I238-A241 PolarHBondContact O-N 2.69Å; I238-C242 PolarHBondContact O-N 3.2Å; I238-C242 PolarHBondContact O-SG 3.25Å |
| 239 | G | 95.3 | Very high | 93.7 | Very high | 0 Ų | 0 | 45.5 Ų | 45.5 | 0% | 0 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -61.8 | -38.7 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | S149 F235 G236 G237 C242 C243 | S149-G239 VanDerWaalsContact OG-C 3.29Å; S149-G239 VanDerWaalsContact OG-CA 3.26Å; S149-G239 WeakPolarHBondContact OG-CA 3.03Å; F235-G239 PolarHBondContact O-N 3.21Å; F235-G239 VanDerWaalsContact O-N 3.14Å; G236-G239 PolarHBondContact O-N 2.92Å; G237-G239 VanDerWaalsContact C-N 3.32Å; G237-G239 PolarHBondContact O-N 3.42Å; G239-C242 WeakPolarHBondContact O-CB 3.41Å; G239-C242 PolarHBondContact O-N 2.97Å; G239-C243 PolarHBondContact O-N 3.17Å |
| 240 | C | 95.6 | Very high | 93.5 | Very high | 25 Ų | 25 | 44.6 Ų | 44.6 | 17% | 0.169 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -64.5 | -43.5 | 173.9 | -66.5 | 0 | 0 | 0 | 0 | 111.9 | G236 G237 I238 C242 C243 L244 | G236-C240 PolarHBondContact O-N 3.28Å; G236-C240 PolarHBondContact O-SG 3.49Å; G237-C240 PolarHBondContact O-N 3.31Å; I238-C240 VanDerWaalsContact C-N 3.34Å; I238-C240 PolarHBondContact O-N 2.75Å; C240-C242 VanDerWaalsContact C-N 3.33Å; C240-C242 PolarHBondContact O-N 2.83Å; C240-C243 WeakPolarHBondContact O-CB 3.46Å; C240-C243 PolarHBondContact O-N 3.04Å; C240-C243 VanDerWaalsContact O-N 3.14Å; C240-L244 PolarHBondContact O-N 3.44Å |
| 241 | A | 94.7 | Very high | 93.3 | Very high | 50 Ų | 50 | 42.3 Ų | 42.3 | 41% | 0.413 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -62 | -41.2 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | G237 I238 C243 L244 L245 | G237-A241 PolarHBondContact O-N 2.9Å; I238-A241 PolarHBondContact O-N 2.69Å; A241-C243 VanDerWaalsContact C-N 3.27Å; A241-C243 PolarHBondContact O-N 3.18Å; A241-L244 WeakPolarHBondContact O-CB 3.36Å; A241-L244 PolarHBondContact O-N 3.3Å; A241-L244 VanDerWaalsContact O-N 3.16Å; A241-L245 PolarHBondContact O-N 3.35Å; A241-L245 VanDerWaalsContact O-N 3.12Å |
| 242 | C | 93.8 | Very high | 92.8 | Very high | 10 Ų | 10 | 43.8 Ų | 43.8 | 7% | 0.068 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -60.7 | -38.2 | 173.8 | -64.3 | 0 | 0 | 0 | 0 | 111.6 | L45 S49 L145 I238 G239 C240 L245 W246 | L45-C242 HydrophobicContact CD2-CB 4.43Å; L45-C242 VanDerWaalsContact CD2-SG 3.53Å; L45-C242 HydrophobicContact CG-CB 4.47Å; L45-C242 WeakPolarHBondContact CG-SG 3.39Å; S49-C242 PolarHBondContact OG-SG 3.46Å; S49-C242 VanDerWaalsContact OG-SG 3.4Å; L145-C242 HydrophobicContact CD2-CB 4.18Å; I238-C242 PolarHBondContact O-N 3.2Å; I238-C242 PolarHBondContact O-SG 3.25Å; G239-C242 WeakPolarHBondContact O-CB 3.41Å; G239-C242 PolarHBondContact O-N 2.97Å; C240-C242 VanDerWaalsContact C-N 3.33Å; C240-C242 PolarHBondContact O-N 2.83Å; C242-L245 PolarHBondContact O-N 2.99Å; C242-W246 WeakPolarHBondContact O-CB 3.44Å; C242-W246 PolarHBondContact O-N 3.46Å |
| 243 | C | 92.4 | Very high | 92.3 | Very high | 2 Ų | 2 | 46.4 Ų | 46.4 | 1% | 0.014 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -66.2 | -36.9 | 175 | -171 | 0 | 0 | 0 | 0 | 113.1 | G142 L145 F146 G239 C240 A241 L245 W246 F247 | G142-C243 PolarHBondContact O-SG 2.97Å; L145-C243 HydrophobicContact CD2-CB 4.21Å; L145-C243 HydrophobicContact CG-CB 4.31Å; F146-C243 HydrophobicContact CB-CB 4.46Å; F146-C243 VanDerWaalsContact CB-SG 3.59Å; G239-C243 PolarHBondContact O-N 3.17Å; C240-C243 WeakPolarHBondContact O-CB 3.46Å; C240-C243 PolarHBondContact O-N 3.04Å; C240-C243 VanDerWaalsContact O-N 3.14Å; A241-C243 VanDerWaalsContact C-N 3.27Å; A241-C243 PolarHBondContact O-N 3.18Å; C243-L245 VanDerWaalsContact C-N 3.27Å; C243-L245 PolarHBondContact O-N 3.45Å; C243-W246 WeakPolarHBondContact O-CB 3.36Å; C243-W246 PolarHBondContact O-N 3.45Å; C243-F247 WeakPolarHBondContact O-CD2 3.14Å; C243-F247 WeakPolarHBondContact SG-CE2 3.1Å |
| 244 | L | 91 | Very high | 91.8 | Very high | 136 Ų | 136 | 41.9 Ų | 41.9 | 71% | 0.712 | 23% | 0.234 | S | C | * | . | H | α-helix | trans | -64.5 | -34.2 | 174.4 | -67.6 | 175.7 | 0 | 0 | 0 | 111.7 | C240 A241 P248 | C240-L244 PolarHBondContact O-N 3.44Å; A241-L244 WeakPolarHBondContact O-CB 3.36Å; A241-L244 PolarHBondContact O-N 3.3Å; A241-L244 VanDerWaalsContact O-N 3.16Å; L244-P248 WeakPolarHBondContact O-CD 3.28Å; L244-P248 WeakPolarHBondContact O-CG 3.38Å |
| 245 | L | 89.8 | Confident | 91.2 | Very high | 94 Ų | 94 | 42.3 Ų | 42.3 | 49% | 0.492 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -75.1 | -29.8 | 173.4 | -64.3 | 175.6 | 0 | 0 | 0 | 112.7 | A241 C242 C243 P248 L249 | A241-L245 PolarHBondContact O-N 3.35Å; A241-L245 VanDerWaalsContact O-N 3.12Å; C242-L245 PolarHBondContact O-N 2.99Å; C243-L245 VanDerWaalsContact C-N 3.27Å; C243-L245 PolarHBondContact O-N 3.45Å; L245-P248 VanDerWaalsContact O-CD 3.29Å; L245-P248 WeakPolarHBondContact O-CD 3.32Å; L245-P248 WeakPolarHBondContact O-CG 3.29Å; L245-L249 HydrophobicContact CB-CD1 4.15Å; L245-L249 VanDerWaalsContact O-CB 3.3Å; L245-L249 WeakPolarHBondContact O-CB 3.32Å; L245-L249 WeakPolarHBondContact O-CD1 3.36Å; L245-L249 WeakPolarHBondContact O-CG 3.45Å; L245-L249 PolarHBondContact O-N 3.21Å |
| 246 | W | 92.2 | Very high | 90.7 | Very high | 0 Ų | 0 | 47.2 Ų | 47.2 | 0% | 0 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -61.6 | -53.3 | -177 | 176.4 | -94.1 | 0 | 0 | 0 | 113.3 | I42 L43 K138 V141 G142 I187 C242 C243 L249 I250 | I42-W246 HydrophobicContact CG2-CE3 3.9Å; I42-W246 HydrophobicContact CG2-CZ3 4.13Å; L43-W246 HydrophobicContact CD2-CH2 3.7Å; L43-W246 HydrophobicContact CD2-CZ3 3.71Å; L43-W246 HydrophobicContact CG-CH2 4.44Å; L43-W246 HydrophobicContact CG-CZ3 4.24Å; K138-W246 PolarHBondContact O-NE1 2.93Å; V141-W246 HydrophobicContact CB-CH2 4.17Å; V141-W246 HydrophobicContact CB-CZ2 3.6Å; V141-W246 HydrophobicContact CG1-CH2 3.56Å; V141-W246 HydrophobicContact CG1-CZ2 3.42Å; V141-W246 VanDerWaalsContact CG1-CZ2 3.42Å; V141-W246 HydrophobicContact CG1-CZ3 4.19Å; G142-W246 VanDerWaalsContact CA-NE1 3.34Å; I187-W246 HydrophobicContact CD1-CH2 3.56Å; I187-W246 HydrophobicContact CD1-CZ2 3.84Å; C242-W246 WeakPolarHBondContact O-CB 3.44Å; C242-W246 PolarHBondContact O-N 3.46Å; C243-W246 WeakPolarHBondContact O-CB 3.36Å; C243-W246 PolarHBondContact O-N 3.45Å; W246-L249 PolarHBondContact O-N 3.18Å; W246-I250 HydrophobicContact CD2-CB 4.24Å; W246-I250 HydrophobicContact CD2-CG1 3.6Å; W246-I250 HydrophobicContact CE3-CD1 4.07Å; W246-I250 HydrophobicContact CE3-CG1 3.49Å; W246-I250 VanDerWaalsContact CE3-CG1 3.49Å; W246-I250 HydrophobicContact CG-CG1 4.24Å; W246-I250 HydrophobicContact CH2-CB 4.42Å; W246-I250 HydrophobicContact CH2-CD1 4.05Å; W246-I250 HydrophobicContact CH2-CG1 3.85Å; W246-I250 HydrophobicContact CH2-CG2 3.98Å; W246-I250 HydrophobicContact CZ2-CB 4.14Å; W246-I250 HydrophobicContact CZ2-CG1 3.97Å; W246-I250 HydrophobicContact CZ2-CG2 3.67Å; W246-I250 HydrophobicContact CZ3-CD1 3.76Å; W246-I250 HydrophobicContact CZ3-CG1 3.61Å; W246-I250 WeakPolarHBondContact O-CB 3.16Å; W246-I250 WeakPolarHBondContact O-CG1 3.29Å; W246-I250 PolarHBondContact O-N 3.46Å |
| 247 | F | 90.4 | Very high | 90.2 | Very high | 78 Ų | 78 | 48.3 Ų | 48.3 | 34% | 0.342 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -60.7 | -40.6 | -175.3 | -71.7 | -68.9 | 0 | 0 | 0 | 115.4 | K138 Y139 C243 | K138-F247 WeakPolarHBondContact CE-O 3.44Å; K138-F247 PolarHBondContact NZ-O 3.46Å; Y139-F247 HydrophobicContact CD1-CE1 4.31Å; C243-F247 WeakPolarHBondContact O-CD2 3.14Å; C243-F247 WeakPolarHBondContact SG-CE2 3.1Å |
| 248 | P | 89.4 | Confident | 89.6 | Confident | 75 Ų | 75 | 50.6 Ų | 50.6 | 49% | 0.487 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -76.6 | -29.9 | 176.2 | 27.1 | -33.9 | 0 | 0 | 0 | 113.7 | L244 L245 Y251 | L244-P248 WeakPolarHBondContact O-CD 3.28Å; L244-P248 WeakPolarHBondContact O-CG 3.38Å; L245-P248 VanDerWaalsContact O-CD 3.29Å; L245-P248 WeakPolarHBondContact O-CD 3.32Å; L245-P248 WeakPolarHBondContact O-CG 3.29Å; P248-Y251 WeakPolarHBondContact O-CE2 3.28Å; P248-Y251 PolarHBondContact O-OH 3.03Å |
| 249 | L | 88.4 | Confident | 89.1 | Confident | 83 Ų | 83 | 56.1 Ų | 56.1 | 44% | 0.435 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -91.3 | -25.5 | -172.2 | -63.8 | 174.7 | 0 | 0 | 0 | 114.1 | I42 L245 W246 | I42-L249 HydrophobicContact CD1-CB 3.73Å; I42-L249 HydrophobicContact CD1-CD1 3.92Å; I42-L249 HydrophobicContact CD1-CG 4.41Å; I42-L249 HydrophobicContact CG1-CD1 4.41Å; L245-L249 HydrophobicContact CB-CD1 4.15Å; L245-L249 VanDerWaalsContact O-CB 3.3Å; L245-L249 WeakPolarHBondContact O-CB 3.32Å; L245-L249 WeakPolarHBondContact O-CD1 3.36Å; L245-L249 WeakPolarHBondContact O-CG 3.45Å; L245-L249 PolarHBondContact O-N 3.21Å; W246-L249 PolarHBondContact O-N 3.18Å |
| 250 | I | 90 | Very high | 88.7 | Confident | 1 Ų | 1 | 57.1 Ų | 57.1 | 1% | 0.005 | 31% | 0.307 | C | S | . | . | trans | -100 | 138.2 | -174 | -58.1 | -69.6 | 0 | 0 | 0 | 111.6 | L39 I42 K138 I187 W246 | L39-I250 HydrophobicContact CD1-CD1 3.13Å; I42-I250 HydrophobicContact CB-CD1 4.27Å; I42-I250 HydrophobicContact CD1-CD1 4.12Å; I42-I250 HydrophobicContact CG2-CD1 3.87Å; I42-I250 HydrophobicContact CG2-CG1 4.26Å; K138-I250 HydrophobicContact CB-CG2 4.32Å; K138-I250 WeakPolarHBondContact CD-O 3.24Å; K138-I250 WeakPolarHBondContact CE-O 3.24Å; K138-I250 HydrophobicContact CG-CG2 4.25Å; K138-I250 PolarHBondContact NZ-O 3.18Å; I187-I250 HydrophobicContact CD1-CG2 4.48Å; W246-I250 HydrophobicContact CD2-CB 4.24Å; W246-I250 HydrophobicContact CD2-CG1 3.6Å; W246-I250 HydrophobicContact CE3-CD1 4.07Å; W246-I250 HydrophobicContact CE3-CG1 3.49Å; W246-I250 VanDerWaalsContact CE3-CG1 3.49Å; W246-I250 HydrophobicContact CG-CG1 4.24Å; W246-I250 HydrophobicContact CH2-CB 4.42Å; W246-I250 HydrophobicContact CH2-CD1 4.05Å; W246-I250 HydrophobicContact CH2-CG1 3.85Å; W246-I250 HydrophobicContact CH2-CG2 3.98Å; W246-I250 HydrophobicContact CZ2-CB 4.14Å; W246-I250 HydrophobicContact CZ2-CG1 3.97Å; W246-I250 HydrophobicContact CZ2-CG2 3.67Å; W246-I250 HydrophobicContact CZ3-CD1 3.76Å; W246-I250 HydrophobicContact CZ3-CG1 3.61Å; W246-I250 WeakPolarHBondContact O-CB 3.16Å; W246-I250 WeakPolarHBondContact O-CG1 3.29Å; W246-I250 PolarHBondContact O-N 3.46Å | ||
| 251 | Y | 88 | Confident | 88.4 | Confident | 70 Ų | 70 | 59 Ų | 59 | 28% | 0.275 | 32% | 0.321 | S | S | . | . | trans | -132.5 | 137.2 | 175.2 | -67.2 | -98.9 | 0 | 0 | 0 | 108.9 | W191 P248 D253 H257 P258 | W191-Y251 WeakPolarHBondContact CZ2-O 3.43Å; W191-Y251 PolarHBondContact NE1-O 3.03Å; P248-Y251 WeakPolarHBondContact O-CE2 3.28Å; P248-Y251 PolarHBondContact O-OH 3.03Å; Y251-D253 VanDerWaalsContact C-N 3.34Å; Y251-D253 PolarHBondContact O-N 2.94Å; Y251-H257 AromaticContact CD2-CD2 3.48Å; Y251-H257 VanDerWaalsContact CD2-CD2 3.48Å; Y251-H257 WeakPolarHBondContact CD2-CD2 3.28Å; Y251-P258 HydrophobicContact CE2-CG 4.31Å | ||
| 252 | D | 84.9 | Confident | 87.9 | Confident | 30 Ų | 30 | 60.7 Ų | 60.7 | 16% | 0.16 | 33% | 0.334 | C | S | . | . | S | Bend | trans | -65 | -39.4 | -178.2 | -78.9 | -49 | 0 | 0 | 0 | 112.4 | A137 K138 K190 W191 | A137-D252 WeakPolarHBondContact CA-OD1 3.47Å; A137-D252 PolarHBondContact N-OD1 3.45Å; K138-D252 WeakPolarHBondContact CB-OD1 3.38Å; K138-D252 WeakPolarHBondContact CB-OD2 3.42Å; K138-D252 PolarHBondContact N-OD1 2.99Å; K190-D252 VanDerWaalsContact CD-O 3.26Å; K190-D252 WeakPolarHBondContact CD-O 3.48Å; W191-D252 PolarHBondContact NE1-O 3.25Å; W191-D252 VanDerWaalsContact NE1-O 3.14Å |
| 253 | D | 85.1 | Confident | 87.5 | Confident | 56 Ų | 56 | 62.7 Ų | 62.7 | 30% | 0.299 | 36% | 0.357 | S | S | . | . | S | Bend | trans | -114.6 | 132.8 | -178.4 | -67.7 | -64.9 | 0 | 0 | 0 | 111.2 | K190 Y251 V255 N256 | K190-D253 WeakPolarHBondContact CD-OD1 3.19Å; K190-D253 WeakPolarHBondContact CE-OD1 3.42Å; K190-D253 IonicContact NZ-OD1 3.34Å; K190-D253 PolarHBondContact NZ-OD1 3.11Å; K190-D253 IonicContact NZ-OD2 3.72Å; K190-D253 PolarHBondContact NZ-OD2 3.28Å; Y251-D253 VanDerWaalsContact C-N 3.34Å; Y251-D253 PolarHBondContact O-N 2.94Å; D253-V255 PolarHBondContact O-N 2.91Å; D253-V255 VanDerWaalsContact O-N 3.12Å; D253-N256 PolarHBondContact O-N 2.98Å; D253-N256 VanDerWaalsContact O-N 3.11Å |
| 254 | P | 85.2 | Confident | 87.2 | Confident | 7 Ų | 7 | 63.4 Ų | 63.4 | 5% | 0.045 | 36% | 0.36 | C | S | . | . | G | 310 helix | trans | -62 | -23 | 176.7 | 26.8 | -35 | 0 | 0 | 0 | 111.8 | W191 N256 H257 I260 I268 | W191-P254 HydrophobicContact CD2-CB 4.21Å; W191-P254 HydrophobicContact CE3-CB 4.15Å; W191-P254 HydrophobicContact CH2-CB 4.07Å; W191-P254 HydrophobicContact CZ2-CB 4.11Å; W191-P254 HydrophobicContact CZ3-CB 4.08Å; P254-N256 VanDerWaalsContact C-N 3.27Å; P254-N256 PolarHBondContact O-N 3.48Å; P254-H257 PolarHBondContact O-N 3.44Å; P254-I260 HydrophobicContact CB-CD1 3.96Å; P254-I268 HydrophobicContact CB-CD1 4.16Å; P254-I268 HydrophobicContact CG-CG2 4.15Å |
| 255 | V | 84.1 | Confident | 87 | Confident | 76 Ų | 76 | 60.2 Ų | 60.2 | 46% | 0.461 | 34% | 0.34 | S | S | . | . | G | 310 helix | trans | -63.7 | -34 | 178.5 | -179.9 | 0 | 0 | 0 | 0 | 112.2 | D253 K265 | D253-V255 PolarHBondContact O-N 2.91Å; D253-V255 VanDerWaalsContact O-N 3.12Å; V255-K265 PolarHBondContact O-NZ 3.43Å |
| 256 | N | 85.5 | Confident | 86.9 | Confident | 107 Ų | 107 | 64.4 Ų | 64.4 | 57% | 0.572 | 35% | 0.35 | S | S | * | . | G | 310 helix | trans | -93.6 | -1.4 | -174.8 | -63.5 | -27.1 | 0 | 0 | 0 | 112.8 | D253 P254 | D253-N256 PolarHBondContact O-N 2.98Å; D253-N256 VanDerWaalsContact O-N 3.11Å; P254-N256 VanDerWaalsContact C-N 3.27Å; P254-N256 PolarHBondContact O-N 3.48Å |
| 257 | H | 85.9 | Confident | 86.6 | Confident | 24 Ų | 24 | 66.2 Ų | 66.2 | 11% | 0.111 | 36% | 0.357 | C | S | . | . | trans | -77.2 | 122.9 | -177 | -171.2 | -80.7 | 0 | 0 | 0 | 111 | V35 W191 Y251 P254 F259 I260 | V35-H257 VanDerWaalsContact CG1-CE1 3.45Å; V35-H257 WeakPolarHBondContact CG1-CE1 3.38Å; W191-H257 HydrophobicContact CH2-CB 3.72Å; W191-H257 AromaticContact CH2-CD2 3.55Å; W191-H257 AromaticContact CH2-CG 3.74Å; W191-H257 HydrophobicContact CZ2-CB 4.26Å; Y251-H257 AromaticContact CD2-CD2 3.48Å; Y251-H257 VanDerWaalsContact CD2-CD2 3.48Å; Y251-H257 WeakPolarHBondContact CD2-CD2 3.28Å; P254-H257 PolarHBondContact O-N 3.44Å; H257-F259 PolarHBondContact ND1-N 3.38Å; H257-F259 PolarHBondContact O-N 3.1Å; H257-I260 HydrophobicContact CB-CB 4.14Å; H257-I260 HydrophobicContact CB-CG2 4.18Å; H257-I260 PolarHBondContact ND1-N 3.42Å; H257-I260 WeakPolarHBondContact O-CG2 3.4Å | ||
| 258 | P | 85.1 | Confident | 86.4 | Confident | 77 Ų | 77 | 62.5 Ų | 62.5 | 50% | 0.5 | 34% | 0.34 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -70.1 | -30.1 | -169.8 | 24.9 | -33.2 | 0 | 0 | 0 | 114 | Y251 | Y251-P258 HydrophobicContact CE2-CG 4.31Š|
| 259 | F | 83.9 | Confident | 86.3 | Confident | 177 Ų | 177 | 62.2 Ų | 62.2 | 78% | 0.776 | 34% | 0.337 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -104.5 | 10.8 | -174.6 | -56.1 | -70.4 | 0 | 0 | 0 | 114 | H257 | H257-F259 PolarHBondContact ND1-N 3.38Å; H257-F259 PolarHBondContact O-N 3.1Å |
| 260 | I | 87.9 | Confident | 86.1 | Confident | 22 Ų | 22 | 61 Ų | 61 | 11% | 0.113 | 34% | 0.335 | C | S | . | . | trans | -76.8 | 134.4 | 179.5 | -162.5 | 171.2 | 0 | 0 | 0 | 110.1 | V35 W191 P254 H257 E264 K265 I268 | V35-I260 HydrophobicContact CG2-CG1 4.44Å; W191-I260 HydrophobicContact CZ3-CD1 4.21Å; P254-I260 HydrophobicContact CB-CD1 3.96Å; H257-I260 HydrophobicContact CB-CB 4.14Å; H257-I260 HydrophobicContact CB-CG2 4.18Å; H257-I260 PolarHBondContact ND1-N 3.42Å; H257-I260 WeakPolarHBondContact O-CG2 3.4Å; I260-E264 HydrophobicContact CD1-CG 4.31Å; I260-E264 HydrophobicContact CG1-CB 4.22Å; I260-E264 HydrophobicContact CG1-CG 4.21Å; I260-K265 HydrophobicContact CD1-CB 4.13Å; I260-K265 HydrophobicContact CG1-CB 4.39Å; I260-K265 HydrophobicContact CG2-CB 4.25Å; I260-K265 HydrophobicContact CG2-CD 4.28Å; I260-I268 HydrophobicContact CD1-CD1 3.99Å | ||
| 261 | S | 87.9 | Confident | 85.7 | Confident | 65 Ų | 65 | 62 Ų | 62 | 46% | 0.455 | 34% | 0.342 | S | S | . | . | trans | -68.6 | 146.2 | 174.5 | 72.4 | 0 | 0 | 0 | 0 | 110.9 | G263 E264 K265 | S261-G263 PolarHBondContact O-N 3.22Å; S261-E264 PolarHBondContact O-N 2.87Å; S261-E264 WeakPolarHBondContact OG-CB 3.47Å; S261-E264 PolarHBondContact OG-N 2.83Å; S261-E264 VanDerWaalsContact OG-N 3.16Å; S261-K265 WeakPolarHBondContact O-CB 3.41Å; S261-K265 PolarHBondContact O-N 2.89Å | ||
| 262 | A | 85.8 | Confident | 85.4 | Confident | 85 Ų | 85 | 60.3 Ų | 60.3 | 70% | 0.702 | 34% | 0.337 | S | S | * | . | H | α-helix | trans | -59.8 | -36.1 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | R266 | A262-R266 WeakPolarHBondContact O-CB 3.28Å; A262-R266 PolarHBondContact O-N 2.81Å |
| 263 | G | 85.2 | Confident | 85 | Confident | 52 Ų | 52 | 61.9 Ų | 61.9 | 54% | 0.536 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -64.4 | -47.4 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | S261 K265 R266 Y267 | S261-G263 PolarHBondContact O-N 3.22Å; G263-K265 PolarHBondContact O-N 2.66Å; G263-R266 PolarHBondContact O-N 3.45Å; G263-Y267 WeakPolarHBondContact O-CB 3.28Å; G263-Y267 PolarHBondContact O-N 3.38Å |
| 264 | E | 85.5 | Confident | 84 | Confident | 17 Ų | 17 | 67.6 Ų | 67.6 | 8% | 0.079 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -64.2 | -42 | 177.7 | -177.7 | 169.1 | -160.9 | 0 | 0 | 111.9 | S34 V35 R36 I260 S261 R266 Y267 I268 | S34-E264 WeakPolarHBondContact CB-OE1 3.43Å; S34-E264 PolarHBondContact OG-OE1 3.31Å; V35-E264 PolarHBondContact N-OE1 2.87Å; V35-E264 PolarHBondContact N-OE2 3.11Å; V35-E264 VanDerWaalsContact N-OE2 3.13Å; R36-E264 WeakPolarHBondContact CG-OE1 3.14Å; R36-E264 IonicContact CZ-OE1 3.69Å; R36-E264 PolarHBondContact N-OE1 3.32Å; R36-E264 IonicContact NE-OE1 2.62Å; R36-E264 PolarHBondContact NE-OE1 2.84Å; R36-E264 IonicContact NH2-OE1 3.97Å; I260-E264 HydrophobicContact CD1-CG 4.31Å; I260-E264 HydrophobicContact CG1-CB 4.22Å; I260-E264 HydrophobicContact CG1-CG 4.21Å; S261-E264 PolarHBondContact O-N 2.87Å; S261-E264 WeakPolarHBondContact OG-CB 3.47Å; S261-E264 PolarHBondContact OG-N 2.83Å; S261-E264 VanDerWaalsContact OG-N 3.16Å; E264-R266 PolarHBondContact O-N 3.25Å; E264-Y267 PolarHBondContact O-N 2.87Å; E264-I268 HydrophobicContact CG-CD1 4.12Å; E264-I268 VanDerWaalsContact O-CG1 3.3Å; E264-I268 WeakPolarHBondContact O-CG1 3.34Å; E264-I268 PolarHBondContact O-N 2.91Å |
| 265 | K | 86.9 | Confident | 82.8 | Confident | 69 Ų | 69 | 71.1 Ų | 71.1 | 30% | 0.3 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -59.3 | -45.9 | 175.5 | 179.5 | 171.5 | 170.7 | 169.2 | 0 | 111.6 | V255 I260 S261 G263 I268 V269 | V255-K265 PolarHBondContact O-NZ 3.43Å; I260-K265 HydrophobicContact CD1-CB 4.13Å; I260-K265 HydrophobicContact CG1-CB 4.39Å; I260-K265 HydrophobicContact CG2-CB 4.25Å; I260-K265 HydrophobicContact CG2-CD 4.28Å; S261-K265 WeakPolarHBondContact O-CB 3.41Å; S261-K265 PolarHBondContact O-N 2.89Å; G263-K265 PolarHBondContact O-N 2.66Å; K265-I268 PolarHBondContact O-N 3.35Å; K265-V269 WeakPolarHBondContact O-CG2 3.2Å; K265-V269 PolarHBondContact O-N 3.44Å; K265-V269 VanDerWaalsContact O-N 3.1Å |
| 266 | R | 86.9 | Confident | 81 | Confident | 182 Ų | 182 | 74.5 Ų | 74.5 | 69% | 0.687 | 41% | 0.411 | S | S | * | . | H | α-helix | trans | -63.7 | -44.2 | 177.8 | -172.3 | 173.5 | -176.8 | 148.1 | -0.7 | 111.4 | A262 G263 E264 I268 V269 C270 | A262-R266 WeakPolarHBondContact O-CB 3.28Å; A262-R266 PolarHBondContact O-N 2.81Å; G263-R266 PolarHBondContact O-N 3.45Å; E264-R266 PolarHBondContact O-N 3.25Å; R266-I268 PolarHBondContact O-N 3.05Å; R266-V269 PolarHBondContact O-N 3.48Å; R266-C270 VanDerWaalsContact O-CB 3.3Å; R266-C270 WeakPolarHBondContact O-CB 3.33Å; R266-C270 PolarHBondContact O-N 2.99Å; R266-C270 PolarHBondContact O-SG 3.49Å |
| 267 | Y | 86.7 | Confident | 79 | Confident | 38 Ų | 38 | 74.3 Ų | 74.3 | 15% | 0.149 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -56.8 | -46.4 | 176.9 | 174.4 | -116.4 | 0 | 0 | 0 | 112.4 | C27 P193 G263 E264 S271 | C27-Y267 HydrophobicContact CB-CD2 4.19Å; P193-Y267 HydrophobicContact CB-CE1 4Å; P193-Y267 HydrophobicContact CG-CD1 4.07Å; P193-Y267 HydrophobicContact CG-CE1 3.54Å; G263-Y267 WeakPolarHBondContact O-CB 3.28Å; G263-Y267 PolarHBondContact O-N 3.38Å; E264-Y267 PolarHBondContact O-N 2.87Å; Y267-S271 VanDerWaalsContact O-CB 3.24Å; Y267-S271 WeakPolarHBondContact O-CB 3.07Å; Y267-S271 PolarHBondContact O-N 3.42Å; Y267-S271 PolarHBondContact O-OG 2.94Å |
| 268 | I | 86.2 | Confident | 77.1 | Confident | 0 Ų | 0 | 76.6 Ų | 76.6 | 0% | 0 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -62.5 | -52.6 | 178.6 | -64.1 | 165 | 0 | 0 | 0 | 110.7 | R36 P193 P254 I260 E264 K265 R266 C270 S271 L272 | R36-I268 HydrophobicContact CG-CD1 3.93Å; P193-I268 HydrophobicContact CG-CG1 4.35Å; P254-I268 HydrophobicContact CB-CD1 4.16Å; P254-I268 HydrophobicContact CG-CG2 4.15Å; I260-I268 HydrophobicContact CD1-CD1 3.99Å; E264-I268 HydrophobicContact CG-CD1 4.12Å; E264-I268 VanDerWaalsContact O-CG1 3.3Å; E264-I268 WeakPolarHBondContact O-CG1 3.34Å; E264-I268 PolarHBondContact O-N 2.91Å; K265-I268 PolarHBondContact O-N 3.35Å; R266-I268 PolarHBondContact O-N 3.05Å; I268-C270 PolarHBondContact O-N 3.43Å; I268-S271 PolarHBondContact O-N 2.96Å; I268-L272 HydrophobicContact CG2-CD1 3.67Å; I268-L272 HydrophobicContact CG2-CG 4.35Å; I268-L272 WeakPolarHBondContact O-CB 3.2Å; I268-L272 WeakPolarHBondContact O-CG 3.28Å; I268-L272 PolarHBondContact O-N 3.2Å |
| 269 | V | 86.5 | Confident | 74.9 | Confident | 69 Ų | 69 | 79.6 Ų | 79.6 | 42% | 0.418 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -62.9 | -44 | -176.2 | 173.9 | 0 | 0 | 0 | 0 | 111.2 | K265 R266 S271 L272 A273 | K265-V269 WeakPolarHBondContact O-CG2 3.2Å; K265-V269 PolarHBondContact O-N 3.44Å; K265-V269 VanDerWaalsContact O-N 3.1Å; R266-V269 PolarHBondContact O-N 3.48Å; V269-S271 PolarHBondContact O-N 3.38Å; V269-L272 PolarHBondContact O-N 2.76Å; V269-A273 WeakPolarHBondContact O-CB 3.42Å; V269-A273 PolarHBondContact O-N 3.3Å |
| 270 | C | 85.3 | Confident | 73.2 | Confident | 58 Ų | 58 | 74.7 Ų | 74.7 | 39% | 0.392 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -64 | -41 | 177.1 | -69.9 | 0 | 0 | 0 | 0 | 112 | R266 I268 L272 Q274 | R266-C270 VanDerWaalsContact O-CB 3.3Å; R266-C270 WeakPolarHBondContact O-CB 3.33Å; R266-C270 PolarHBondContact O-N 2.99Å; R266-C270 PolarHBondContact O-SG 3.49Å; I268-C270 PolarHBondContact O-N 3.43Å; C270-L272 VanDerWaalsContact C-N 3.33Å; C270-L272 PolarHBondContact O-N 2.96Å; C270-Q274 PolarHBondContact O-N 2.99Å |
| 271 | S | 82.4 | Confident | 72 | Confident | 21 Ų | 21 | 79.6 Ų | 79.6 | 15% | 0.147 | 47% | 0.471 | C | S | . | . | H | α-helix | trans | -67.2 | -33.5 | 178.9 | -60.2 | 0 | 0 | 0 | 0 | 112.8 | Y267 I268 V269 | Y267-S271 VanDerWaalsContact O-CB 3.24Å; Y267-S271 WeakPolarHBondContact O-CB 3.07Å; Y267-S271 PolarHBondContact O-N 3.42Å; Y267-S271 PolarHBondContact O-OG 2.94Å; I268-S271 PolarHBondContact O-N 2.96Å; V269-S271 PolarHBondContact O-N 3.38Å |
| 272 | L | 81.3 | Confident | 71.3 | Confident | 34 Ų | 34 | 81.4 Ų | 81.4 | 18% | 0.178 | 48% | 0.484 | C | S | . | . | H | α-helix | trans | -80.4 | -36.7 | 178.3 | -68.3 | 174 | 0 | 0 | 0 | 112.5 | V189 K190 I268 V269 C270 Q274 Q275 | V189-L272 WeakPolarHBondContact O-CD2 3.44Å; K190-L272 VanDerWaalsContact O-CD1 3.28Å; K190-L272 WeakPolarHBondContact O-CD1 3.34Å; I268-L272 HydrophobicContact CG2-CD1 3.67Å; I268-L272 HydrophobicContact CG2-CG 4.35Å; I268-L272 WeakPolarHBondContact O-CB 3.2Å; I268-L272 WeakPolarHBondContact O-CG 3.28Å; I268-L272 PolarHBondContact O-N 3.2Å; V269-L272 PolarHBondContact O-N 2.76Å; C270-L272 VanDerWaalsContact C-N 3.33Å; C270-L272 PolarHBondContact O-N 2.96Å; L272-Q274 PolarHBondContact O-N 3.18Å; L272-Q275 WeakPolarHBondContact O-CA 3.33Å; L272-Q275 WeakPolarHBondContact O-CB 3.41Å; L272-Q275 PolarHBondContact O-N 2.9Å |
| 273 | A | 76.1 | Confident | 71.1 | Confident | 63 Ų | 63 | 81 Ų | 81 | 52% | 0.521 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -64 | -28.4 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | V269 Q275 | V269-A273 WeakPolarHBondContact O-CB 3.42Å; V269-A273 PolarHBondContact O-N 3.3Å; A273-Q275 PolarHBondContact O-N 2.66Å |
| 274 | Q | 63.1 | Low | 71.3 | Confident | 176 Ų | 176 | 80.2 Ų | 80.2 | 82% | 0.822 | 46% | 0.455 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.3 | -10.3 | 170.9 | -71.5 | 178.2 | -5.5 | 0 | 0 | 113.2 | C270 L272 | C270-Q274 PolarHBondContact O-N 2.99Å; L272-Q274 PolarHBondContact O-N 3.18Å |
| 275 | Q | 61.4 | Low | 71.5 | Confident | 82 Ų | 82 | 83.7 Ų | 83.7 | 38% | 0.383 | 47% | 0.473 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -103.2 | -5.5 | -173.3 | -139.6 | -177.2 | 26.7 | 0 | 0 | 114 | P194 R197 L272 A273 C277 | P194-Q275 VanDerWaalsContact CG-CD 3.47Å; P194-Q275 HydrophobicContact CG-CG 4.25Å; R197-Q275 VanDerWaalsContact NH2-OE1 3.16Å; L272-Q275 WeakPolarHBondContact O-CA 3.33Å; L272-Q275 WeakPolarHBondContact O-CB 3.41Å; L272-Q275 PolarHBondContact O-N 2.9Å; A273-Q275 PolarHBondContact O-N 2.66Å; Q275-C277 VanDerWaalsContact C-N 3.28Å; Q275-C277 PolarHBondContact O-N 2.71Å |
| 276 | D | 45.2 | Very low | 71.6 | Confident | 146 Ų | 146 | 89.6 Ų | 89.6 | 78% | 0.781 | 49% | 0.493 | S | S | * | . | trans | -67.5 | 84 | -179.7 | -81.2 | -27.8 | 0 | 0 | 0 | 111.4 | ||||
| 277 | C | 44.8 | Very low | 71.7 | Confident | 104 Ų | 104 | 82.9 Ų | 82.9 | 70% | 0.703 | 48% | 0.477 | S | S | * | . | trans | -77.8 | 116.4 | 163.5 | -79.2 | 0 | 0 | 0 | 0 | 109.4 | Q275 | Q275-C277 VanDerWaalsContact C-N 3.28Å; Q275-C277 PolarHBondContact O-N 2.71Å | ||
| 278 | S | 44.2 | Very low | 71.9 | Confident | 71 Ų | 71 | 81.4 Ų | 81.4 | 50% | 0.497 | 47% | 0.471 | S | S | . | . | trans | 8.5 | 124.6 | 165.6 | 58.9 | 0 | 0 | 0 | 0 | 119.1 | W281 | S278-W281 PolarHBondContact OG-NE1 2.92Š| ||
| 279 | P | 40.2 | Very low | 72.3 | Confident | 140 Ų | 140 | 86.2 Ų | 86.2 | 91% | 0.909 | 50% | 0.496 | S | S | * | . | S | Bend | trans | -72.3 | 137.2 | 174.4 | 30.7 | -32 | 0 | 0 | 0 | 111.4 | ||
| 280 | G | 48.6 | Very low | 72.6 | Confident | 74 Ų | 74 | 90 Ų | 90 | 76% | 0.763 | 51% | 0.507 | S | S | * | . | trans | 114.6 | 49.7 | 160.6 | 0 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 281 | W | 62.4 | Low | 73.1 | Confident | 126 Ų | 126 | 87.7 Ų | 87.7 | 48% | 0.477 | 49% | 0.491 | S | S | . | . | P | Polyproline II helix | trans | -94.8 | 124 | 173.4 | -61.6 | -11 | 0 | 0 | 0 | 111.8 | S278 R423 | S278-W281 PolarHBondContact OG-NE1 2.92Å; W281-R423 HydrophobicContact CZ3-CB 4.26Å; W281-R423 HydrophobicContact CZ3-CG 4.32Å |
| 282 | S | 73.4 | Confident | 73.7 | Confident | 102 Ų | 102 | 91 Ų | 91 | 71% | 0.713 | 51% | 0.507 | S | S | * | . | P | Polyproline II helix | trans | -78.9 | 132 | 170.9 | 58.8 | 0 | 0 | 0 | 0 | 110.6 | P284 | S282-P284 WeakPolarHBondContact O-CD 3.36Š|
| 283 | L | 82 | Confident | 74.4 | Confident | 78 Ų | 78 | 90 Ų | 90 | 41% | 0.408 | 50% | 0.502 | S | S | . | . | P | Polyproline II helix | trans | -68 | 120.2 | 174.6 | -72.2 | 167.4 | 0 | 0 | 0 | 110.6 | I285 Y424 F427 | L283-I285 HydrophobicContact CB-CD1 4.41Å; L283-I285 HydrophobicContact CB-CG1 3.93Å; L283-I285 PolarHBondContact O-N 3.48Å; L283-Y424 HydrophobicContact CD2-CD1 3.84Å; L283-Y424 HydrophobicContact CD2-CE1 4.16Å; L283-F427 HydrophobicContact CD1-CD2 4.18Å; L283-F427 HydrophobicContact CD1-CE2 4.39Å; L283-F427 HydrophobicContact CD2-CB 4.4Å; L283-F427 HydrophobicContact CD2-CG 4.29Å |
| 284 | P | 87.8 | Confident | 75.3 | Confident | 34 Ų | 34 | 87.2 Ų | 87.2 | 22% | 0.221 | 48% | 0.479 | C | S | . | . | trans | -80 | 55.6 | -179.5 | 34.3 | -36.2 | 0 | 0 | 0 | 111.8 | S282 R286 A287 M288 Y424 W488 | S282-P284 WeakPolarHBondContact O-CD 3.36Å; P284-R286 VanDerWaalsContact C-N 3.27Å; P284-R286 PolarHBondContact O-N 3.16Å; P284-R286 VanDerWaalsContact O-N 3.14Å; P284-A287 HydrophobicContact CB-CB 4.31Å; P284-A287 PolarHBondContact O-N 3.45Å; P284-M288 HydrophobicContact CG-CG 4.34Å; P284-M288 HydrophobicContact CG-SD 4.44Å; P284-M288 WeakPolarHBondContact O-CG 3.19Å; P284-M288 PolarHBondContact O-N 3.37Å; P284-Y424 WeakPolarHBondContact CD-OH 3.41Å; P284-Y424 HydrophobicContact CG-CE2 4.05Å; P284-W488 HydrophobicContact CG-CB 4.47Å; P284-W488 HydrophobicContact CG-CE3 4.14Å | ||
| 285 | I | 89.4 | Confident | 76.9 | Confident | 90 Ų | 90 | 83.4 Ų | 83.4 | 46% | 0.462 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -51.8 | -43.8 | -171.4 | -62.2 | 171.6 | 0 | 0 | 0 | 111.8 | L283 A287 M288 I289 | L283-I285 HydrophobicContact CB-CD1 4.41Å; L283-I285 HydrophobicContact CB-CG1 3.93Å; L283-I285 PolarHBondContact O-N 3.48Å; I285-A287 VanDerWaalsContact C-N 3.29Å; I285-A287 PolarHBondContact O-N 3.08Å; I285-M288 PolarHBondContact O-N 3.22Å; I285-I289 HydrophobicContact CG2-CD1 3.69Å; I285-I289 HydrophobicContact CG2-CG1 4.3Å; I285-I289 WeakPolarHBondContact O-CG1 3.29Å; I285-I289 PolarHBondContact O-N 3.43Å |
| 286 | R | 89.1 | Confident | 78.7 | Confident | 194 Ų | 194 | 79.5 Ų | 79.5 | 73% | 0.732 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -62.7 | -35.3 | -179.8 | -169.3 | 179.3 | -174 | -166.9 | 1.6 | 112.7 | P284 K290 | P284-R286 VanDerWaalsContact C-N 3.27Å; P284-R286 PolarHBondContact O-N 3.16Å; P284-R286 VanDerWaalsContact O-N 3.14Å; R286-K290 WeakPolarHBondContact O-CG 3.34Å |
| 287 | A | 88.9 | Confident | 81.1 | Confident | 41 Ų | 41 | 72.5 Ų | 72.5 | 34% | 0.339 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -77.4 | -38 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.2 | P284 I285 K290 S291 W488 | P284-A287 HydrophobicContact CB-CB 4.31Å; P284-A287 PolarHBondContact O-N 3.45Å; I285-A287 VanDerWaalsContact C-N 3.29Å; I285-A287 PolarHBondContact O-N 3.08Å; A287-K290 PolarHBondContact O-N 2.9Å; A287-S291 PolarHBondContact O-N 3.38Å; A287-W488 HydrophobicContact CB-CB 3.63Å; A287-W488 HydrophobicContact CB-CG 4.18Å |
| 288 | M | 92.4 | Very high | 83.6 | Confident | 6 Ų | 6 | 67.8 Ų | 67.8 | 3% | 0.03 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -59.8 | -48.2 | 175 | -63.9 | 177 | 77.8 | 0 | 0 | 111.5 | P284 I285 K290 S291 L294 F427 L428 W488 | P284-M288 HydrophobicContact CG-CG 4.34Å; P284-M288 HydrophobicContact CG-SD 4.44Å; P284-M288 WeakPolarHBondContact O-CG 3.19Å; P284-M288 PolarHBondContact O-N 3.37Å; I285-M288 PolarHBondContact O-N 3.22Å; M288-K290 PolarHBondContact O-N 3.43Å; M288-K290 VanDerWaalsContact O-N 3.16Å; M288-S291 VanDerWaalsContact O-CB 3.29Å; M288-S291 WeakPolarHBondContact O-CB 3.3Å; M288-S291 PolarHBondContact O-N 2.93Å; M288-L294 HydrophobicContact CB-CD2 3.89Å; M288-L294 HydrophobicContact CE-CD2 4.25Å; M288-F427 HydrophobicContact CE-CD1 3.72Å; M288-F427 HydrophobicContact CE-CE1 3.72Å; M288-F427 HydrophobicContact SD-CD1 4.41Å; M288-F427 HydrophobicContact SD-CE1 4.18Å; M288-L428 HydrophobicContact CE-CD2 3.36Å; M288-L428 HydrophobicContact CE-CG 4.04Å; M288-W488 HydrophobicContact CE-CH2 3.93Å; M288-W488 HydrophobicContact CE-CZ3 3.81Å; M288-W488 HydrophobicContact CG-CD2 4.01Å; M288-W488 HydrophobicContact CG-CE3 3.63Å; M288-W488 HydrophobicContact CG-CH2 4.01Å; M288-W488 HydrophobicContact CG-CZ2 4.37Å; M288-W488 HydrophobicContact CG-CZ3 3.62Å; M288-W488 HydrophobicContact SD-CE3 4.44Å; M288-W488 HydrophobicContact SD-CZ3 4.07Å |
| 289 | I | 93 | Very high | 86.1 | Confident | 102 Ų | 102 | 66.8 Ų | 66.8 | 52% | 0.523 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -60 | -28 | 178.1 | -68.4 | 169.2 | 0 | 0 | 0 | 112 | I285 W295 | I285-I289 HydrophobicContact CG2-CD1 3.69Å; I285-I289 HydrophobicContact CG2-CG1 4.3Å; I285-I289 WeakPolarHBondContact O-CG1 3.29Å; I285-I289 PolarHBondContact O-N 3.43Å; I289-W295 PolarHBondContact O-NE1 2.82Å |
| 290 | K | 93.2 | Very high | 88.8 | Confident | 148 Ų | 148 | 60.2 Ų | 60.2 | 64% | 0.643 | 32% | 0.315 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.9 | -5.7 | 177.4 | -69.4 | -178.9 | 176.6 | -170.1 | 0 | 113.8 | R286 A287 M288 L292 | R286-K290 WeakPolarHBondContact O-CG 3.34Å; A287-K290 PolarHBondContact O-N 2.9Å; M288-K290 PolarHBondContact O-N 3.43Å; M288-K290 VanDerWaalsContact O-N 3.16Å; K290-L292 PolarHBondContact O-N 3.47Å |
| 291 | S | 95.4 | Very high | 91 | Very high | 9 Ų | 9 | 56.8 Ų | 56.8 | 6% | 0.063 | 28% | 0.279 | C | S | . | . | trans | -83.4 | 107.5 | -174.4 | -172.8 | 0 | 0 | 0 | 0 | 111.4 | A287 M288 L294 W295 W488 | A287-S291 PolarHBondContact O-N 3.38Å; M288-S291 VanDerWaalsContact O-CB 3.29Å; M288-S291 WeakPolarHBondContact O-CB 3.3Å; M288-S291 PolarHBondContact O-N 2.93Å; S291-L294 WeakPolarHBondContact O-CB 3.26Å; S291-L294 PolarHBondContact O-N 3.36Å; S291-W295 PolarHBondContact O-N 2.95Å; S291-W488 VanDerWaalsContact CB-NE1 3.33Å; S291-W488 PolarHBondContact OG-NE1 3.06Å; S291-W488 VanDerWaalsContact OG-NE1 3.11Å | ||
| 292 | L | 96 | Very high | 92.6 | Very high | 91 Ų | 91 | 52.9 Ų | 52.9 | 48% | 0.476 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -58.6 | -40.8 | 176.3 | -68.2 | 171.2 | 0 | 0 | 0 | 113.5 | K290 L294 W295 A296 F480 | K290-L292 PolarHBondContact O-N 3.47Å; L292-L294 VanDerWaalsContact C-N 3.27Å; L292-L294 PolarHBondContact O-N 3.37Å; L292-W295 PolarHBondContact O-N 3.21Å; L292-A296 WeakPolarHBondContact O-CB 3.46Å; L292-A296 PolarHBondContact O-N 3.47Å; L292-F480 HydrophobicContact CB-CB 4.41Å; L292-F480 HydrophobicContact CB-CD1 4.2Å; L292-F480 HydrophobicContact CD1-CD1 3.96Å; L292-F480 HydrophobicContact CD1-CE1 4.05Å |
| 293 | P | 95.8 | Very high | 93.7 | Very high | 13 Ų | 13 | 48.3 Ų | 48.3 | 8% | 0.084 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -62.1 | -33 | 175.8 | -27.3 | 38.5 | 0 | 0 | 0 | 113.5 | A296 I297 R482 | P293-A296 WeakPolarHBondContact O-CB 3.25Å; P293-A296 PolarHBondContact O-N 3.44Å; P293-I297 WeakPolarHBondContact O-CG1 3.37Å; P293-I297 PolarHBondContact O-N 3.07Å; P293-R482 HydrophobicContact CB-CB 3.99Å; P293-R482 HydrophobicContact CB-CG 4.12Å; P293-R482 HydrophobicContact CG-CB 3.99Å; P293-R482 HydrophobicContact CG-CG 3.6Å |
| 294 | L | 95.7 | Very high | 94.3 | Very high | 5 Ų | 5 | 45.1 Ų | 45.1 | 3% | 0.026 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -66.8 | -47.8 | 174.3 | 176.7 | 58.3 | 0 | 0 | 0 | 111 | M288 S291 L292 A296 I297 L298 I420 L428 | M288-L294 HydrophobicContact CB-CD2 3.89Å; M288-L294 HydrophobicContact CE-CD2 4.25Å; S291-L294 WeakPolarHBondContact O-CB 3.26Å; S291-L294 PolarHBondContact O-N 3.36Å; L292-L294 VanDerWaalsContact C-N 3.27Å; L292-L294 PolarHBondContact O-N 3.37Å; L294-A296 PolarHBondContact O-N 3.31Å; L294-I297 PolarHBondContact O-N 3.28Å; L294-I297 VanDerWaalsContact O-N 3.14Å; L294-L298 HydrophobicContact CD1-CD1 4.28Å; L294-L298 HydrophobicContact CD1-CG 4.2Å; L294-L298 HydrophobicContact CG-CD1 3.99Å; L294-L298 HydrophobicContact CG-CG 4.38Å; L294-L298 WeakPolarHBondContact O-CG 3.47Å; L294-L298 PolarHBondContact O-N 2.9Å; L294-I420 HydrophobicContact CB-CD1 4.34Å; L294-I420 HydrophobicContact CD1-CD1 4.17Å; L294-L428 HydrophobicContact CD1-CD2 3.47Å; L294-L428 VanDerWaalsContact CD1-CD2 3.47Å; L294-L428 HydrophobicContact CD2-CD2 4.08Å; L294-L428 HydrophobicContact CG-CD2 4.45Å |
| 295 | W | 97.1 | Very high | 94.7 | Very high | 95 Ų | 95 | 45.5 Ų | 45.5 | 36% | 0.36 | 21% | 0.214 | S | C | . | . | H | α-helix | trans | -59.6 | -35.6 | 174.6 | -77.7 | 107.5 | 0 | 0 | 0 | 112.7 | I289 S291 L292 I297 L298 I299 F435 F476 | I289-W295 PolarHBondContact O-NE1 2.82Å; S291-W295 PolarHBondContact O-N 2.95Å; L292-W295 PolarHBondContact O-N 3.21Å; W295-I297 VanDerWaalsContact C-N 3.31Å; W295-I297 PolarHBondContact O-N 2.92Å; W295-L298 HydrophobicContact CD2-CD1 4.43Å; W295-L298 HydrophobicContact CE3-CD1 4.14Å; W295-L298 HydrophobicContact CZ3-CD1 4.42Å; W295-L298 PolarHBondContact O-N 2.9Å; W295-I299 WeakPolarHBondContact O-CB 3.11Å; W295-I299 WeakPolarHBondContact O-CG1 3.32Å; W295-I299 PolarHBondContact O-N 3.44Å; W295-F435 HydrophobicContact CH2-CZ 4.48Å; W295-F435 HydrophobicContact CZ3-CE1 4.29Å; W295-F435 AromaticContact CZ3-CZ 3.86Å; W295-F435 HydrophobicContact CZ3-CZ 3.86Å; W295-F476 HydrophobicContact CB-CE1 4.26Å |
| 296 | A | 97.3 | Very high | 95 | Very high | 0 Ų | 0 | 42.1 Ų | 42.1 | 0% | 0 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -58.9 | -44.4 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | L292 P293 L294 S300 F476 Y477 F480 | L292-A296 WeakPolarHBondContact O-CB 3.46Å; L292-A296 PolarHBondContact O-N 3.47Å; P293-A296 WeakPolarHBondContact O-CB 3.25Å; P293-A296 PolarHBondContact O-N 3.44Å; L294-A296 PolarHBondContact O-N 3.31Å; A296-S300 WeakPolarHBondContact O-CB 3.38Å; A296-S300 PolarHBondContact O-N 3.39Å; A296-S300 VanDerWaalsContact O-N 3.08Å; A296-F476 HydrophobicContact CB-CD1 4.23Å; A296-F476 HydrophobicContact CB-CE1 4.15Å; A296-Y477 HydrophobicContact CB-CD2 4.16Å; A296-F480 HydrophobicContact CB-CB 3.95Å |
| 297 | I | 96.4 | Very high | 95.2 | Very high | 0 Ų | 0 | 33 Ų | 33 | 0% | 0 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -69.7 | -45.7 | 177 | -61.4 | 164 | 0 | 0 | 0 | 110.5 | P293 L294 W295 I299 S300 Y301 N416 F417 I420 L432 Y477 | P293-I297 WeakPolarHBondContact O-CG1 3.37Å; P293-I297 PolarHBondContact O-N 3.07Å; L294-I297 PolarHBondContact O-N 3.28Å; L294-I297 VanDerWaalsContact O-N 3.14Å; W295-I297 VanDerWaalsContact C-N 3.31Å; W295-I297 PolarHBondContact O-N 2.92Å; I297-I299 PolarHBondContact O-N 3.2Å; I297-S300 PolarHBondContact O-N 2.86Å; I297-Y301 WeakPolarHBondContact O-CB 3.48Å; I297-Y301 PolarHBondContact O-N 3.31Å; I297-N416 HydrophobicContact CD1-CB 3.98Å; I297-N416 HydrophobicContact CG1-CB 4.18Å; I297-F417 HydrophobicContact CG2-CB 4.46Å; I297-I420 HydrophobicContact CD1-CD1 3.55Å; I297-I420 HydrophobicContact CD1-CG1 3.77Å; I297-I420 HydrophobicContact CD1-CG2 4.09Å; I297-L432 HydrophobicContact CG2-CD1 4.5Å; I297-L432 HydrophobicContact CG2-CD2 3.76Å; I297-Y477 HydrophobicContact CG1-CE2 4.04Å |
| 298 | L | 96.8 | Very high | 95.4 | Very high | 4 Ų | 4 | 35.3 Ų | 35.3 | 2% | 0.021 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -59.6 | -45.2 | -179.6 | -68.8 | 170.9 | 0 | 0 | 0 | 112.5 | L294 W295 Y301 F302 L431 L432 F435 | L294-L298 HydrophobicContact CD1-CD1 4.28Å; L294-L298 HydrophobicContact CD1-CG 4.2Å; L294-L298 HydrophobicContact CG-CD1 3.99Å; L294-L298 HydrophobicContact CG-CG 4.38Å; L294-L298 WeakPolarHBondContact O-CG 3.47Å; L294-L298 PolarHBondContact O-N 2.9Å; W295-L298 HydrophobicContact CD2-CD1 4.43Å; W295-L298 HydrophobicContact CE3-CD1 4.14Å; W295-L298 HydrophobicContact CZ3-CD1 4.42Å; W295-L298 PolarHBondContact O-N 2.9Å; L298-Y301 WeakPolarHBondContact O-CB 3.45Å; L298-Y301 PolarHBondContact O-N 3.09Å; L298-F302 PolarHBondContact O-N 2.85Å; L298-L431 HydrophobicContact CD1-CD2 3.94Å; L298-L431 HydrophobicContact CD1-CG 4.48Å; L298-L431 HydrophobicContact CD2-CB 4.49Å; L298-L431 HydrophobicContact CD2-CD2 3.91Å; L298-L431 HydrophobicContact CD2-CG 3.74Å; L298-L432 HydrophobicContact CD2-CD2 3.7Å; L298-L432 HydrophobicContact CD2-CG 4.18Å; L298-L432 HydrophobicContact CG-CD2 4.47Å; L298-F435 HydrophobicContact CB-CD1 4.4Å; L298-F435 HydrophobicContact CB-CE1 4.35Å; L298-F435 HydrophobicContact CB-CE2 4.47Å; L298-F435 HydrophobicContact CB-CG 4.48Å; L298-F435 HydrophobicContact CB-CZ 4.38Å; L298-F435 HydrophobicContact CD1-CE2 4.19Å; L298-F435 HydrophobicContact CD1-CZ 4.34Å; L298-F435 HydrophobicContact CD2-CD2 3.87Å; L298-F435 HydrophobicContact CD2-CE2 4.04Å; L298-F435 HydrophobicContact CD2-CG 4.42Å; L298-F435 HydrophobicContact CG-CE2 4.48Å |
| 299 | I | 97.4 | Very high | 95.5 | Very high | 51 Ų | 51 | 35.6 Ų | 35.6 | 26% | 0.262 | 16% | 0.164 | S | C | . | . | H | α-helix | trans | -67.8 | -43.4 | 178 | -68.9 | 166.9 | 0 | 0 | 0 | 110.4 | W295 I297 Y301 F302 C303 F476 | W295-I299 WeakPolarHBondContact O-CB 3.11Å; W295-I299 WeakPolarHBondContact O-CG1 3.32Å; W295-I299 PolarHBondContact O-N 3.44Å; I297-I299 PolarHBondContact O-N 3.2Å; I299-Y301 VanDerWaalsContact C-N 3.27Å; I299-Y301 PolarHBondContact O-N 2.72Å; I299-F302 PolarHBondContact O-N 3.5Å; I299-C303 WeakPolarHBondContact O-CB 3.46Å; I299-C303 PolarHBondContact O-N 3.33Å; I299-C303 PolarHBondContact O-SG 3.49Å; I299-F476 HydrophobicContact CB-CD1 4.26Å; I299-F476 HydrophobicContact CD1-CD1 3.75Å; I299-F476 HydrophobicContact CD1-CE1 3.54Å; I299-F476 HydrophobicContact CD1-CG 4.4Å; I299-F476 HydrophobicContact CD1-CZ 4.02Å; I299-F476 HydrophobicContact CG2-CD1 4.42Å |
| 300 | S | 96 | Very high | 95.5 | Very high | 1 Ų | 1 | 31 Ų | 31 | 1% | 0.007 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -58 | -42.6 | 174.5 | -157.9 | 0 | 0 | 0 | 0 | 111.2 | A296 I297 C303 E304 A413 | A296-S300 WeakPolarHBondContact O-CB 3.38Å; A296-S300 PolarHBondContact O-N 3.39Å; A296-S300 VanDerWaalsContact O-N 3.08Å; I297-S300 PolarHBondContact O-N 2.86Å; S300-C303 PolarHBondContact O-N 2.84Å; S300-E304 WeakPolarHBondContact O-CB 3.18Å; S300-E304 WeakPolarHBondContact O-CG 3.47Å; S300-E304 PolarHBondContact O-N 3.34Å; S300-E304 PolarHBondContact OG-OE1 3.04Å; S300-A413 WeakPolarHBondContact OG-CB 3.41Å |
| 301 | Y | 94.8 | Very high | 95.4 | Very high | 2 Ų | 2 | 25 Ų | 25 | 1% | 0.008 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -60.9 | -47.9 | 177 | -143.6 | -89.9 | 0 | 0 | 0 | 111.2 | I297 L298 I299 C303 Y305 L414 K429 L432 A436 | I297-Y301 WeakPolarHBondContact O-CB 3.48Å; I297-Y301 PolarHBondContact O-N 3.31Å; L298-Y301 WeakPolarHBondContact O-CB 3.45Å; L298-Y301 PolarHBondContact O-N 3.09Å; I299-Y301 VanDerWaalsContact C-N 3.27Å; I299-Y301 PolarHBondContact O-N 2.72Å; Y301-C303 PolarHBondContact O-N 2.83Å; Y301-Y305 AromaticContact CD1-CD2 3.49Å; Y301-Y305 HydrophobicContact CD1-CD2 3.49Å; Y301-Y305 VanDerWaalsContact CD1-CD2 3.49Å; Y301-Y305 AromaticContact CD1-CE2 3.52Å; Y301-Y305 HydrophobicContact CD1-CE2 3.52Å; Y301-Y305 HydrophobicContact CD1-CG 4.45Å; Y301-Y305 HydrophobicContact CD2-CE2 4.38Å; Y301-Y305 AromaticContact CE1-CD2 3.49Å; Y301-Y305 HydrophobicContact CE1-CD2 3.49Å; Y301-Y305 VanDerWaalsContact CE1-CD2 3.49Å; Y301-Y305 AromaticContact CE1-CE2 3.02Å; Y301-Y305 HydrophobicContact CE1-CE2 3.02Å; Y301-Y305 HydrophobicContact CE1-CG 4.42Å; Y301-Y305 AromaticContact CE1-CZ 3.65Å; Y301-Y305 HydrophobicContact CE2-CE2 4Å; Y301-Y305 HydrophobicContact CG-CD2 4.15Å; Y301-Y305 HydrophobicContact CG-CE2 4.16Å; Y301-Y305 AromaticContact CZ-CE2 3.27Å; Y301-Y305 AromaticContact CZ-CZ 3.8Å; Y301-Y305 WeakPolarHBondContact O-CB 3.39Å; Y301-Y305 VanDerWaalsContact O-CD2 3.28Å; Y301-Y305 WeakPolarHBondContact O-CD2 3.15Å; Y301-Y305 PolarHBondContact O-N 3.39Å; Y301-Y305 PolarHBondContact OH-OH 2.99Å; Y301-L414 HydrophobicContact CD2-CD2 3.2Å; Y301-L414 HydrophobicContact CD2-CG 4.46Å; Y301-L414 HydrophobicContact CE2-CB 4.18Å; Y301-L414 HydrophobicContact CE2-CD2 3.42Å; Y301-L414 VanDerWaalsContact CE2-CD2 3.42Å; Y301-L414 HydrophobicContact CE2-CG 4.37Å; Y301-L414 HydrophobicContact CG-CD2 3.89Å; Y301-K429 PolarHBondContact OH-NZ 2.95Å; Y301-L432 HydrophobicContact CD1-CB 4Å; Y301-L432 HydrophobicContact CD1-CD2 4.38Å; Y301-L432 VanDerWaalsContact CD1-O 3.23Å; Y301-L432 WeakPolarHBondContact CD1-O 3.09Å; Y301-L432 HydrophobicContact CD2-CB 4.04Å; Y301-L432 HydrophobicContact CD2-CD1 4.26Å; Y301-L432 HydrophobicContact CD2-CD2 3.53Å; Y301-L432 HydrophobicContact CD2-CG 4.15Å; Y301-L432 HydrophobicContact CE1-CB 3.96Å; Y301-L432 WeakPolarHBondContact CE1-O 3.22Å; Y301-L432 HydrophobicContact CE2-CB 4Å; Y301-L432 HydrophobicContact CE2-CD1 4.2Å; Y301-L432 HydrophobicContact CE2-CD2 4.23Å; Y301-L432 HydrophobicContact CE2-CG 4.37Å; Y301-L432 HydrophobicContact CG-CB 4.06Å; Y301-L432 HydrophobicContact CG-CD2 3.64Å; Y301-L432 HydrophobicContact CG-CG 4.4Å; Y301-A436 HydrophobicContact CD1-CB 3.8Å; Y301-A436 HydrophobicContact CE1-CB 3.65Å |
| 302 | F | 97.4 | Very high | 95.1 | Very high | 44 Ų | 44 | 25.4 Ų | 25.4 | 19% | 0.193 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -57.7 | -48.2 | 175.5 | 172.4 | -91.9 | 0 | 0 | 0 | 112.1 | L298 I299 W306 F435 I438 A439 I442 V469 | L298-F302 PolarHBondContact O-N 2.85Å; I299-F302 PolarHBondContact O-N 3.5Å; F302-W306 HydrophobicContact CE1-CE3 4.02Å; F302-W306 HydrophobicContact CE1-CZ3 4.49Å; F302-W306 HydrophobicContact CE2-CE3 4.5Å; F302-W306 AromaticContact CZ-CE3 3.69Å; F302-W306 HydrophobicContact CZ-CE3 3.69Å; F302-W306 AromaticContact CZ-CZ3 3.94Å; F302-W306 HydrophobicContact CZ-CZ3 3.94Å; F302-W306 WeakPolarHBondContact O-CB 3.5Å; F302-W306 PolarHBondContact O-N 3.5Å; F302-F435 HydrophobicContact CB-CB 4.37Å; F302-F435 HydrophobicContact CB-CD1 4.2Å; F302-I438 HydrophobicContact CD2-CG2 4.43Å; F302-I438 HydrophobicContact CE2-CG2 3.99Å; F302-A439 HydrophobicContact CD2-CB 3.63Å; F302-A439 HydrophobicContact CE2-CB 3.79Å; F302-A439 HydrophobicContact CG-CB 4.24Å; F302-A439 VanDerWaalsContact O-CB 3.22Å; F302-A439 WeakPolarHBondContact O-CB 3.43Å; F302-I442 HydrophobicContact CE2-CD1 4.33Å; F302-I442 HydrophobicContact CZ-CD1 4.45Å; F302-V469 HydrophobicContact CE1-CG1 4.38Å |
| 303 | C | 96.9 | Very high | 94.9 | Very high | 6 Ų | 6 | 21.2 Ų | 21.2 | 4% | 0.041 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -65.3 | -43.4 | -177.3 | -70.2 | 0 | 0 | 0 | 0 | 112.7 | I299 S300 Y301 W306 V469 N470 G473 | I299-C303 WeakPolarHBondContact O-CB 3.46Å; I299-C303 PolarHBondContact O-N 3.33Å; I299-C303 PolarHBondContact O-SG 3.49Å; S300-C303 PolarHBondContact O-N 2.84Å; Y301-C303 PolarHBondContact O-N 2.83Å; C303-W306 VanDerWaalsContact O-CB 3.28Å; C303-W306 WeakPolarHBondContact O-CB 3.46Å; C303-W306 PolarHBondContact O-N 2.94Å; C303-V469 HydrophobicContact CB-CG1 4.07Å; C303-V469 PolarHBondContact SG-O 2.9Å; C303-N470 PolarHBondContact O-ND2 3.34Å; C303-N470 PolarHBondContact O-OD1 2.98Å; C303-G473 VanDerWaalsContact SG-CA 3.59Å |
| 304 | E | 94.5 | Very high | 94.7 | Very high | 11 Ų | 11 | 21 Ų | 21 | 5% | 0.051 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -69.3 | -43.1 | 179.3 | -71.3 | 176.7 | -163.8 | 0 | 0 | 111.4 | S300 W306 L307 F308 V375 C409 L414 | S300-E304 WeakPolarHBondContact O-CB 3.18Å; S300-E304 WeakPolarHBondContact O-CG 3.47Å; S300-E304 PolarHBondContact O-N 3.34Å; S300-E304 PolarHBondContact OG-OE1 3.04Å; E304-W306 VanDerWaalsContact C-N 3.26Å; E304-W306 PolarHBondContact O-N 3Å; E304-L307 PolarHBondContact O-N 2.87Å; E304-F308 PolarHBondContact O-N 3.43Å; E304-V375 HydrophobicContact CG-CG2 4.43Å; E304-C409 VanDerWaalsContact CD-CB 3.48Å; E304-C409 HydrophobicContact CG-CB 4.48Å; E304-C409 PolarHBondContact OE1-SG 2.88Å; E304-C409 WeakPolarHBondContact OE2-CB 3.29Å; E304-L414 VanDerWaalsContact OE2-CD1 3.28Å; E304-L414 WeakPolarHBondContact OE2-CD1 3.46Å; E304-L414 WeakPolarHBondContact OE2-CD2 3.45Å; E304-L414 WeakPolarHBondContact OE2-CG 3.26Å |
| 305 | Y | 95.2 | Very high | 94.4 | Very high | 43 Ų | 43 | 21 Ų | 21 | 17% | 0.169 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -68.6 | -25.2 | 176.5 | -84.5 | -92.7 | 0 | 0 | 0 | 112.8 | Y301 L307 F308 Y309 L414 A436 | Y301-Y305 AromaticContact CD1-CD2 3.49Å; Y301-Y305 HydrophobicContact CD1-CD2 3.49Å; Y301-Y305 VanDerWaalsContact CD1-CD2 3.49Å; Y301-Y305 AromaticContact CD1-CE2 3.52Å; Y301-Y305 HydrophobicContact CD1-CE2 3.52Å; Y301-Y305 HydrophobicContact CD1-CG 4.45Å; Y301-Y305 HydrophobicContact CD2-CE2 4.38Å; Y301-Y305 AromaticContact CE1-CD2 3.49Å; Y301-Y305 HydrophobicContact CE1-CD2 3.49Å; Y301-Y305 VanDerWaalsContact CE1-CD2 3.49Å; Y301-Y305 AromaticContact CE1-CE2 3.02Å; Y301-Y305 HydrophobicContact CE1-CE2 3.02Å; Y301-Y305 HydrophobicContact CE1-CG 4.42Å; Y301-Y305 AromaticContact CE1-CZ 3.65Å; Y301-Y305 HydrophobicContact CE2-CE2 4Å; Y301-Y305 HydrophobicContact CG-CD2 4.15Å; Y301-Y305 HydrophobicContact CG-CE2 4.16Å; Y301-Y305 AromaticContact CZ-CE2 3.27Å; Y301-Y305 AromaticContact CZ-CZ 3.8Å; Y301-Y305 WeakPolarHBondContact O-CB 3.39Å; Y301-Y305 VanDerWaalsContact O-CD2 3.28Å; Y301-Y305 WeakPolarHBondContact O-CD2 3.15Å; Y301-Y305 PolarHBondContact O-N 3.39Å; Y301-Y305 PolarHBondContact OH-OH 2.99Å; Y305-L307 VanDerWaalsContact C-N 3.33Å; Y305-L307 PolarHBondContact O-N 3.26Å; Y305-F308 HydrophobicContact CD1-CD1 4.14Å; Y305-F308 HydrophobicContact CE1-CD1 4.44Å; Y305-F308 PolarHBondContact O-N 2.87Å; Y305-Y309 HydrophobicContact CD1-CD2 4.25Å; Y305-Y309 AromaticContact CD1-CE2 3.77Å; Y305-Y309 HydrophobicContact CD1-CE2 3.77Å; Y305-Y309 WeakPolarHBondContact O-CB 3.2Å; Y305-Y309 WeakPolarHBondContact O-CD2 3.48Å; Y305-Y309 PolarHBondContact O-N 3.35Å; Y305-L414 HydrophobicContact CE2-CD1 4.47Å; Y305-L414 HydrophobicContact CE2-CD2 4.1Å; Y305-A436 HydrophobicContact CD1-CB 3.63Å; Y305-A436 HydrophobicContact CD2-CB 3.83Å; Y305-A436 HydrophobicContact CE1-CB 4.06Å; Y305-A436 HydrophobicContact CE2-CB 4.25Å; Y305-A436 HydrophobicContact CG-CB 3.48Å; Y305-A436 VanDerWaalsContact CG-CB 3.48Å |
| 306 | W | 96.4 | Very high | 94 | Very high | 18 Ų | 18 | 16.5 Ų | 16.5 | 7% | 0.068 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -55.2 | -50.8 | 170.1 | 179.9 | -72.4 | 0 | 0 | 0 | 110.9 | F302 C303 E304 T310 A439 I442 S443 A446 L465 V469 | F302-W306 HydrophobicContact CE1-CE3 4.02Å; F302-W306 HydrophobicContact CE1-CZ3 4.49Å; F302-W306 HydrophobicContact CE2-CE3 4.5Å; F302-W306 AromaticContact CZ-CE3 3.69Å; F302-W306 HydrophobicContact CZ-CE3 3.69Å; F302-W306 AromaticContact CZ-CZ3 3.94Å; F302-W306 HydrophobicContact CZ-CZ3 3.94Å; F302-W306 WeakPolarHBondContact O-CB 3.5Å; F302-W306 PolarHBondContact O-N 3.5Å; C303-W306 VanDerWaalsContact O-CB 3.28Å; C303-W306 WeakPolarHBondContact O-CB 3.46Å; C303-W306 PolarHBondContact O-N 2.94Å; E304-W306 VanDerWaalsContact C-N 3.26Å; E304-W306 PolarHBondContact O-N 3Å; W306-T310 WeakPolarHBondContact O-CB 3.37Å; W306-T310 PolarHBondContact O-N 3.41Å; W306-T310 PolarHBondContact O-OG1 3.26Å; W306-A439 HydrophobicContact CB-CB 4.3Å; W306-I442 HydrophobicContact CH2-CB 4.32Å; W306-I442 HydrophobicContact CH2-CG2 3.56Å; W306-I442 HydrophobicContact CZ3-CB 3.8Å; W306-I442 HydrophobicContact CZ3-CG2 3.44Å; W306-I442 VanDerWaalsContact CZ3-CG2 3.44Å; W306-S443 VanDerWaalsContact CD2-CB 3.44Å; W306-S443 PolarHBondContact O-OG 2.87Å; W306-A446 HydrophobicContact CH2-CB 4.05Å; W306-A446 HydrophobicContact CZ2-CB 4Å; W306-L465 HydrophobicContact CZ2-CD2 3.8Å; W306-L465 HydrophobicContact CZ2-CG 4.19Å; W306-V469 HydrophobicContact CB-CG1 4.22Å; W306-V469 HydrophobicContact CD2-CG1 4.29Å; W306-V469 HydrophobicContact CG-CG1 4.12Å |
| 307 | L | 93.1 | Very high | 93.6 | Very high | 4 Ų | 4 | 17.1 Ų | 17.1 | 2% | 0.021 | 8% | 0.08 | C | C | . | . | H | α-helix | trans | -68 | -45.4 | 179.6 | 175.6 | 62 | 0 | 0 | 0 | 111.4 | E304 Y305 Y309 T310 I311 L382 N470 | E304-L307 PolarHBondContact O-N 2.87Å; Y305-L307 VanDerWaalsContact C-N 3.33Å; Y305-L307 PolarHBondContact O-N 3.26Å; L307-Y309 VanDerWaalsContact C-N 3.35Å; L307-Y309 PolarHBondContact O-N 2.96Å; L307-T310 WeakPolarHBondContact O-CB 3.32Å; L307-T310 PolarHBondContact O-N 3.23Å; L307-T310 VanDerWaalsContact O-N 3.14Å; L307-I311 HydrophobicContact CD1-CD1 3.8Å; L307-I311 HydrophobicContact CD1-CG1 3.93Å; L307-I311 HydrophobicContact CG-CD1 3.94Å; L307-I311 HydrophobicContact CG-CG1 4.39Å; L307-I311 WeakPolarHBondContact O-CG1 3.29Å; L307-I311 PolarHBondContact O-N 2.97Å; L307-L382 HydrophobicContact CD1-CD1 3.36Å; L307-L382 HydrophobicContact CD2-CD1 3.78Å; L307-L382 HydrophobicContact CG-CD1 4.2Å; L307-N470 WeakPolarHBondContact CB-ND2 3.32Å |
| 308 | F | 92.6 | Very high | 93.2 | Very high | 89 Ų | 89 | 17.5 Ų | 17.5 | 39% | 0.39 | 8% | 0.082 | S | C | . | . | H | α-helix | trans | -53.8 | -51.2 | 177.5 | 177.4 | -97.7 | 0 | 0 | 0 | 111.5 | E304 Y305 T310 I311 M312 | E304-F308 PolarHBondContact O-N 3.43Å; Y305-F308 HydrophobicContact CD1-CD1 4.14Å; Y305-F308 HydrophobicContact CE1-CD1 4.44Å; Y305-F308 PolarHBondContact O-N 2.87Å; F308-T310 VanDerWaalsContact C-N 3.34Å; F308-T310 PolarHBondContact O-N 3.06Å; F308-I311 PolarHBondContact O-N 3.4Å; F308-M312 HydrophobicContact CE1-SD 4.12Å; F308-M312 WeakPolarHBondContact O-CB 3.43Å; F308-M312 PolarHBondContact O-N 3.4Å |
| 309 | Y | 93.9 | Very high | 92.8 | Very high | 12 Ų | 12 | 17.3 Ų | 17.3 | 5% | 0.047 | 8% | 0.081 | C | C | . | . | H | α-helix | trans | -67.7 | -32.4 | 178.9 | -80.3 | -66.4 | 0 | 0 | 0 | 113.1 | Y305 L307 M312 A313 A436 H437 G440 | Y305-Y309 HydrophobicContact CD1-CD2 4.25Å; Y305-Y309 AromaticContact CD1-CE2 3.77Å; Y305-Y309 HydrophobicContact CD1-CE2 3.77Å; Y305-Y309 WeakPolarHBondContact O-CB 3.2Å; Y305-Y309 WeakPolarHBondContact O-CD2 3.48Å; Y305-Y309 PolarHBondContact O-N 3.35Å; L307-Y309 VanDerWaalsContact C-N 3.35Å; L307-Y309 PolarHBondContact O-N 2.96Å; Y309-M312 HydrophobicContact CD1-CE 3.62Å; Y309-M312 HydrophobicContact CD1-SD 4.11Å; Y309-M312 HydrophobicContact CE1-CE 3.94Å; Y309-M312 HydrophobicContact CE1-SD 4.25Å; Y309-M312 PolarHBondContact O-N 3.45Å; Y309-A313 WeakPolarHBondContact O-CB 3.28Å; Y309-A313 PolarHBondContact O-N 3.28Å; Y309-A436 VanDerWaalsContact CE2-O 3.28Å; Y309-A436 WeakPolarHBondContact CE2-O 3.35Å; Y309-H437 PolarHBondContact OH-ND1 3.23Å; Y309-G440 VanDerWaalsContact CG-CA 3.42Å |
| 310 | T | 93.3 | Very high | 92.2 | Very high | 6 Ų | 6 | 16 Ų | 16 | 4% | 0.037 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -63.6 | -50.3 | 174.6 | -57.8 | 0 | 0 | 0 | 0 | 110.6 | W306 L307 F308 A313 Y314 S443 V462 | W306-T310 WeakPolarHBondContact O-CB 3.37Å; W306-T310 PolarHBondContact O-N 3.41Å; W306-T310 PolarHBondContact O-OG1 3.26Å; L307-T310 WeakPolarHBondContact O-CB 3.32Å; L307-T310 PolarHBondContact O-N 3.23Å; L307-T310 VanDerWaalsContact O-N 3.14Å; F308-T310 VanDerWaalsContact C-N 3.34Å; F308-T310 PolarHBondContact O-N 3.06Å; T310-A313 PolarHBondContact O-N 3.46Å; T310-Y314 WeakPolarHBondContact O-CB 3.44Å; T310-Y314 PolarHBondContact O-N 2.88Å; T310-S443 WeakPolarHBondContact OG1-CB 3.1Å; T310-S443 PolarHBondContact OG1-OG 2.87Å; T310-V462 HydrophobicContact CG2-CG1 3.83Å |
| 311 | I | 90.7 | Very high | 91.5 | Very high | 20 Ų | 20 | 18.5 Ų | 18.5 | 10% | 0.103 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -61.5 | -46.9 | 176.1 | -67.3 | 179.3 | 0 | 0 | 0 | 109.7 | L307 F308 A313 T315 F338 | L307-I311 HydrophobicContact CD1-CD1 3.8Å; L307-I311 HydrophobicContact CD1-CG1 3.93Å; L307-I311 HydrophobicContact CG-CD1 3.94Å; L307-I311 HydrophobicContact CG-CG1 4.39Å; L307-I311 WeakPolarHBondContact O-CG1 3.29Å; L307-I311 PolarHBondContact O-N 2.97Å; F308-I311 PolarHBondContact O-N 3.4Å; I311-A313 VanDerWaalsContact C-N 3.33Å; I311-A313 PolarHBondContact O-N 3.29Å; I311-T315 VanDerWaalsContact CG2-OG1 3.25Å; I311-T315 WeakPolarHBondContact CG2-OG1 3.39Å; I311-T315 WeakPolarHBondContact O-CB 3.36Å; I311-T315 PolarHBondContact O-N 3.33Å; I311-T315 PolarHBondContact O-OG1 3.32Å; I311-F338 HydrophobicContact CG2-CZ 4.14Å |
| 312 | M | 89.8 | Confident | 90.8 | Very high | 18 Ų | 18 | 19 Ų | 19 | 9% | 0.089 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -56.2 | -44.5 | 178.1 | -164.9 | -166.2 | 77.9 | 0 | 0 | 113.3 | Q54 M55 S58 F308 Y309 F338 | Q54-M312 HydrophobicContact CG-CE 4.38Å; M55-M312 HydrophobicContact CE-CG 3.43Å; M55-M312 VanDerWaalsContact CE-CG 3.43Å; M55-M312 HydrophobicContact CE-SD 4.41Å; M55-M312 HydrophobicContact CG-CG 4.33Å; S58-M312 WeakPolarHBondContact CB-O 3.07Å; S58-M312 PolarHBondContact OG-O 3.43Å; F308-M312 HydrophobicContact CE1-SD 4.12Å; F308-M312 WeakPolarHBondContact O-CB 3.43Å; F308-M312 PolarHBondContact O-N 3.4Å; Y309-M312 HydrophobicContact CD1-CE 3.62Å; Y309-M312 HydrophobicContact CD1-SD 4.11Å; Y309-M312 HydrophobicContact CE1-CE 3.94Å; Y309-M312 HydrophobicContact CE1-SD 4.25Å; Y309-M312 PolarHBondContact O-N 3.45Å; M312-F338 HydrophobicContact CB-CE1 4.39Å; M312-F338 HydrophobicContact CB-CZ 4.46Å; M312-F338 HydrophobicContact CG-CE1 4.43Å |
| 313 | A | 91.9 | Very high | 89.8 | Confident | 3 Ų | 3 | 17.1 Ų | 17.1 | 3% | 0.025 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -79.1 | -38.7 | -174.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | S58 L114 Y309 T310 I311 P444 | S58-A313 WeakPolarHBondContact CB-O 3.23Å; L114-A313 HydrophobicContact CB-CB 4.31Å; L114-A313 HydrophobicContact CD1-CB 4.17Å; L114-A313 HydrophobicContact CD2-CB 4.24Å; L114-A313 HydrophobicContact CG-CB 4.47Å; Y309-A313 WeakPolarHBondContact O-CB 3.28Å; Y309-A313 PolarHBondContact O-N 3.28Å; T310-A313 PolarHBondContact O-N 3.46Å; I311-A313 VanDerWaalsContact C-N 3.33Å; I311-A313 PolarHBondContact O-N 3.29Å; A313-P444 HydrophobicContact CB-CB 4.18Å; A313-P444 HydrophobicContact CB-CG 4.16Å |
| 314 | Y | 91 | Very high | 89 | Confident | 8 Ų | 8 | 24.8 Ų | 24.8 | 3% | 0.031 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -109.9 | -7.5 | -168.6 | -75.9 | -80.1 | 0 | 0 | 0 | 115.4 | G111 L114 T310 T317 Y318 P444 A447 G448 I451 W459 | G111-Y314 WeakPolarHBondContact CA-OH 3.32Å; L114-Y314 HydrophobicContact CD1-CE1 4.2Å; L114-Y314 HydrophobicContact CD1-CE2 4.23Å; T310-Y314 WeakPolarHBondContact O-CB 3.44Å; T310-Y314 PolarHBondContact O-N 2.88Å; Y314-T317 HydrophobicContact CD1-CG2 4.46Å; Y314-T317 PolarHBondContact O-N 2.89Å; Y314-Y318 VanDerWaalsContact O-CB 3.26Å; Y314-Y318 WeakPolarHBondContact O-CB 3.46Å; Y314-Y318 PolarHBondContact O-N 3.4Å; Y314-P444 HydrophobicContact CE2-CB 3.94Å; Y314-P444 PolarHBondContact OH-O 3.4Å; Y314-A447 HydrophobicContact CD2-CB 3.98Å; Y314-A447 HydrophobicContact CE2-CB 3.5Å; Y314-A447 VanDerWaalsContact CE2-CB 3.5Å; Y314-G448 VanDerWaalsContact OH-CA 3.31Å; Y314-G448 WeakPolarHBondContact OH-CA 3.46Å; Y314-G448 PolarHBondContact OH-N 3.44Å; Y314-G448 VanDerWaalsContact OH-N 3.13Å; Y314-I451 HydrophobicContact CD1-CD1 3.99Å; Y314-I451 HydrophobicContact CE1-CD1 3.76Å; Y314-W459 AromaticContact CD1-CH2 3.76Å; Y314-W459 HydrophobicContact CD1-CH2 3.76Å; Y314-W459 HydrophobicContact CD1-CZ3 4.23Å; Y314-W459 HydrophobicContact CG-CH2 4.2Å; Y314-W459 HydrophobicContact CG-CZ3 4.29Å |
| 315 | T | 90.4 | Very high | 88.3 | Confident | 5 Ų | 5 | 25.2 Ų | 25.2 | 3% | 0.031 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -55.7 | -49.5 | 179.3 | -66.1 | 0 | 0 | 0 | 0 | 112.6 | I311 T317 Y318 I319 | I311-T315 VanDerWaalsContact CG2-OG1 3.25Å; I311-T315 WeakPolarHBondContact CG2-OG1 3.39Å; I311-T315 WeakPolarHBondContact O-CB 3.36Å; I311-T315 PolarHBondContact O-N 3.33Å; I311-T315 PolarHBondContact O-OG1 3.32Å; T315-T317 PolarHBondContact O-N 3.26Å; T315-Y318 PolarHBondContact O-N 3.15Å; T315-I319 HydrophobicContact CG2-CD1 3.6Å; T315-I319 HydrophobicContact CG2-CG1 4.36Å; T315-I319 WeakPolarHBondContact O-CG1 3.39Å; T315-I319 PolarHBondContact O-N 2.9Å |
| 316 | P | 88 | Confident | 87.7 | Confident | 1 Ų | 1 | 28 Ų | 28 | 1% | 0.006 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -63 | -41.9 | 178.1 | -20.4 | 33 | 0 | 0 | 0 | 112.6 | S58 I59 L216 I319 S320 S334 | S58-P316 WeakPolarHBondContact O-CB 3.46Å; I59-P316 HydrophobicContact CD1-CB 3.86Å; I59-P316 HydrophobicContact CD1-CG 4.36Å; L216-P316 HydrophobicContact CD2-CG 4.11Å; P316-I319 PolarHBondContact O-N 3.14Å; P316-S320 WeakPolarHBondContact O-CB 3.11Å; P316-S320 PolarHBondContact O-N 3.14Å; P316-S334 VanDerWaalsContact CA-OG 3.31Å; P316-S334 WeakPolarHBondContact CA-OG 3.3Å |
| 317 | T | 89.5 | Confident | 86.9 | Confident | 14 Ų | 14 | 28.8 Ų | 28.8 | 9% | 0.086 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -63.5 | -41.9 | 177.3 | -52.6 | 0 | 0 | 0 | 0 | 112 | Y314 T315 S320 S321 W459 | Y314-T317 HydrophobicContact CD1-CG2 4.46Å; Y314-T317 PolarHBondContact O-N 2.89Å; T315-T317 PolarHBondContact O-N 3.26Å; T317-S320 PolarHBondContact O-N 2.89Å; T317-S321 WeakPolarHBondContact O-CB 3.37Å; T317-S321 PolarHBondContact O-N 3.07Å; T317-S321 PolarHBondContact O-OG 3.32Å; T317-W459 HydrophobicContact CG2-CZ2 4.39Å |
| 318 | Y | 88.6 | Confident | 86.5 | Confident | 7 Ų | 7 | 34.8 Ų | 34.8 | 3% | 0.027 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -63.4 | -47.7 | 176.4 | -175.7 | -99.6 | 0 | 0 | 0 | 110.2 | Y314 T315 S320 S321 V322 T395 L399 W459 F463 | Y314-Y318 VanDerWaalsContact O-CB 3.26Å; Y314-Y318 WeakPolarHBondContact O-CB 3.46Å; Y314-Y318 PolarHBondContact O-N 3.4Å; T315-Y318 PolarHBondContact O-N 3.15Å; Y318-S320 VanDerWaalsContact C-N 3.34Å; Y318-S320 PolarHBondContact O-N 3.3Å; Y318-S321 PolarHBondContact O-N 2.96Å; Y318-V322 HydrophobicContact CD2-CB 4.06Å; Y318-V322 HydrophobicContact CD2-CG1 4.48Å; Y318-V322 HydrophobicContact CD2-CG2 3.66Å; Y318-V322 HydrophobicContact CE1-CB 4.45Å; Y318-V322 HydrophobicContact CE1-CG1 4.16Å; Y318-V322 HydrophobicContact CE2-CB 3.95Å; Y318-V322 HydrophobicContact CE2-CG1 3.89Å; Y318-V322 HydrophobicContact CE2-CG2 3.65Å; Y318-V322 HydrophobicContact CG-CB 4.38Å; Y318-V322 HydrophobicContact CG-CG2 4.38Å; Y318-V322 WeakPolarHBondContact O-CA 3.15Å; Y318-V322 WeakPolarHBondContact O-CB 3.22Å; Y318-V322 PolarHBondContact O-N 3.41Å; Y318-T395 HydrophobicContact CE1-CG2 3.76Å; Y318-L399 HydrophobicContact CD1-CD1 4.05Å; Y318-L399 HydrophobicContact CE1-CD1 4.14Å; Y318-W459 AromaticContact CD2-CD2 3.62Å; Y318-W459 HydrophobicContact CD2-CD2 3.62Å; Y318-W459 AromaticContact CD2-CE2 3.93Å; Y318-W459 AromaticContact CD2-CE3 3.51Å; Y318-W459 HydrophobicContact CD2-CE3 3.51Å; Y318-W459 HydrophobicContact CD2-CG 4.24Å; Y318-W459 AromaticContact CD2-CH2 3.98Å; Y318-W459 HydrophobicContact CD2-CH2 3.98Å; Y318-W459 HydrophobicContact CD2-CZ2 4.11Å; Y318-W459 AromaticContact CD2-CZ3 3.7Å; Y318-W459 HydrophobicContact CD2-CZ3 3.7Å; Y318-W459 HydrophobicContact CE2-CB 4.42Å; Y318-W459 HydrophobicContact CE2-CD2 4.05Å; Y318-W459 HydrophobicContact CE2-CE3 4.11Å; Y318-W459 HydrophobicContact CE2-CG 4.21Å; Y318-W459 HydrophobicContact CG-CH2 4.41Å; Y318-W459 HydrophobicContact CG-CZ3 4.32Å; Y318-F463 HydrophobicContact CD2-CZ 4.1Å; Y318-F463 AromaticContact CE2-CE2 3.75Å; Y318-F463 HydrophobicContact CE2-CE2 3.75Å; Y318-F463 AromaticContact CE2-CZ 3.71Å; Y318-F463 HydrophobicContact CE2-CZ 3.71Å |
| 319 | I | 87.1 | Confident | 86.1 | Confident | 0 Ų | 0 | 33.8 Ų | 33.8 | 0% | 0 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -64.1 | -41.3 | 179.8 | -61.9 | 168.8 | 0 | 0 | 0 | 111.3 | T315 P316 L323 Q324 A325 L333 S334 M396 | T315-I319 HydrophobicContact CG2-CD1 3.6Å; T315-I319 HydrophobicContact CG2-CG1 4.36Å; T315-I319 WeakPolarHBondContact O-CG1 3.39Å; T315-I319 PolarHBondContact O-N 2.9Å; P316-I319 PolarHBondContact O-N 3.14Å; I319-L323 HydrophobicContact CB-CD1 4.45Å; I319-L323 HydrophobicContact CG1-CD1 4.25Å; I319-L323 HydrophobicContact CG2-CD1 4.24Å; I319-L323 CarbonylContact O-C 3.48Å; I319-L323 VanDerWaalsContact O-CB 3.24Å; I319-L323 WeakPolarHBondContact O-CB 3.15Å; I319-L323 PolarHBondContact O-N 2.94Å; I319-Q324 PolarHBondContact O-N 3.01Å; I319-A325 HydrophobicContact CG2-CB 3.9Å; I319-A325 PolarHBondContact O-N 2.98Å; I319-L333 HydrophobicContact CD1-CB 4.14Å; I319-L333 HydrophobicContact CG2-CB 4.47Å; I319-L333 HydrophobicContact CG2-CD1 4.36Å; I319-S334 WeakPolarHBondContact CD1-OG 3.42Å; I319-M396 HydrophobicContact CB-CE 4.05Å; I319-M396 HydrophobicContact CD1-CE 3.5Å; I319-M396 VanDerWaalsContact CD1-CE 3.5Å; I319-M396 HydrophobicContact CD1-SD 4.18Å; I319-M396 HydrophobicContact CG1-CE 3.41Å; I319-M396 VanDerWaalsContact CG1-CE 3.41Å; I319-M396 HydrophobicContact CG2-CE 3.48Å; I319-M396 VanDerWaalsContact CG2-CE 3.48Å |
| 320 | S | 84.5 | Confident | 85.7 | Confident | 23 Ų | 23 | 33.3 Ų | 33.3 | 16% | 0.161 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -71.1 | -45 | 178.6 | -174.5 | 0 | 0 | 0 | 0 | 112.6 | P316 T317 Y318 Q324 | P316-S320 WeakPolarHBondContact O-CB 3.11Å; P316-S320 PolarHBondContact O-N 3.14Å; T317-S320 PolarHBondContact O-N 2.89Å; Y318-S320 VanDerWaalsContact C-N 3.34Å; Y318-S320 PolarHBondContact O-N 3.3Å; S320-Q324 VanDerWaalsContact O-CA 3.23Å; S320-Q324 WeakPolarHBondContact O-CA 3.31Å; S320-Q324 PolarHBondContact O-N 3Å |
| 321 | S | 81.7 | Confident | 85.4 | Confident | 55 Ų | 55 | 33 Ų | 33 | 39% | 0.385 | 17% | 0.17 | S | C | . | . | H | α-helix | trans | -82.8 | -39.3 | -174.6 | 64 | 0 | 0 | 0 | 0 | 114.1 | T317 Y318 | T317-S321 WeakPolarHBondContact O-CB 3.37Å; T317-S321 PolarHBondContact O-N 3.07Å; T317-S321 PolarHBondContact O-OG 3.32Å; Y318-S321 PolarHBondContact O-N 2.96Å |
| 322 | V | 79.4 | Confident | 85.3 | Confident | 11 Ų | 11 | 35.3 Ų | 35.3 | 7% | 0.067 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -90.5 | -43.6 | -174 | 165.9 | 0 | 0 | 0 | 0 | 111.7 | Y318 R389 W459 | Y318-V322 HydrophobicContact CD2-CB 4.06Å; Y318-V322 HydrophobicContact CD2-CG1 4.48Å; Y318-V322 HydrophobicContact CD2-CG2 3.66Å; Y318-V322 HydrophobicContact CE1-CB 4.45Å; Y318-V322 HydrophobicContact CE1-CG1 4.16Å; Y318-V322 HydrophobicContact CE2-CB 3.95Å; Y318-V322 HydrophobicContact CE2-CG1 3.89Å; Y318-V322 HydrophobicContact CE2-CG2 3.65Å; Y318-V322 HydrophobicContact CG-CB 4.38Å; Y318-V322 HydrophobicContact CG-CG2 4.38Å; Y318-V322 WeakPolarHBondContact O-CA 3.15Å; Y318-V322 WeakPolarHBondContact O-CB 3.22Å; Y318-V322 PolarHBondContact O-N 3.41Å; V322-R389 HydrophobicContact CG1-CG 3.93Å; V322-R389 PolarHBondContact O-NH2 3.38Å; V322-W459 HydrophobicContact CG2-CG 4.32Å |
| 323 | L | 78.2 | Confident | 85.3 | Confident | 5 Ų | 5 | 37 Ų | 37 | 3% | 0.026 | 19% | 0.191 | C | C | . | . | S | Bend | trans | -90.3 | -3.9 | 179 | -67.4 | 162.6 | 0 | 0 | 0 | 112.6 | I319 A325 H392 T395 M396 | I319-L323 HydrophobicContact CB-CD1 4.45Å; I319-L323 HydrophobicContact CG1-CD1 4.25Å; I319-L323 HydrophobicContact CG2-CD1 4.24Å; I319-L323 CarbonylContact O-C 3.48Å; I319-L323 VanDerWaalsContact O-CB 3.24Å; I319-L323 WeakPolarHBondContact O-CB 3.15Å; I319-L323 PolarHBondContact O-N 2.94Å; L323-A325 PolarHBondContact O-N 3.05Å; L323-H392 HydrophobicContact CD2-CB 3.9Å; L323-H392 PolarHBondContact O-CD2 3.25Å; L323-H392 VanDerWaalsContact O-CD2 3.23Å; L323-H392 PolarHBondContact O-NE2 2.82Å; L323-T395 HydrophobicContact CD1-CG2 4.01Å; L323-T395 HydrophobicContact CD2-CG2 4.17Å; L323-T395 HydrophobicContact CG-CG2 4.37Å; L323-M396 HydrophobicContact CD1-CE 3.33Å |
| 324 | Q | 78.9 | Confident | 85.3 | Confident | 167 Ų | 167 | 36.8 Ų | 36.8 | 78% | 0.78 | 19% | 0.19 | S | C | * | . | trans | 53 | 29.5 | 179.7 | -60.3 | -172.9 | -21.3 | 0 | 0 | 113 | I319 S320 | I319-Q324 PolarHBondContact O-N 3.01Å; S320-Q324 VanDerWaalsContact O-CA 3.23Å; S320-Q324 WeakPolarHBondContact O-CA 3.31Å; S320-Q324 PolarHBondContact O-N 3Å | ||
| 325 | A | 79.4 | Confident | 85.3 | Confident | 21 Ų | 21 | 36.6 Ų | 36.6 | 17% | 0.174 | 19% | 0.19 | C | C | . | . | trans | -76.5 | 148.2 | 177.7 | 0 | 0 | 0 | 0 | 0 | 110.4 | I319 L323 D329 S330 | I319-A325 HydrophobicContact CG2-CB 3.9Å; I319-A325 PolarHBondContact O-N 2.98Å; L323-A325 PolarHBondContact O-N 3.05Å; A325-D329 HydrophobicContact CB-CB 4.38Å; A325-S330 PolarHBondContact O-OG 2.97Å | ||
| 326 | N | 83.4 | Confident | 85.4 | Confident | 100 Ų | 100 | 40.2 Ų | 40.2 | 54% | 0.535 | 21% | 0.208 | S | C | . | . | trans | -60.6 | 160 | 172.6 | -67.6 | -47.2 | 0 | 0 | 0 | 111 | R328 D329 S330 | N326-R328 VanDerWaalsContact C-N 3.32Å; N326-R328 PolarHBondContact O-N 3.01Å; N326-D329 PolarHBondContact O-N 2.95Å; N326-S330 VanDerWaalsContact O-CB 3.3Å; N326-S330 WeakPolarHBondContact O-CB 3.31Å; N326-S330 PolarHBondContact O-N 3.22Å; N326-S330 PolarHBondContact O-OG 2.97Å | ||
| 327 | L | 80.4 | Confident | 85.5 | Confident | 36 Ų | 36 | 40.2 Ų | 40.2 | 19% | 0.188 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -58.8 | -41.1 | -178.7 | -67.7 | 170.6 | 0 | 0 | 0 | 112.6 | P62 A63 G220 C223 Q224 S330 G331 | P62-L327 HydrophobicContact CB-CD2 3.9Å; A63-L327 HydrophobicContact CB-CD1 3.66Å; A63-L327 HydrophobicContact CB-CD2 4.12Å; G220-L327 WeakPolarHBondContact CA-O 3.43Å; C223-L327 HydrophobicContact CB-CD1 4.25Å; Q224-L327 HydrophobicContact CB-CB 4.31Å; L327-S330 PolarHBondContact O-N 2.87Å; L327-G331 PolarHBondContact O-N 3.43Å |
| 328 | R | 83.6 | Confident | 85.5 | Confident | 129 Ų | 129 | 41 Ų | 41 | 49% | 0.487 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -59.1 | -52.5 | 174.6 | 177 | -175.6 | 178.1 | -172.1 | -1.2 | 112.1 | L221 Q224 N326 S330 G331 I332 | L221-R328 HydrophobicContact CD1-CG 4.26Å; Q224-R328 VanDerWaalsContact OE1-N 3.07Å; N326-R328 VanDerWaalsContact C-N 3.32Å; N326-R328 PolarHBondContact O-N 3.01Å; R328-S330 VanDerWaalsContact C-N 3.3Å; R328-S330 PolarHBondContact O-N 3.4Å; R328-G331 PolarHBondContact O-N 3.47Å; R328-I332 HydrophobicContact CG-CD1 4.11Å; R328-I332 WeakPolarHBondContact O-CG1 3.41Å; R328-I332 PolarHBondContact O-N 3.24Å; R328-I332 VanDerWaalsContact O-N 3.08Å |
| 329 | D | 84.7 | Confident | 85.6 | Confident | 68 Ų | 68 | 43.1 Ų | 43.1 | 36% | 0.364 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -67.1 | -36.8 | -177.4 | -59.5 | -32.6 | 0 | 0 | 0 | 110.7 | A325 N326 G331 I332 L333 | A325-D329 HydrophobicContact CB-CB 4.38Å; N326-D329 PolarHBondContact O-N 2.95Å; D329-G331 VanDerWaalsContact C-N 3.32Å; D329-G331 PolarHBondContact O-N 3.39Å; D329-I332 PolarHBondContact O-N 3.49Å; D329-L333 VanDerWaalsContact O-CB 3.23Å; D329-L333 WeakPolarHBondContact O-CB 3.21Å; D329-L333 WeakPolarHBondContact O-CD1 3.08Å; D329-L333 WeakPolarHBondContact O-CG 3.45Å; D329-L333 PolarHBondContact O-N 3.02Å |
| 330 | S | 85.3 | Confident | 85.9 | Confident | 2 Ų | 2 | 45.3 Ų | 45.3 | 1% | 0.014 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -58.9 | -42.8 | 172.8 | -60.6 | 0 | 0 | 0 | 0 | 111.6 | A325 N326 L327 R328 S334 | A325-S330 PolarHBondContact O-OG 2.97Å; N326-S330 VanDerWaalsContact O-CB 3.3Å; N326-S330 WeakPolarHBondContact O-CB 3.31Å; N326-S330 PolarHBondContact O-N 3.22Å; N326-S330 PolarHBondContact O-OG 2.97Å; L327-S330 PolarHBondContact O-N 2.87Å; R328-S330 VanDerWaalsContact C-N 3.3Å; R328-S330 PolarHBondContact O-N 3.4Å; S330-S334 WeakPolarHBondContact O-CB 3.5Å; S330-S334 PolarHBondContact O-N 2.82Å; S330-S334 PolarHBondContact O-OG 3.43Å |
| 331 | G | 86.9 | Confident | 86.2 | Confident | 0 Ų | 0 | 44.4 Ų | 44.4 | 0% | 0 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -62.7 | -50.8 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | L216 L327 R328 D329 L333 S334 A335 | L216-G331 CarbonylContact C-O 3.42Å; L216-G331 CarbonylContact O-C 3.44Å; L216-G331 WeakPolarHBondContact O-CA 3.42Å; L327-G331 PolarHBondContact O-N 3.43Å; R328-G331 PolarHBondContact O-N 3.47Å; D329-G331 VanDerWaalsContact C-N 3.32Å; D329-G331 PolarHBondContact O-N 3.39Å; G331-L333 PolarHBondContact O-N 3.18Å; G331-S334 PolarHBondContact O-N 2.99Å; G331-A335 PolarHBondContact O-N 3.15Å |
| 332 | I | 88.9 | Confident | 86.6 | Confident | 68 Ų | 68 | 43 Ų | 43 | 35% | 0.349 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -61.9 | -46.7 | -179.8 | -64.6 | 169.3 | 0 | 0 | 0 | 110.9 | R328 D329 S334 A335 | R328-I332 HydrophobicContact CG-CD1 4.11Å; R328-I332 WeakPolarHBondContact O-CG1 3.41Å; R328-I332 PolarHBondContact O-N 3.24Å; R328-I332 VanDerWaalsContact O-N 3.08Å; D329-I332 PolarHBondContact O-N 3.49Å; I332-S334 VanDerWaalsContact C-N 3.33Å; I332-S334 PolarHBondContact O-N 2.92Å; I332-A335 WeakPolarHBondContact O-CB 3.4Å; I332-A335 PolarHBondContact O-N 3.4Å |
| 333 | L | 90.4 | Very high | 87.3 | Confident | 53 Ų | 53 | 47 Ų | 47 | 28% | 0.277 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -68.6 | -33.5 | 179.9 | -67.8 | 168.8 | 0 | 0 | 0 | 111.9 | I319 D329 G331 A335 L336 P337 M396 | I319-L333 HydrophobicContact CD1-CB 4.14Å; I319-L333 HydrophobicContact CG2-CB 4.47Å; I319-L333 HydrophobicContact CG2-CD1 4.36Å; D329-L333 VanDerWaalsContact O-CB 3.23Å; D329-L333 WeakPolarHBondContact O-CB 3.21Å; D329-L333 WeakPolarHBondContact O-CD1 3.08Å; D329-L333 WeakPolarHBondContact O-CG 3.45Å; D329-L333 PolarHBondContact O-N 3.02Å; G331-L333 PolarHBondContact O-N 3.18Å; L333-A335 PolarHBondContact O-N 2.76Å; L333-L336 HydrophobicContact CD2-CD1 4.03Å; L333-L336 PolarHBondContact O-N 3.26Å; L333-P337 VanDerWaalsContact O-CD 3.31Å; L333-P337 WeakPolarHBondContact O-CD 3.43Å; L333-M396 HydrophobicContact CB-CE 3.64Å; L333-M396 HydrophobicContact CB-SD 3.91Å; L333-M396 HydrophobicContact CD1-CE 3.67Å; L333-M396 HydrophobicContact CD1-SD 4.48Å; L333-M396 HydrophobicContact CD2-CE 4.46Å; L333-M396 HydrophobicContact CD2-CG 4.48Å; L333-M396 HydrophobicContact CD2-SD 4.24Å; L333-M396 HydrophobicContact CG-CE 4.12Å; L333-M396 HydrophobicContact CG-SD 4.44Å |
| 334 | S | 90.2 | Very high | 88 | Confident | 0 Ų | 0 | 47.7 Ų | 47.7 | 0% | 0 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -64.1 | -26.7 | 174.5 | -64.7 | 0 | 0 | 0 | 0 | 112.8 | P316 I319 S330 G331 I332 P337 F338 | P316-S334 VanDerWaalsContact CA-OG 3.31Å; P316-S334 WeakPolarHBondContact CA-OG 3.3Å; I319-S334 WeakPolarHBondContact CD1-OG 3.42Å; S330-S334 WeakPolarHBondContact O-CB 3.5Å; S330-S334 PolarHBondContact O-N 2.82Å; S330-S334 PolarHBondContact O-OG 3.43Å; G331-S334 PolarHBondContact O-N 2.99Å; I332-S334 VanDerWaalsContact C-N 3.33Å; I332-S334 PolarHBondContact O-N 2.92Å; S334-P337 WeakPolarHBondContact O-CD 3.48Å; S334-F338 WeakPolarHBondContact O-CD2 3.38Å; S334-F338 VanDerWaalsContact O-CE2 3.27Å; S334-F338 WeakPolarHBondContact O-CE2 3.42Å |
| 335 | A | 91.4 | Very high | 88.7 | Confident | 3 Ų | 3 | 42.6 Ų | 42.6 | 3% | 0.025 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -73.2 | -28.1 | -180 | 0 | 0 | 0 | 0 | 0 | 112.9 | F213 L216 G331 I332 L333 F338 V339 | F213-A335 HydrophobicContact CD2-CB 3.9Å; F213-A335 HydrophobicContact CE2-CB 4.08Å; L216-A335 HydrophobicContact CB-CB 3.97Å; G331-A335 PolarHBondContact O-N 3.15Å; I332-A335 WeakPolarHBondContact O-CB 3.4Å; I332-A335 PolarHBondContact O-N 3.4Å; L333-A335 PolarHBondContact O-N 2.76Å; A335-F338 PolarHBondContact O-N 3.04Å; A335-V339 WeakPolarHBondContact O-CG2 3.49Å; A335-V339 PolarHBondContact O-N 3.13Å; A335-V339 VanDerWaalsContact O-N 3.16Å |
| 336 | L | 92.1 | Very high | 89.3 | Confident | 81 Ų | 81 | 46.6 Ų | 46.6 | 42% | 0.424 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -60.5 | -49.2 | -173.8 | -68.1 | 170.7 | 0 | 0 | 0 | 113.9 | L333 F338 V339 V340 V400 | L333-L336 HydrophobicContact CD2-CD1 4.03Å; L333-L336 PolarHBondContact O-N 3.26Å; L336-F338 VanDerWaalsContact C-N 3.27Å; L336-F338 PolarHBondContact O-N 2.64Å; L336-V339 PolarHBondContact O-N 3.34Å; L336-V340 WeakPolarHBondContact O-CG2 3.28Å; L336-V340 PolarHBondContact O-N 3.35Å; L336-V400 HydrophobicContact CB-CG2 3.95Å |
| 337 | P | 90.9 | Very high | 89.8 | Confident | 2 Ų | 2 | 46.5 Ų | 46.5 | 1% | 0.013 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -60.4 | -35.9 | -178.8 | -22.4 | 33.3 | 0 | 0 | 0 | 113.2 | L333 S334 G341 L399 V400 S403 | L333-P337 VanDerWaalsContact O-CD 3.31Å; L333-P337 WeakPolarHBondContact O-CD 3.43Å; S334-P337 WeakPolarHBondContact O-CD 3.48Å; P337-G341 PolarHBondContact O-N 3.41Å; P337-L399 HydrophobicContact CG-CB 4.44Å; P337-V400 HydrophobicContact CG-CG2 3.98Å; P337-S403 WeakPolarHBondContact CB-OG 3.48Å; P337-S403 WeakPolarHBondContact O-CB 3.13Å |
| 338 | F | 88.9 | Confident | 90.4 | Very high | 29 Ų | 29 | 44.8 Ų | 44.8 | 13% | 0.127 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -70.8 | -44.5 | 177.9 | -60.5 | -81.7 | 0 | 0 | 0 | 111.9 | M55 L216 I311 M312 S334 A335 L336 G341 C342 | M55-F338 HydrophobicContact CE-CD1 4.07Å; M55-F338 HydrophobicContact CE-CD2 4.4Å; M55-F338 HydrophobicContact CE-CE1 3.7Å; M55-F338 HydrophobicContact CE-CE2 4.07Å; M55-F338 HydrophobicContact CE-CG 4.43Å; M55-F338 HydrophobicContact CE-CZ 3.74Å; L216-F338 HydrophobicContact CD1-CD2 3.54Å; L216-F338 HydrophobicContact CD1-CE2 3.73Å; L216-F338 HydrophobicContact CD1-CG 4.43Å; I311-F338 HydrophobicContact CG2-CZ 4.14Å; M312-F338 HydrophobicContact CB-CE1 4.39Å; M312-F338 HydrophobicContact CB-CZ 4.46Å; M312-F338 HydrophobicContact CG-CE1 4.43Å; S334-F338 WeakPolarHBondContact O-CD2 3.38Å; S334-F338 VanDerWaalsContact O-CE2 3.27Å; S334-F338 WeakPolarHBondContact O-CE2 3.42Å; A335-F338 PolarHBondContact O-N 3.04Å; L336-F338 VanDerWaalsContact C-N 3.27Å; L336-F338 PolarHBondContact O-N 2.64Å; F338-G341 PolarHBondContact O-N 3.32Å; F338-C342 WeakPolarHBondContact O-CB 3.36Å; F338-C342 PolarHBondContact O-N 2.98Å; F338-C342 PolarHBondContact O-SG 3.01Å |
| 339 | V | 91 | Very high | 90.8 | Very high | 52 Ų | 52 | 39.6 Ų | 39.6 | 32% | 0.315 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -65.1 | -46.2 | 179.9 | 173.4 | 0 | 0 | 0 | 0 | 111.4 | F213 A335 L336 G341 C342 I343 | F213-V339 HydrophobicContact CB-CG2 4.48Å; F213-V339 HydrophobicContact CD2-CG2 3.27Å; F213-V339 HydrophobicContact CE2-CG2 3.73Å; F213-V339 HydrophobicContact CG-CG2 4.12Å; A335-V339 WeakPolarHBondContact O-CG2 3.49Å; A335-V339 PolarHBondContact O-N 3.13Å; A335-V339 VanDerWaalsContact O-N 3.16Å; L336-V339 PolarHBondContact O-N 3.34Å; V339-G341 VanDerWaalsContact C-N 3.35Å; V339-C342 WeakPolarHBondContact O-CB 3.22Å; V339-C342 PolarHBondContact O-N 2.89Å; V339-I343 HydrophobicContact CG1-CD1 4.28Å; V339-I343 WeakPolarHBondContact O-CG1 3.28Å; V339-I343 PolarHBondContact O-N 2.66Å; V339-I343 VanDerWaalsContact O-N 3.12Å |
| 340 | V | 93.1 | Very high | 91.2 | Very high | 47 Ų | 47 | 41.5 Ų | 41.5 | 29% | 0.285 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -65.9 | -42.3 | 178.3 | 179.1 | 0 | 0 | 0 | 0 | 110.3 | L336 C342 I343 C344 V400 A404 | L336-V340 WeakPolarHBondContact O-CG2 3.28Å; L336-V340 PolarHBondContact O-N 3.35Å; V340-C342 VanDerWaalsContact C-N 3.33Å; V340-C342 PolarHBondContact O-N 3.13Å; V340-I343 PolarHBondContact O-N 2.89Å; V340-C344 PolarHBondContact O-N 3.49Å; V340-C344 PolarHBondContact O-SG 3.17Å; V340-V400 HydrophobicContact CB-CG1 3.89Å; V340-V400 HydrophobicContact CG1-CG1 3.94Å; V340-V400 HydrophobicContact CG2-CG1 3.77Å; V340-A404 HydrophobicContact CG1-CB 3.77Å |
| 341 | G | 91.9 | Very high | 91.7 | Very high | 3 Ų | 3 | 45.1 Ų | 45.1 | 3% | 0.031 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -53.8 | -50 | 173.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | P337 F338 V339 I343 C344 I345 S407 | P337-G341 PolarHBondContact O-N 3.41Å; F338-G341 PolarHBondContact O-N 3.32Å; V339-G341 VanDerWaalsContact C-N 3.35Å; G341-I343 VanDerWaalsContact C-N 3.35Å; G341-I343 PolarHBondContact O-N 3.35Å; G341-C344 CarbonylContact O-C 3.59Å; G341-C344 WeakPolarHBondContact O-CA 3.38Å; G341-C344 WeakPolarHBondContact O-CB 3.44Å; G341-C344 PolarHBondContact O-N 2.57Å; G341-I345 WeakPolarHBondContact O-CG1 3.17Å; G341-I345 PolarHBondContact O-N 3.09Å; G341-S407 VanDerWaalsContact C-OG 3.27Å; G341-S407 WeakPolarHBondContact CA-OG 3.39Å; G341-S407 WeakPolarHBondContact O-CB 3.4Å; G341-S407 PolarHBondContact O-OG 2.96Å |
| 342 | C | 90.1 | Very high | 92 | Very high | 26 Ų | 26 | 45.3 Ų | 45.3 | 18% | 0.176 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -53.7 | -45.6 | 176.3 | -75.6 | 0 | 0 | 0 | 0 | 113.9 | M209 F338 V339 V340 C344 I345 I346 | M209-C342 HydrophobicContact CE-CB 3.21Å; M209-C342 WeakPolarHBondContact CE-SG 3.38Å; F338-C342 WeakPolarHBondContact O-CB 3.36Å; F338-C342 PolarHBondContact O-N 2.98Å; F338-C342 PolarHBondContact O-SG 3.01Å; V339-C342 WeakPolarHBondContact O-CB 3.22Å; V339-C342 PolarHBondContact O-N 2.89Å; V340-C342 VanDerWaalsContact C-N 3.33Å; V340-C342 PolarHBondContact O-N 3.13Å; C342-C344 VanDerWaalsContact C-N 3.32Å; C342-I345 PolarHBondContact O-N 3.37Å; C342-I346 PolarHBondContact O-N 2.92Å |
| 343 | I | 92.8 | Very high | 92.1 | Very high | 94 Ų | 94 | 47 Ų | 47 | 48% | 0.482 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -62.7 | -43.2 | 175.8 | -65.8 | 166.6 | 0 | 0 | 0 | 109.9 | V339 V340 G341 I345 I346 L347 | V339-I343 HydrophobicContact CG1-CD1 4.28Å; V339-I343 WeakPolarHBondContact O-CG1 3.28Å; V339-I343 PolarHBondContact O-N 2.66Å; V339-I343 VanDerWaalsContact O-N 3.12Å; V340-I343 PolarHBondContact O-N 2.89Å; G341-I343 VanDerWaalsContact C-N 3.35Å; G341-I343 PolarHBondContact O-N 3.35Å; I343-I345 PolarHBondContact O-N 3.27Å; I343-I346 PolarHBondContact O-N 3.41Å; I343-L347 HydrophobicContact CG2-CD1 3.88Å; I343-L347 HydrophobicContact CG2-CG 4.32Å; I343-L347 WeakPolarHBondContact O-CG 3.39Å; I343-L347 PolarHBondContact O-N 3.39Å |
| 344 | C | 94.5 | Very high | 92.3 | Very high | 21 Ų | 21 | 49.4 Ų | 49.4 | 14% | 0.142 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -66.2 | -30.9 | 177.8 | -71 | 0 | 0 | 0 | 0 | 113.6 | V340 G341 C342 I346 L347 G348 A404 | V340-C344 PolarHBondContact O-N 3.49Å; V340-C344 PolarHBondContact O-SG 3.17Å; G341-C344 CarbonylContact O-C 3.59Å; G341-C344 WeakPolarHBondContact O-CA 3.38Å; G341-C344 WeakPolarHBondContact O-CB 3.44Å; G341-C344 PolarHBondContact O-N 2.57Å; C342-C344 VanDerWaalsContact C-N 3.32Å; C344-I346 VanDerWaalsContact C-N 3.34Å; C344-L347 PolarHBondContact O-N 2.84Å; C344-G348 WeakPolarHBondContact O-CA 3.44Å; C344-G348 PolarHBondContact O-N 3.2Å; C344-A404 VanDerWaalsContact CB-O 3.25Å; C344-A404 WeakPolarHBondContact CB-O 3.17Å |
| 345 | I | 92.5 | Very high | 92.5 | Very high | 60 Ų | 60 | 50.7 Ų | 50.7 | 31% | 0.308 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -58.4 | -49.3 | 171.5 | -64.7 | 174.3 | 0 | 0 | 0 | 109.6 | G341 C342 I343 G348 G349 E410 | G341-I345 WeakPolarHBondContact O-CG1 3.17Å; G341-I345 PolarHBondContact O-N 3.09Å; C342-I345 PolarHBondContact O-N 3.37Å; I343-I345 PolarHBondContact O-N 3.27Å; I345-G348 PolarHBondContact O-N 3.02Å; I345-G349 PolarHBondContact O-N 3.3Å; I345-E410 HydrophobicContact CD1-CG 3.99Å; I345-E410 HydrophobicContact CG1-CB 4.43Å; I345-E410 HydrophobicContact CG1-CG 3.99Å; I345-E410 HydrophobicContact CG2-CB 3.97Å; I345-E410 HydrophobicContact CG2-CG 4.18Å |
| 346 | I | 91.9 | Very high | 92.5 | Very high | 105 Ų | 105 | 54 Ų | 54 | 54% | 0.538 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -64.2 | -48.5 | -178.8 | -61.5 | 171.2 | 0 | 0 | 0 | 110.3 | C342 I343 C344 G348 G349 L350 | C342-I346 PolarHBondContact O-N 2.92Å; I343-I346 PolarHBondContact O-N 3.41Å; C344-I346 VanDerWaalsContact C-N 3.34Å; I346-G348 VanDerWaalsContact C-N 3.3Å; I346-G348 PolarHBondContact O-N 2.89Å; I346-G349 PolarHBondContact O-N 2.97Å; I346-L350 HydrophobicContact CG2-CD1 4.19Å; I346-L350 WeakPolarHBondContact O-CG 3.28Å; I346-L350 PolarHBondContact O-N 3.03Å |
| 347 | L | 94 | Very high | 92.6 | Very high | 98 Ų | 98 | 54.4 Ų | 54.4 | 51% | 0.513 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -62.3 | -38.7 | 178.4 | -67.1 | 175.9 | 0 | 0 | 0 | 112 | I343 C344 L350 L351 | I343-L347 HydrophobicContact CG2-CD1 3.88Å; I343-L347 HydrophobicContact CG2-CG 4.32Å; I343-L347 WeakPolarHBondContact O-CG 3.39Å; I343-L347 PolarHBondContact O-N 3.39Å; C344-L347 PolarHBondContact O-N 2.84Å; L347-L350 PolarHBondContact O-N 3.4Å; L347-L351 VanDerWaalsContact O-CB 3.27Å; L347-L351 WeakPolarHBondContact O-CB 3.48Å; L347-L351 PolarHBondContact O-N 3.49Å |
| 348 | G | 93.6 | Very high | 92.7 | Very high | 0 Ų | 0 | 62.7 Ų | 62.7 | 0% | 0 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -61.2 | -44.8 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | C344 I345 I346 L351 A352 F370 S411 | C344-G348 WeakPolarHBondContact O-CA 3.44Å; C344-G348 PolarHBondContact O-N 3.2Å; I345-G348 PolarHBondContact O-N 3.02Å; I346-G348 VanDerWaalsContact C-N 3.3Å; I346-G348 PolarHBondContact O-N 2.89Å; G348-L351 PolarHBondContact O-N 3Å; G348-A352 WeakPolarHBondContact O-CB 3.41Å; G348-A352 PolarHBondContact O-N 3.03Å; G348-F370 VanDerWaalsContact O-CE1 3.28Å; G348-F370 WeakPolarHBondContact O-CE1 3.18Å; G348-S411 VanDerWaalsContact C-OG 3.25Å |
| 349 | G | 92.1 | Very high | 92.8 | Very high | 20 Ų | 20 | 70.2 Ų | 70.2 | 21% | 0.206 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -61.7 | -49.5 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | I345 I346 L351 A352 D353 S411 | I345-G349 PolarHBondContact O-N 3.3Å; I346-G349 PolarHBondContact O-N 2.97Å; G349-L351 VanDerWaalsContact C-N 3.29Å; G349-L351 PolarHBondContact O-N 2.73Å; G349-A352 PolarHBondContact O-N 3.45Å; G349-D353 PolarHBondContact O-N 3.14Å; G349-S411 VanDerWaalsContact CA-OG 3.28Å; G349-S411 WeakPolarHBondContact CA-OG 3.27Å; G349-S411 PolarHBondContact N-OG 3.3Å |
| 350 | L | 93.8 | Very high | 93 | Very high | 108 Ų | 108 | 72.6 Ų | 72.6 | 57% | 0.565 | 37% | 0.373 | S | S | * | . | H | α-helix | trans | -59.6 | -39.4 | 177 | -67.3 | 175 | 0 | 0 | 0 | 112.2 | I346 L347 F354 | I346-L350 HydrophobicContact CG2-CD1 4.19Å; I346-L350 WeakPolarHBondContact O-CG 3.28Å; I346-L350 PolarHBondContact O-N 3.03Å; L347-L350 PolarHBondContact O-N 3.4Å; L350-F354 WeakPolarHBondContact O-CB 3.34Å; L350-F354 PolarHBondContact O-N 3.2Å |
| 351 | L | 94.6 | Very high | 93 | Very high | 78 Ų | 78 | 73 Ų | 73 | 41% | 0.408 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -68.2 | -42.2 | 176.9 | -176.2 | 62.2 | 0 | 0 | 0 | 111.7 | L347 G348 G349 F354 L355 F370 F408 | L347-L351 VanDerWaalsContact O-CB 3.27Å; L347-L351 WeakPolarHBondContact O-CB 3.48Å; L347-L351 PolarHBondContact O-N 3.49Å; G348-L351 PolarHBondContact O-N 3Å; G349-L351 VanDerWaalsContact C-N 3.29Å; G349-L351 PolarHBondContact O-N 2.73Å; L351-F354 PolarHBondContact O-N 3.25Å; L351-L355 HydrophobicContact CD1-CG 4.49Å; L351-L355 HydrophobicContact CG-CD1 4.23Å; L351-L355 VanDerWaalsContact O-CG 3.26Å; L351-L355 WeakPolarHBondContact O-CG 3.28Å; L351-L355 PolarHBondContact O-N 3.4Å; L351-F370 HydrophobicContact CB-CZ 4.28Å; L351-F370 HydrophobicContact CD2-CZ 4.09Å; L351-F370 HydrophobicContact CG-CZ 4.04Å; L351-F408 HydrophobicContact CD2-CE1 4.32Å |
| 352 | A | 93.1 | Very high | 93.2 | Very high | 4 Ų | 4 | 82.3 Ų | 82.3 | 3% | 0.033 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -60.9 | -45.1 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.3 | G348 G349 L355 L356 I366 F370 | G348-A352 WeakPolarHBondContact O-CB 3.41Å; G348-A352 PolarHBondContact O-N 3.03Å; G349-A352 PolarHBondContact O-N 3.45Å; A352-L355 PolarHBondContact O-N 2.9Å; A352-L356 WeakPolarHBondContact O-CB 3.26Å; A352-L356 PolarHBondContact O-N 2.83Å; A352-I366 HydrophobicContact CB-CG2 3.9Å; A352-F370 HydrophobicContact CB-CE1 3.97Å; A352-F370 HydrophobicContact CB-CZ 3.93Å |
| 353 | D | 91.9 | Very high | 93.3 | Very high | 103 Ų | 103 | 83.4 Ų | 83.4 | 55% | 0.551 | 41% | 0.411 | S | S | * | . | H | α-helix | trans | -65 | -39.2 | 177 | -72.5 | -16.6 | 0 | 0 | 0 | 112.1 | G349 L356 S357 | G349-D353 PolarHBondContact O-N 3.14Å; D353-L356 PolarHBondContact O-N 2.99Å; D353-S357 WeakPolarHBondContact O-CB 3.17Å; D353-S357 PolarHBondContact O-N 3.06Å; D353-S357 PolarHBondContact O-OG 3.15Å |
| 354 | F | 93.7 | Very high | 93.4 | Very high | 103 Ų | 103 | 80.7 Ų | 80.7 | 45% | 0.452 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -61.4 | -47.9 | 174 | 176 | -95 | 0 | 0 | 0 | 111.8 | L350 L351 L356 S357 R358 I360 | L350-F354 WeakPolarHBondContact O-CB 3.34Å; L350-F354 PolarHBondContact O-N 3.2Å; L351-F354 PolarHBondContact O-N 3.25Å; F354-L356 VanDerWaalsContact C-N 3.31Å; F354-L356 PolarHBondContact O-N 3.12Å; F354-S357 PolarHBondContact O-OG 2.98Å; F354-S357 VanDerWaalsContact O-OG 3.1Å; F354-R358 HydrophobicContact CD2-CG 4.25Å; F354-R358 HydrophobicContact CE1-CG 4.43Å; F354-R358 HydrophobicContact CE2-CG 3.96Å; F354-R358 HydrophobicContact CZ-CG 4.05Å; F354-R358 WeakPolarHBondContact O-CB 3.37Å; F354-R358 WeakPolarHBondContact O-CG 3.23Å; F354-R358 PolarHBondContact O-N 3.24Å; F354-R358 VanDerWaalsContact O-N 3.08Å; F354-I360 HydrophobicContact CE1-CD1 4.11Å |
| 355 | L | 94.6 | Very high | 93.4 | Very high | 28 Ų | 28 | 82.8 Ų | 82.8 | 15% | 0.147 | 41% | 0.41 | C | S | . | . | H | α-helix | trans | -63.7 | -38.1 | 179.3 | -69.2 | 170.8 | 0 | 0 | 0 | 112 | L351 A352 K359 I360 L361 I366 F370 | L351-L355 HydrophobicContact CD1-CG 4.49Å; L351-L355 HydrophobicContact CG-CD1 4.23Å; L351-L355 VanDerWaalsContact O-CG 3.26Å; L351-L355 WeakPolarHBondContact O-CG 3.28Å; L351-L355 PolarHBondContact O-N 3.4Å; A352-L355 PolarHBondContact O-N 2.9Å; L355-K359 PolarHBondContact O-N 3.37Å; L355-I360 HydrophobicContact CD2-CB 4.31Å; L355-I360 HydrophobicContact CD2-CD1 4.03Å; L355-I360 HydrophobicContact CD2-CG2 4.27Å; L355-I360 PolarHBondContact O-N 3.24Å; L355-L361 HydrophobicContact CD1-CD1 4.32Å; L355-I366 HydrophobicContact CB-CD1 3.97Å; L355-I366 HydrophobicContact CB-CG1 4.43Å; L355-F370 HydrophobicContact CD1-CE2 3.85Å; L355-F370 HydrophobicContact CD1-CZ 4.11Å |
| 356 | L | 92.3 | Very high | 93.6 | Very high | 73 Ų | 73 | 80 Ų | 80 | 38% | 0.382 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -72.1 | -48.6 | 178.5 | -174.4 | 64.3 | 0 | 0 | 0 | 112 | A352 D353 F354 R358 K359 L363 I366 | A352-L356 WeakPolarHBondContact O-CB 3.26Å; A352-L356 PolarHBondContact O-N 2.83Å; D353-L356 PolarHBondContact O-N 2.99Å; F354-L356 VanDerWaalsContact C-N 3.31Å; F354-L356 PolarHBondContact O-N 3.12Å; L356-R358 VanDerWaalsContact C-N 3.33Å; L356-R358 PolarHBondContact O-N 3.28Å; L356-K359 WeakPolarHBondContact O-CA 3.21Å; L356-K359 PolarHBondContact O-N 3.48Å; L356-L363 HydrophobicContact CD1-CB 4.24Å; L356-L363 HydrophobicContact CD1-CD1 4.35Å; L356-L363 HydrophobicContact CD2-CD1 4.13Å; L356-I366 HydrophobicContact CB-CD1 3.75Å; L356-I366 HydrophobicContact CD1-CD1 4.13Å |
| 357 | S | 93.2 | Very high | 93.8 | Very high | 88 Ų | 88 | 76.6 Ų | 76.6 | 62% | 0.615 | 38% | 0.376 | S | S | * | . | H | α-helix | trans | -64.7 | -35.5 | -177.9 | 59.2 | 0 | 0 | 0 | 0 | 112.7 | D353 F354 K359 | D353-S357 WeakPolarHBondContact O-CB 3.17Å; D353-S357 PolarHBondContact O-N 3.06Å; D353-S357 PolarHBondContact O-OG 3.15Å; F354-S357 PolarHBondContact O-OG 2.98Å; F354-S357 VanDerWaalsContact O-OG 3.1Å; S357-K359 PolarHBondContact O-N 3.01Å |
| 358 | R | 93.4 | Very high | 94 | Very high | 177 Ų | 177 | 73.9 Ų | 73.9 | 67% | 0.668 | 36% | 0.36 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.1 | -0.7 | 173.1 | -65 | -65.9 | -171.8 | 176.4 | 0.4 | 113.5 | F354 L356 I360 | F354-R358 HydrophobicContact CD2-CG 4.25Å; F354-R358 HydrophobicContact CE1-CG 4.43Å; F354-R358 HydrophobicContact CE2-CG 3.96Å; F354-R358 HydrophobicContact CZ-CG 4.05Å; F354-R358 WeakPolarHBondContact O-CB 3.37Å; F354-R358 WeakPolarHBondContact O-CG 3.23Å; F354-R358 PolarHBondContact O-N 3.24Å; F354-R358 VanDerWaalsContact O-N 3.08Å; L356-R358 VanDerWaalsContact C-N 3.33Å; L356-R358 PolarHBondContact O-N 3.28Å; R358-I360 HydrophobicContact CB-CD1 3.76Å; R358-I360 HydrophobicContact CB-CG1 3.73Å; R358-I360 HydrophobicContact CG-CD1 4.48Å; R358-I360 PolarHBondContact O-N 2.93Å; R358-I360 VanDerWaalsContact O-N 3.17Å |
| 359 | K | 91.1 | Very high | 94.1 | Very high | 187 Ų | 187 | 77.3 Ų | 77.3 | 81% | 0.813 | 38% | 0.378 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 53.7 | 30.5 | -177.5 | -57.3 | -179.3 | 178.9 | 179.2 | 0 | 113.1 | L355 L356 S357 | L355-K359 PolarHBondContact O-N 3.37Å; L356-K359 WeakPolarHBondContact O-CA 3.21Å; L356-K359 PolarHBondContact O-N 3.48Å; S357-K359 PolarHBondContact O-N 3.01Å |
| 360 | I | 94.6 | Very high | 94.4 | Very high | 101 Ų | 101 | 76.7 Ų | 76.7 | 52% | 0.518 | 37% | 0.369 | S | S | . | . | S | Bend | trans | -70.6 | -40.5 | 179.2 | -62.3 | 168.9 | 0 | 0 | 0 | 109.4 | F354 L355 R358 | F354-I360 HydrophobicContact CE1-CD1 4.11Å; L355-I360 HydrophobicContact CD2-CB 4.31Å; L355-I360 HydrophobicContact CD2-CD1 4.03Å; L355-I360 HydrophobicContact CD2-CG2 4.27Å; L355-I360 PolarHBondContact O-N 3.24Å; R358-I360 HydrophobicContact CB-CD1 3.76Å; R358-I360 HydrophobicContact CB-CG1 3.73Å; R358-I360 HydrophobicContact CG-CD1 4.48Å; R358-I360 PolarHBondContact O-N 2.93Å; R358-I360 VanDerWaalsContact O-N 3.17Å |
| 361 | L | 94.2 | Very high | 94.5 | Very high | 55 Ų | 55 | 71.5 Ų | 71.5 | 29% | 0.288 | 34% | 0.342 | S | S | . | . | S | Bend | trans | -129.8 | 153.3 | 179.3 | -62.7 | 178.3 | 0 | 0 | 0 | 110.9 | L355 T365 I366 L369 | L355-L361 HydrophobicContact CD1-CD1 4.32Å; L361-T365 HydrophobicContact CD2-CG2 4.23Å; L361-I366 HydrophobicContact CB-CD1 4.09Å; L361-I366 HydrophobicContact CB-CG1 3.6Å; L361-I366 HydrophobicContact CD1-CG1 4.14Å; L361-L369 HydrophobicContact CD1-CD2 3.96Å |
| 362 | R | 94.3 | Very high | 94.7 | Very high | 199 Ų | 199 | 68.6 Ų | 68.6 | 75% | 0.751 | 33% | 0.329 | S | S | * | . | trans | -73.2 | 152.1 | 169.6 | -67 | -177.4 | 179.2 | -177.1 | 0.1 | 110.3 | I364 T365 I366 | R362-I364 PolarHBondContact O-N 3.22Å; R362-T365 WeakPolarHBondContact O-CA 3.35Å; R362-T365 WeakPolarHBondContact O-CB 3.33Å; R362-T365 PolarHBondContact O-N 3.34Å; R362-I366 PolarHBondContact O-N 3.4Å | ||
| 363 | L | 92.5 | Very high | 94.9 | Very high | 49 Ų | 49 | 71 Ų | 71 | 26% | 0.257 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -50.8 | -52.2 | -179.8 | -177.6 | 62 | 0 | 0 | 0 | 112.5 | L356 T365 I366 R367 D419 A483 | L356-L363 HydrophobicContact CD1-CB 4.24Å; L356-L363 HydrophobicContact CD1-CD1 4.35Å; L356-L363 HydrophobicContact CD2-CD1 4.13Å; L363-T365 VanDerWaalsContact C-N 3.27Å; L363-T365 PolarHBondContact O-N 3.18Å; L363-I366 WeakPolarHBondContact O-CB 3.35Å; L363-I366 PolarHBondContact O-N 3.44Å; L363-I366 VanDerWaalsContact O-N 3.11Å; L363-R367 HydrophobicContact CD1-CG 4.43Å; L363-R367 HydrophobicContact CG-CG 4.48Å; L363-R367 WeakPolarHBondContact O-CG 3.26Å; L363-R367 PolarHBondContact O-N 2.86Å; L363-D419 HydrophobicContact CD2-CB 4.28Å; L363-A483 HydrophobicContact CD2-CB 4.12Å; L363-A483 HydrophobicContact CG-CB 4.04Å |
| 364 | I | 94.6 | Very high | 95.1 | Very high | 38 Ų | 38 | 66.2 Ų | 66.2 | 20% | 0.195 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -60.6 | -34.6 | 178.6 | -172.7 | 52.7 | 0 | 0 | 0 | 113.3 | R362 R367 K368 A483 | R362-I364 PolarHBondContact O-N 3.22Å; I364-R367 PolarHBondContact O-N 2.88Å; I364-K368 HydrophobicContact CD1-CD 4.27Å; I364-K368 HydrophobicContact CD1-CG 4.09Å; I364-K368 HydrophobicContact CG1-CD 4.26Å; I364-K368 HydrophobicContact CG1-CG 4.45Å; I364-K368 WeakPolarHBondContact O-CB 3.4Å; I364-K368 WeakPolarHBondContact O-CG 3.36Å; I364-K368 PolarHBondContact O-N 3.41Å; I364-A483 HydrophobicContact CB-CB 3.9Å; I364-A483 HydrophobicContact CD1-CB 3.9Å; I364-A483 HydrophobicContact CG1-CB 4.43Å |
| 365 | T | 96.4 | Very high | 95.2 | Very high | 64 Ų | 64 | 61.5 Ų | 61.5 | 39% | 0.393 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -67.9 | -41.6 | 177.3 | -52.8 | 0 | 0 | 0 | 0 | 110.2 | L361 R362 L363 K368 L369 | L361-T365 HydrophobicContact CD2-CG2 4.23Å; R362-T365 WeakPolarHBondContact O-CA 3.35Å; R362-T365 WeakPolarHBondContact O-CB 3.33Å; R362-T365 PolarHBondContact O-N 3.34Å; L363-T365 VanDerWaalsContact C-N 3.27Å; L363-T365 PolarHBondContact O-N 3.18Å; T365-K368 PolarHBondContact O-N 3.37Å; T365-L369 WeakPolarHBondContact O-CB 3.45Å; T365-L369 PolarHBondContact O-N 3.04Å |
| 366 | I | 95.7 | Very high | 95.3 | Very high | 2 Ų | 2 | 64 Ų | 64 | 1% | 0.01 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -60.7 | -50.8 | 173.9 | -63.4 | 171.2 | 0 | 0 | 0 | 109.7 | A352 L355 L356 L361 R362 L363 K368 L369 F370 | A352-I366 HydrophobicContact CB-CG2 3.9Å; L355-I366 HydrophobicContact CB-CD1 3.97Å; L355-I366 HydrophobicContact CB-CG1 4.43Å; L356-I366 HydrophobicContact CB-CD1 3.75Å; L356-I366 HydrophobicContact CD1-CD1 4.13Å; L361-I366 HydrophobicContact CB-CD1 4.09Å; L361-I366 HydrophobicContact CB-CG1 3.6Å; L361-I366 HydrophobicContact CD1-CG1 4.14Å; R362-I366 PolarHBondContact O-N 3.4Å; L363-I366 WeakPolarHBondContact O-CB 3.35Å; L363-I366 PolarHBondContact O-N 3.44Å; L363-I366 VanDerWaalsContact O-N 3.11Å; I366-K368 VanDerWaalsContact C-N 3.35Å; I366-K368 PolarHBondContact O-N 2.8Å; I366-L369 PolarHBondContact O-N 3.23Å; I366-F370 HydrophobicContact CG2-CD2 3.83Å; I366-F370 HydrophobicContact CG2-CE2 3.86Å; I366-F370 WeakPolarHBondContact O-CB 3.46Å; I366-F370 VanDerWaalsContact O-CD2 3.26Å; I366-F370 WeakPolarHBondContact O-CD2 3.45Å; I366-F370 PolarHBondContact O-N 2.92Å |
| 367 | R | 96.4 | Very high | 95.5 | Very high | 33 Ų | 33 | 66 Ų | 66 | 13% | 0.125 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -56.4 | -46.7 | 180 | -63.2 | -63.1 | -174.2 | -146.3 | 4.7 | 112.1 | L363 I364 T371 S411 G412 V415 D419 A483 | L363-R367 HydrophobicContact CD1-CG 4.43Å; L363-R367 HydrophobicContact CG-CG 4.48Å; L363-R367 WeakPolarHBondContact O-CG 3.26Å; L363-R367 PolarHBondContact O-N 2.86Å; I364-R367 PolarHBondContact O-N 2.88Å; R367-T371 PolarHBondContact O-N 3.4Å; R367-T371 PolarHBondContact O-OG1 2.94Å; R367-S411 PolarHBondContact NH1-O 3.12Å; R367-G412 WeakPolarHBondContact CD-O 3.33Å; R367-G412 WeakPolarHBondContact O-CA 3.38Å; R367-V415 VanDerWaalsContact CZ-CG2 3.43Å; R367-D419 IonicContact CZ-OD2 3.32Å; R367-D419 IonicContact NE-OD2 2.73Å; R367-D419 PolarHBondContact NE-OD2 3.35Å; R367-D419 IonicContact NH2-OD1 3.24Å; R367-D419 PolarHBondContact NH2-OD1 2.82Å; R367-D419 IonicContact NH2-OD2 3.05Å; R367-D419 PolarHBondContact NH2-OD2 3.33Å; R367-A483 HydrophobicContact CG-CB 4.47Å |
| 368 | K | 97.4 | Very high | 95.6 | Very high | 42 Ų | 42 | 61.9 Ų | 61.9 | 18% | 0.183 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -69.7 | -41.4 | 178.9 | -73.8 | -173.9 | 179.9 | -172.6 | 0 | 112.9 | I364 T365 I366 A372 Y477 L478 G481 | I364-K368 HydrophobicContact CD1-CD 4.27Å; I364-K368 HydrophobicContact CD1-CG 4.09Å; I364-K368 HydrophobicContact CG1-CD 4.26Å; I364-K368 HydrophobicContact CG1-CG 4.45Å; I364-K368 WeakPolarHBondContact O-CB 3.4Å; I364-K368 WeakPolarHBondContact O-CG 3.36Å; I364-K368 PolarHBondContact O-N 3.41Å; T365-K368 PolarHBondContact O-N 3.37Å; I366-K368 VanDerWaalsContact C-N 3.35Å; I366-K368 PolarHBondContact O-N 2.8Å; K368-A372 VanDerWaalsContact O-CB 3.25Å; K368-A372 WeakPolarHBondContact O-CB 3.29Å; K368-A372 PolarHBondContact O-N 2.7Å; K368-Y477 HydrophobicContact CG-CE1 4.26Å; K368-L478 HydrophobicContact CB-CD2 3.73Å; K368-L478 HydrophobicContact CD-CD2 4.14Å; K368-L478 WeakPolarHBondContact CE-O 3.13Å; K368-L478 HydrophobicContact CG-CD2 3.98Å; K368-L478 PolarHBondContact NZ-O 2.82Å; K368-G481 WeakPolarHBondContact CE-O 3.31Å; K368-G481 PolarHBondContact NZ-O 3.23Å |
| 369 | L | 97.1 | Very high | 95.7 | Very high | 72 Ų | 72 | 53.7 Ų | 53.7 | 38% | 0.377 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -63.4 | -47.7 | -179.8 | 178.1 | 64.3 | 0 | 0 | 0 | 111.3 | L361 T365 I366 A372 I373 | L361-L369 HydrophobicContact CD1-CD2 3.96Å; T365-L369 WeakPolarHBondContact O-CB 3.45Å; T365-L369 PolarHBondContact O-N 3.04Å; I366-L369 PolarHBondContact O-N 3.23Å; L369-A372 PolarHBondContact O-N 3.38Å; L369-I373 HydrophobicContact CD1-CD1 3.84Å; L369-I373 HydrophobicContact CD1-CG1 4.25Å; L369-I373 HydrophobicContact CG-CD1 3.89Å; L369-I373 WeakPolarHBondContact O-CG1 3.49Å; L369-I373 PolarHBondContact O-N 3.25Å |
| 370 | F | 96.9 | Very high | 95.9 | Very high | 6 Ų | 6 | 49.6 Ų | 49.6 | 3% | 0.026 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -65.7 | -41.6 | -178.7 | -84.1 | -117.8 | 0 | 0 | 0 | 111.6 | G348 L351 A352 L355 I366 G374 F408 | G348-F370 VanDerWaalsContact O-CE1 3.28Å; G348-F370 WeakPolarHBondContact O-CE1 3.18Å; L351-F370 HydrophobicContact CB-CZ 4.28Å; L351-F370 HydrophobicContact CD2-CZ 4.09Å; L351-F370 HydrophobicContact CG-CZ 4.04Å; A352-F370 HydrophobicContact CB-CE1 3.97Å; A352-F370 HydrophobicContact CB-CZ 3.93Å; L355-F370 HydrophobicContact CD1-CE2 3.85Å; L355-F370 HydrophobicContact CD1-CZ 4.11Å; I366-F370 HydrophobicContact CG2-CD2 3.83Å; I366-F370 HydrophobicContact CG2-CE2 3.86Å; I366-F370 WeakPolarHBondContact O-CB 3.46Å; I366-F370 VanDerWaalsContact O-CD2 3.26Å; I366-F370 WeakPolarHBondContact O-CD2 3.45Å; I366-F370 PolarHBondContact O-N 2.92Å; F370-G374 PolarHBondContact O-N 2.87Å; F370-F408 HydrophobicContact CD1-CB 4.21Å; F370-F408 AromaticContact CD1-CD1 3.73Å; F370-F408 HydrophobicContact CD1-CD1 3.73Å; F370-F408 HydrophobicContact CD1-CG 4.48Å; F370-F408 AromaticContact CE1-CD1 3.71Å; F370-F408 HydrophobicContact CE1-CD1 3.71Å; F370-F408 HydrophobicContact CE1-CE1 4.29Å |
| 371 | T | 97.1 | Very high | 95.9 | Very high | 0 Ų | 0 | 45.8 Ų | 45.8 | 0% | 0 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -62.8 | -42.7 | 171.4 | -57.2 | 0 | 0 | 0 | 0 | 112.1 | R367 G374 V375 A413 L474 Y477 | R367-T371 PolarHBondContact O-N 3.4Å; R367-T371 PolarHBondContact O-OG1 2.94Å; T371-G374 PolarHBondContact O-N 3.33Å; T371-V375 HydrophobicContact CG2-CG2 4.36Å; T371-V375 WeakPolarHBondContact O-CB 3.18Å; T371-V375 WeakPolarHBondContact O-CG2 3.28Å; T371-V375 PolarHBondContact O-N 3.35Å; T371-A413 HydrophobicContact CG2-CB 4.02Å; T371-A413 WeakPolarHBondContact OG1-CB 3.43Å; T371-A413 PolarHBondContact OG1-N 2.91Å; T371-L474 HydrophobicContact CG2-CD1 3.81Å; T371-Y477 HydrophobicContact CG2-CD1 3.84Å; T371-Y477 HydrophobicContact CG2-CE1 4.16Å |
| 372 | A | 97.7 | Very high | 95.7 | Very high | 16 Ų | 16 | 43.2 Ų | 43.2 | 13% | 0.132 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -63.2 | -45.5 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | K368 L369 V375 L376 L474 | K368-A372 VanDerWaalsContact O-CB 3.25Å; K368-A372 WeakPolarHBondContact O-CB 3.29Å; K368-A372 PolarHBondContact O-N 2.7Å; L369-A372 PolarHBondContact O-N 3.38Å; A372-V375 PolarHBondContact O-N 2.94Å; A372-L376 HydrophobicContact CB-CD1 4.28Å; A372-L376 WeakPolarHBondContact O-CB 3.15Å; A372-L376 VanDerWaalsContact O-CG 3.23Å; A372-L376 WeakPolarHBondContact O-CG 3.25Å; A372-L376 PolarHBondContact O-N 3.34Å; A372-L474 HydrophobicContact CB-CD1 4.06Å; A372-L474 HydrophobicContact CB-CD2 4.48Å |
| 373 | I | 97.1 | Very high | 95.6 | Very high | 56 Ų | 56 | 35.7 Ų | 35.7 | 29% | 0.287 | 19% | 0.189 | S | C | . | . | H | α-helix | trans | -62.7 | -48.5 | 176.1 | -68.5 | 169.2 | 0 | 0 | 0 | 110.1 | L369 V375 F377 P378 I405 | L369-I373 HydrophobicContact CD1-CD1 3.84Å; L369-I373 HydrophobicContact CD1-CG1 4.25Å; L369-I373 HydrophobicContact CG-CD1 3.89Å; L369-I373 WeakPolarHBondContact O-CG1 3.49Å; L369-I373 PolarHBondContact O-N 3.25Å; I373-V375 PolarHBondContact O-N 3.45Å; I373-F377 HydrophobicContact CG2-CD2 4.08Å; I373-F377 HydrophobicContact CG2-CE2 4.42Å; I373-F377 PolarHBondContact O-N 2.96Å; I373-P378 WeakPolarHBondContact O-CD 3.25Å; I373-I405 HydrophobicContact CG2-CG2 3.8Å; I373-I405 WeakPolarHBondContact O-CG2 3.48Å |
| 374 | G | 95.9 | Very high | 95.5 | Very high | 1 Ų | 1 | 35 Ų | 35 | 1% | 0.01 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -68.1 | -14.5 | -178.4 | 0 | 0 | 0 | 0 | 0 | 114.8 | F370 T371 P378 I405 S406 C409 | F370-G374 PolarHBondContact O-N 2.87Å; T371-G374 PolarHBondContact O-N 3.33Å; G374-P378 WeakPolarHBondContact O-CD 3.19Å; G374-P378 WeakPolarHBondContact O-CG 3.28Å; G374-I405 VanDerWaalsContact CA-O 3.28Å; G374-I405 WeakPolarHBondContact CA-O 3.42Å; G374-S406 WeakPolarHBondContact O-CA 3.47Å; G374-C409 VanDerWaalsContact CA-SG 3.54Å |
| 375 | V | 96.7 | Very high | 95.2 | Very high | 4 Ų | 4 | 33.2 Ų | 33.2 | 2% | 0.024 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -104.9 | -47.4 | 175.2 | 168 | 0 | 0 | 0 | 0 | 112.5 | E304 T371 A372 I373 S379 N470 I471 L474 | E304-V375 HydrophobicContact CG-CG2 4.43Å; T371-V375 HydrophobicContact CG2-CG2 4.36Å; T371-V375 WeakPolarHBondContact O-CB 3.18Å; T371-V375 WeakPolarHBondContact O-CG2 3.28Å; T371-V375 PolarHBondContact O-N 3.35Å; A372-V375 PolarHBondContact O-N 2.94Å; I373-V375 PolarHBondContact O-N 3.45Å; V375-S379 WeakPolarHBondContact O-CB 2.98Å; V375-S379 PolarHBondContact O-N 2.77Å; V375-S379 PolarHBondContact O-OG 3.17Å; V375-N470 HydrophobicContact CG1-CB 3.82Å; V375-I471 HydrophobicContact CG1-CD1 4.12Å; V375-L474 HydrophobicContact CB-CB 4.17Å; V375-L474 HydrophobicContact CB-CD2 4.03Å; V375-L474 HydrophobicContact CB-CG 4.46Å; V375-L474 HydrophobicContact CG1-CB 3.73Å; V375-L474 HydrophobicContact CG1-CD2 3.86Å; V375-L474 HydrophobicContact CG1-CG 4.33Å; V375-L474 HydrophobicContact CG2-CB 4.45Å |
| 376 | L | 96.8 | Very high | 94.6 | Very high | 81 Ų | 81 | 32 Ų | 32 | 42% | 0.424 | 17% | 0.172 | S | C | . | . | H | α-helix | trans | -64.6 | -51.2 | -172.3 | -70.5 | 169.4 | 0 | 0 | 0 | 111.8 | A372 S379 V380 I471 L474 | A372-L376 HydrophobicContact CB-CD1 4.28Å; A372-L376 WeakPolarHBondContact O-CB 3.15Å; A372-L376 VanDerWaalsContact O-CG 3.23Å; A372-L376 WeakPolarHBondContact O-CG 3.25Å; A372-L376 PolarHBondContact O-N 3.34Å; L376-S379 PolarHBondContact O-N 3.22Å; L376-V380 WeakPolarHBondContact O-CG2 3.46Å; L376-V380 PolarHBondContact O-N 2.83Å; L376-I471 HydrophobicContact CD2-CD1 3.59Å; L376-L474 HydrophobicContact CD1-CD2 4.22Å; L376-L474 HydrophobicContact CD2-CD2 3.75Å; L376-L474 HydrophobicContact CG-CD2 3.59Å |
| 377 | F | 95.9 | Very high | 94.1 | Very high | 116 Ų | 116 | 40.7 Ų | 40.7 | 51% | 0.509 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -67.3 | -48.5 | -176.7 | -73.1 | -84.6 | 0 | 0 | 0 | 112 | I373 S379 V380 I381 I405 | I373-F377 HydrophobicContact CG2-CD2 4.08Å; I373-F377 HydrophobicContact CG2-CE2 4.42Å; I373-F377 PolarHBondContact O-N 2.96Å; F377-S379 VanDerWaalsContact C-N 3.28Å; F377-S379 PolarHBondContact O-N 3.04Å; F377-V380 PolarHBondContact O-N 2.97Å; F377-I381 WeakPolarHBondContact O-CB 3.42Å; F377-I381 VanDerWaalsContact O-CG1 3.24Å; F377-I381 WeakPolarHBondContact O-CG1 3.28Å; F377-I381 PolarHBondContact O-N 3.1Å; F377-I405 HydrophobicContact CB-CD1 4.04Å; F377-I405 HydrophobicContact CB-CG2 3.9Å |
| 378 | P | 95.3 | Very high | 93.5 | Very high | 1 Ų | 1 | 39.8 Ų | 39.8 | 1% | 0.006 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -57.9 | -39.6 | 174.7 | -32.5 | 43.8 | 0 | 0 | 0 | 112.9 | I373 G374 I381 L382 S402 I405 | I373-P378 WeakPolarHBondContact O-CD 3.25Å; G374-P378 WeakPolarHBondContact O-CD 3.19Å; G374-P378 WeakPolarHBondContact O-CG 3.28Å; P378-I381 PolarHBondContact O-N 2.86Å; P378-L382 VanDerWaalsContact O-CB 3.3Å; P378-L382 WeakPolarHBondContact O-CB 3.47Å; P378-L382 WeakPolarHBondContact O-CD1 3.27Å; P378-L382 WeakPolarHBondContact O-CG 3.34Å; P378-L382 PolarHBondContact O-N 2.9Å; P378-S402 WeakPolarHBondContact CB-OG 3.13Å; P378-S402 WeakPolarHBondContact CG-O 3.37Å; P378-I405 HydrophobicContact CG-CB 3.96Å; P378-I405 HydrophobicContact CG-CG2 4.06Å |
| 379 | S | 95.4 | Very high | 92.3 | Very high | 5 Ų | 5 | 42 Ų | 42 | 4% | 0.035 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -61.9 | -45.6 | 176.8 | -61.8 | 0 | 0 | 0 | 0 | 112 | V375 L376 F377 V383 | V375-S379 WeakPolarHBondContact O-CB 2.98Å; V375-S379 PolarHBondContact O-N 2.77Å; V375-S379 PolarHBondContact O-OG 3.17Å; L376-S379 PolarHBondContact O-N 3.22Å; F377-S379 VanDerWaalsContact C-N 3.28Å; F377-S379 PolarHBondContact O-N 3.04Å; S379-V383 WeakPolarHBondContact O-CB 3.36Å; S379-V383 VanDerWaalsContact O-CG2 3.26Å; S379-V383 WeakPolarHBondContact O-CG2 3.45Å; S379-V383 PolarHBondContact O-N 3.08Å |
| 380 | V | 95.4 | Very high | 91.3 | Very high | 101 Ų | 101 | 44.4 Ų | 44.4 | 61% | 0.612 | 23% | 0.233 | S | C | * | . | H | α-helix | trans | -63.8 | -44.8 | 176.7 | 172.8 | 0 | 0 | 0 | 0 | 111.1 | L376 F377 V383 S384 | L376-V380 WeakPolarHBondContact O-CG2 3.46Å; L376-V380 PolarHBondContact O-N 2.83Å; F377-V380 PolarHBondContact O-N 2.97Å; V380-V383 PolarHBondContact O-N 3.41Å; V380-S384 WeakPolarHBondContact O-CB 3.39Å; V380-S384 PolarHBondContact O-N 3.1Å; V380-S384 PolarHBondContact O-OG 2.9Å |
| 381 | I | 94.6 | Very high | 90.7 | Very high | 20 Ų | 20 | 46.4 Ų | 46.4 | 10% | 0.103 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -61.6 | -48.2 | 179 | -67.4 | 165.2 | 0 | 0 | 0 | 110.5 | F377 P378 V383 S384 L385 F398 L401 I405 | F377-I381 WeakPolarHBondContact O-CB 3.42Å; F377-I381 VanDerWaalsContact O-CG1 3.24Å; F377-I381 WeakPolarHBondContact O-CG1 3.28Å; F377-I381 PolarHBondContact O-N 3.1Å; P378-I381 PolarHBondContact O-N 2.86Å; I381-V383 PolarHBondContact O-N 3.18Å; I381-S384 WeakPolarHBondContact CA-OG 3.16Å; I381-S384 PolarHBondContact O-N 3.34Å; I381-S384 VanDerWaalsContact O-N 3.14Å; I381-S384 PolarHBondContact O-OG 3.35Å; I381-L385 PolarHBondContact O-N 3.39Å; I381-L385 VanDerWaalsContact O-N 3.15Å; I381-F398 HydrophobicContact CG2-CB 3.72Å; I381-F398 HydrophobicContact CG2-CD2 3.88Å; I381-F398 HydrophobicContact CG2-CG 3.95Å; I381-F398 VanDerWaalsContact CG2-O 3.32Å; I381-F398 WeakPolarHBondContact CG2-O 3.25Å; I381-L401 HydrophobicContact CD1-CB 4.47Å; I381-L401 HydrophobicContact CD1-CD2 3.88Å; I381-L401 HydrophobicContact CD1-CG 3.88Å; I381-I405 HydrophobicContact CD1-CD1 3.96Å |
| 382 | L | 90.4 | Very high | 90.1 | Very high | 1 Ų | 1 | 51.6 Ų | 51.6 | 1% | 0.005 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -63.2 | -42.8 | 179.5 | -71.7 | 168 | 0 | 0 | 0 | 112.2 | L307 P378 S384 L385 S402 F463 | L307-L382 HydrophobicContact CD1-CD1 3.36Å; L307-L382 HydrophobicContact CD2-CD1 3.78Å; L307-L382 HydrophobicContact CG-CD1 4.2Å; P378-L382 VanDerWaalsContact O-CB 3.3Å; P378-L382 WeakPolarHBondContact O-CB 3.47Å; P378-L382 WeakPolarHBondContact O-CD1 3.27Å; P378-L382 WeakPolarHBondContact O-CG 3.34Å; P378-L382 PolarHBondContact O-N 2.9Å; L382-S384 VanDerWaalsContact C-N 3.26Å; L382-S384 PolarHBondContact O-N 3.17Å; L382-L385 HydrophobicContact CD2-CD1 3.7Å; L382-L385 WeakPolarHBondContact O-CB 3.1Å; L382-L385 PolarHBondContact O-N 3.21Å; L382-S402 WeakPolarHBondContact CG-OG 3.48Å; L382-F463 HydrophobicContact CB-CB 4.47Å; L382-F463 HydrophobicContact CB-CD1 4.46Å; L382-F463 HydrophobicContact CD2-CD1 4.13Å; L382-F463 HydrophobicContact CD2-CE1 4.25Å |
| 383 | V | 92.3 | Very high | 89.6 | Confident | 41 Ų | 41 | 54.9 Ų | 54.9 | 25% | 0.248 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -61.2 | -40.9 | 174.9 | 171 | 0 | 0 | 0 | 0 | 109.6 | S379 V380 I381 L385 P386 W387 L464 A467 | S379-V383 WeakPolarHBondContact O-CB 3.36Å; S379-V383 VanDerWaalsContact O-CG2 3.26Å; S379-V383 WeakPolarHBondContact O-CG2 3.45Å; S379-V383 PolarHBondContact O-N 3.08Å; V380-V383 PolarHBondContact O-N 3.41Å; I381-V383 PolarHBondContact O-N 3.18Å; V383-L385 VanDerWaalsContact C-N 3.29Å; V383-L385 PolarHBondContact O-N 3.23Å; V383-P386 WeakPolarHBondContact O-CD 3.36Å; V383-W387 HydrophobicContact CG1-CZ3 4.06Å; V383-W387 VanDerWaalsContact O-CE3 3.29Å; V383-W387 WeakPolarHBondContact O-CZ3 3.4Å; V383-L464 HydrophobicContact CG1-CD2 3.94Å; V383-L464 HydrophobicContact CG2-CD2 4.02Å; V383-A467 HydrophobicContact CG2-CB 3.56Å |
| 384 | S | 90.7 | Very high | 89.2 | Confident | 35 Ų | 35 | 56.1 Ų | 56.1 | 25% | 0.245 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -70.9 | -14.7 | 179.9 | 69.4 | 0 | 0 | 0 | 0 | 115.8 | V380 I381 L382 P386 W387 F398 | V380-S384 WeakPolarHBondContact O-CB 3.39Å; V380-S384 PolarHBondContact O-N 3.1Å; V380-S384 PolarHBondContact O-OG 2.9Å; I381-S384 WeakPolarHBondContact CA-OG 3.16Å; I381-S384 PolarHBondContact O-N 3.34Å; I381-S384 VanDerWaalsContact O-N 3.14Å; I381-S384 PolarHBondContact O-OG 3.35Å; L382-S384 VanDerWaalsContact C-N 3.26Å; L382-S384 PolarHBondContact O-N 3.17Å; S384-P386 VanDerWaalsContact C-CD 3.45Å; S384-W387 PolarHBondContact O-N 3.28Å; S384-W387 VanDerWaalsContact O-N 3.15Å; S384-F398 VanDerWaalsContact OG-CE2 3.3Å; S384-F398 WeakPolarHBondContact OG-CE2 3.27Å |
| 385 | L | 87.4 | Confident | 88.9 | Confident | 0 Ų | 0 | 56.1 Ų | 56.1 | 0% | 0 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -52.7 | -44.2 | -176.6 | -84.4 | 170.7 | 0 | 0 | 0 | 115.3 | I381 L382 V383 W387 V388 R389 T395 F398 L399 F463 | I381-L385 PolarHBondContact O-N 3.39Å; I381-L385 VanDerWaalsContact O-N 3.15Å; L382-L385 HydrophobicContact CD2-CD1 3.7Å; L382-L385 WeakPolarHBondContact O-CB 3.1Å; L382-L385 PolarHBondContact O-N 3.21Å; V383-L385 VanDerWaalsContact C-N 3.29Å; V383-L385 PolarHBondContact O-N 3.23Å; L385-W387 PolarHBondContact O-N 3.06Å; L385-V388 PolarHBondContact O-N 2.79Å; L385-R389 PolarHBondContact O-N 2.98Å; L385-T395 HydrophobicContact CD2-CG2 4.09Å; L385-F398 HydrophobicContact CD2-CB 3.56Å; L385-F398 HydrophobicContact CD2-CD2 4.34Å; L385-F398 HydrophobicContact CD2-CG 4.41Å; L385-F398 HydrophobicContact CG-CB 4.4Å; L385-L399 HydrophobicContact CD1-CD2 3.84Å; L385-L399 HydrophobicContact CD1-CG 4.48Å; L385-L399 HydrophobicContact CD2-CG 4.39Å; L385-F463 HydrophobicContact CB-CD2 4.29Å; L385-F463 HydrophobicContact CB-CE2 4.14Å; L385-F463 HydrophobicContact CD1-CD1 4.49Å; L385-F463 HydrophobicContact CD1-CD2 4.4Å; L385-F463 HydrophobicContact CD1-CE1 4.09Å; L385-F463 HydrophobicContact CD1-CE2 3.98Å; L385-F463 HydrophobicContact CD1-CZ 3.82Å |
| 386 | P | 84.7 | Confident | 88.6 | Confident | 40 Ų | 40 | 56.9 Ų | 56.9 | 26% | 0.26 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -59.6 | -31.2 | -179.1 | -24.7 | 36.9 | 0 | 0 | 0 | 113.3 | V383 S384 V388 R460 F463 | V383-P386 WeakPolarHBondContact O-CD 3.36Å; S384-P386 VanDerWaalsContact C-CD 3.45Å; P386-V388 VanDerWaalsContact C-N 3.33Å; P386-R460 HydrophobicContact CG-CB 4.03Å; P386-R460 HydrophobicContact CG-CG 4.08Å; P386-F463 HydrophobicContact CG-CD2 4.31Å |
| 387 | W | 85.1 | Confident | 88.4 | Confident | 183 Ų | 183 | 56.8 Ų | 56.8 | 69% | 0.693 | 31% | 0.306 | S | S | * | . | H | α-helix | trans | -79.2 | -17.5 | 179.2 | -69.6 | -85.3 | 0 | 0 | 0 | 113.5 | V383 S384 L385 | V383-W387 HydrophobicContact CG1-CZ3 4.06Å; V383-W387 VanDerWaalsContact O-CE3 3.29Å; V383-W387 WeakPolarHBondContact O-CZ3 3.4Å; S384-W387 PolarHBondContact O-N 3.28Å; S384-W387 VanDerWaalsContact O-N 3.15Å; L385-W387 PolarHBondContact O-N 3.06Å |
| 388 | V | 83.2 | Confident | 88.2 | Confident | 15 Ų | 15 | 53.5 Ų | 53.5 | 9% | 0.091 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -98.5 | -4.3 | -176.6 | 161.3 | 0 | 0 | 0 | 0 | 112.5 | L385 P386 S390 S391 M394 F398 | L385-V388 PolarHBondContact O-N 2.79Å; P386-V388 VanDerWaalsContact C-N 3.33Å; V388-S390 PolarHBondContact O-N 3.06Å; V388-S391 PolarHBondContact O-N 2.96Å; V388-M394 HydrophobicContact CB-CE 3.84Å; V388-M394 HydrophobicContact CG1-CB 3.64Å; V388-M394 HydrophobicContact CG1-CE 3.47Å; V388-M394 VanDerWaalsContact CG1-CE 3.47Å; V388-M394 HydrophobicContact CG1-CG 3.42Å; V388-M394 VanDerWaalsContact CG1-CG 3.42Å; V388-M394 HydrophobicContact CG1-SD 4.13Å; V388-M394 HydrophobicContact CG2-CE 3.78Å; V388-F398 HydrophobicContact CB-CD2 4.43Å; V388-F398 HydrophobicContact CB-CE2 4.26Å; V388-F398 HydrophobicContact CG1-CD2 4.23Å; V388-F398 HydrophobicContact CG1-CE2 4.26Å; V388-F398 HydrophobicContact CG1-CG 4.41Å; V388-F398 HydrophobicContact CG1-CZ 4.46Å; V388-F398 HydrophobicContact CG2-CD2 4.16Å; V388-F398 HydrophobicContact CG2-CE2 3.52Å; V388-F398 HydrophobicContact CG2-CZ 3.88Å |
| 389 | R | 72.3 | Confident | 88.1 | Confident | 88 Ų | 88 | 53.8 Ų | 53.8 | 33% | 0.332 | 29% | 0.293 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -54.5 | -24.3 | -174.5 | -173.7 | 177.8 | 174.5 | 142.9 | 3.6 | 114.9 | V322 L385 S391 | V322-R389 HydrophobicContact CG1-CG 3.93Å; V322-R389 PolarHBondContact O-NH2 3.38Å; L385-R389 PolarHBondContact O-N 2.98Å; R389-S391 PolarHBondContact O-N 3.29Å; R389-S391 VanDerWaalsContact O-N 3.14Å |
| 390 | S | 76.3 | Confident | 88 | Confident | 122 Ų | 122 | 55 Ų | 55 | 85% | 0.853 | 30% | 0.3 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.4 | -17.5 | -179.8 | -174 | 0 | 0 | 0 | 0 | 114.1 | V388 | V388-S390 PolarHBondContact O-N 3.06Š|
| 391 | S | 85.4 | Confident | 88 | Confident | 48 Ų | 48 | 53.9 Ų | 53.9 | 34% | 0.336 | 29% | 0.29 | S | S | . | . | trans | -124.7 | 120 | 177.7 | 175 | 0 | 0 | 0 | 0 | 111.2 | V388 R389 S393 M394 T395 | V388-S391 PolarHBondContact O-N 2.96Å; R389-S391 PolarHBondContact O-N 3.29Å; R389-S391 VanDerWaalsContact O-N 3.14Å; S391-S393 VanDerWaalsContact C-N 3.32Å; S391-S393 PolarHBondContact O-N 3.41Å; S391-M394 PolarHBondContact O-N 2.93Å; S391-M394 PolarHBondContact OG-N 3.08Å; S391-T395 PolarHBondContact O-N 3.39Å; S391-T395 PolarHBondContact O-OG1 3.39Å | ||
| 392 | H | 83.5 | Confident | 88 | Confident | 110 Ų | 110 | 52.9 Ų | 52.9 | 51% | 0.509 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -58.3 | -44.4 | 177.3 | -65.4 | 64.1 | 0 | 0 | 0 | 112.5 | L323 M394 T395 M396 | L323-H392 HydrophobicContact CD2-CB 3.9Å; L323-H392 PolarHBondContact O-CD2 3.25Å; L323-H392 VanDerWaalsContact O-CD2 3.23Å; L323-H392 PolarHBondContact O-NE2 2.82Å; H392-M394 PolarHBondContact O-N 3.38Å; H392-T395 PolarHBondContact O-N 3.43Å; H392-M396 WeakPolarHBondContact O-CG 3.34Å; H392-M396 PolarHBondContact O-N 2.94Å |
| 393 | S | 87 | Confident | 88.2 | Confident | 85 Ų | 85 | 53.6 Ų | 53.6 | 59% | 0.594 | 29% | 0.29 | S | S | * | . | H | α-helix | trans | -63.3 | -41.8 | -179.9 | -177.2 | 0 | 0 | 0 | 0 | 112 | S391 M396 T397 | S391-S393 VanDerWaalsContact C-N 3.32Å; S391-S393 PolarHBondContact O-N 3.41Å; S393-M396 PolarHBondContact O-N 2.96Å; S393-T397 WeakPolarHBondContact O-CB 3.45Å; S393-T397 PolarHBondContact O-N 2.9Å; S393-T397 PolarHBondContact O-OG1 3.06Å |
| 394 | M | 88.9 | Confident | 88.3 | Confident | 82 Ų | 82 | 52.1 Ų | 52.1 | 40% | 0.404 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -70.1 | -40.8 | -179.1 | -159 | 164.7 | 64.3 | 0 | 0 | 111.5 | V388 S391 H392 M396 T397 F398 | V388-M394 HydrophobicContact CB-CE 3.84Å; V388-M394 HydrophobicContact CG1-CB 3.64Å; V388-M394 HydrophobicContact CG1-CE 3.47Å; V388-M394 VanDerWaalsContact CG1-CE 3.47Å; V388-M394 HydrophobicContact CG1-CG 3.42Å; V388-M394 VanDerWaalsContact CG1-CG 3.42Å; V388-M394 HydrophobicContact CG1-SD 4.13Å; V388-M394 HydrophobicContact CG2-CE 3.78Å; S391-M394 PolarHBondContact O-N 2.93Å; S391-M394 PolarHBondContact OG-N 3.08Å; H392-M394 PolarHBondContact O-N 3.38Å; M394-M396 PolarHBondContact O-N 2.94Å; M394-T397 PolarHBondContact O-N 3.5Å; M394-F398 HydrophobicContact CG-CD1 4.34Å; M394-F398 HydrophobicContact CG-CE1 3.96Å; M394-F398 WeakPolarHBondContact O-CD1 3.25Å; M394-F398 PolarHBondContact O-N 2.92Å |
| 395 | T | 89.1 | Confident | 88.6 | Confident | 0 Ų | 0 | 51.8 Ų | 51.8 | 0% | 0 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -60 | -45.2 | 174.4 | -57.9 | 0 | 0 | 0 | 0 | 111.6 | Y318 L323 L385 S391 H392 F398 L399 | Y318-T395 HydrophobicContact CE1-CG2 3.76Å; L323-T395 HydrophobicContact CD1-CG2 4.01Å; L323-T395 HydrophobicContact CD2-CG2 4.17Å; L323-T395 HydrophobicContact CG-CG2 4.37Å; L385-T395 HydrophobicContact CD2-CG2 4.09Å; S391-T395 PolarHBondContact O-N 3.39Å; S391-T395 PolarHBondContact O-OG1 3.39Å; H392-T395 PolarHBondContact O-N 3.43Å; T395-F398 PolarHBondContact O-N 2.94Å; T395-L399 HydrophobicContact CG2-CD1 4.44Å; T395-L399 WeakPolarHBondContact O-CG 3.35Å; T395-L399 PolarHBondContact O-N 2.96Å |
| 396 | M | 90.8 | Very high | 88.9 | Confident | 20 Ų | 20 | 53.3 Ų | 53.3 | 10% | 0.099 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -63.9 | -43.3 | 176.6 | -77.2 | -67.1 | 167.5 | 0 | 0 | 112.5 | I319 L323 L333 H392 S393 M394 F398 L399 V400 | I319-M396 HydrophobicContact CB-CE 4.05Å; I319-M396 HydrophobicContact CD1-CE 3.5Å; I319-M396 VanDerWaalsContact CD1-CE 3.5Å; I319-M396 HydrophobicContact CD1-SD 4.18Å; I319-M396 HydrophobicContact CG1-CE 3.41Å; I319-M396 VanDerWaalsContact CG1-CE 3.41Å; I319-M396 HydrophobicContact CG2-CE 3.48Å; I319-M396 VanDerWaalsContact CG2-CE 3.48Å; L323-M396 HydrophobicContact CD1-CE 3.33Å; L333-M396 HydrophobicContact CB-CE 3.64Å; L333-M396 HydrophobicContact CB-SD 3.91Å; L333-M396 HydrophobicContact CD1-CE 3.67Å; L333-M396 HydrophobicContact CD1-SD 4.48Å; L333-M396 HydrophobicContact CD2-CE 4.46Å; L333-M396 HydrophobicContact CD2-CG 4.48Å; L333-M396 HydrophobicContact CD2-SD 4.24Å; L333-M396 HydrophobicContact CG-CE 4.12Å; L333-M396 HydrophobicContact CG-SD 4.44Å; H392-M396 WeakPolarHBondContact O-CG 3.34Å; H392-M396 PolarHBondContact O-N 2.94Å; S393-M396 PolarHBondContact O-N 2.96Å; M394-M396 PolarHBondContact O-N 2.94Å; M396-F398 VanDerWaalsContact C-N 3.25Å; M396-F398 PolarHBondContact O-N 2.83Å; M396-L399 PolarHBondContact O-N 2.58Å; M396-V400 WeakPolarHBondContact O-CB 3.41Å; M396-V400 WeakPolarHBondContact O-CG2 3.08Å; M396-V400 PolarHBondContact O-N 3.42Å |
| 397 | T | 92.2 | Very high | 89.4 | Confident | 79 Ų | 79 | 52.1 Ų | 52.1 | 49% | 0.485 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -59.8 | -40.8 | 177.4 | -60.8 | 0 | 0 | 0 | 0 | 110.5 | S393 M394 L401 | S393-T397 WeakPolarHBondContact O-CB 3.45Å; S393-T397 PolarHBondContact O-N 2.9Å; S393-T397 PolarHBondContact O-OG1 3.06Å; M394-T397 PolarHBondContact O-N 3.5Å; T397-L401 WeakPolarHBondContact O-CB 3.39Å; T397-L401 PolarHBondContact O-N 2.97Å |
| 398 | F | 93.4 | Very high | 89.8 | Confident | 48 Ų | 48 | 45.5 Ų | 45.5 | 21% | 0.211 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -68.1 | -41.9 | 178.4 | -81.7 | 35.8 | 0 | 0 | 0 | 112 | I381 S384 L385 V388 M394 T395 M396 L401 S402 | I381-F398 HydrophobicContact CG2-CB 3.72Å; I381-F398 HydrophobicContact CG2-CD2 3.88Å; I381-F398 HydrophobicContact CG2-CG 3.95Å; I381-F398 VanDerWaalsContact CG2-O 3.32Å; I381-F398 WeakPolarHBondContact CG2-O 3.25Å; S384-F398 VanDerWaalsContact OG-CE2 3.3Å; S384-F398 WeakPolarHBondContact OG-CE2 3.27Å; L385-F398 HydrophobicContact CD2-CB 3.56Å; L385-F398 HydrophobicContact CD2-CD2 4.34Å; L385-F398 HydrophobicContact CD2-CG 4.41Å; L385-F398 HydrophobicContact CG-CB 4.4Å; V388-F398 HydrophobicContact CB-CD2 4.43Å; V388-F398 HydrophobicContact CB-CE2 4.26Å; V388-F398 HydrophobicContact CG1-CD2 4.23Å; V388-F398 HydrophobicContact CG1-CE2 4.26Å; V388-F398 HydrophobicContact CG1-CG 4.41Å; V388-F398 HydrophobicContact CG1-CZ 4.46Å; V388-F398 HydrophobicContact CG2-CD2 4.16Å; V388-F398 HydrophobicContact CG2-CE2 3.52Å; V388-F398 HydrophobicContact CG2-CZ 3.88Å; M394-F398 HydrophobicContact CG-CD1 4.34Å; M394-F398 HydrophobicContact CG-CE1 3.96Å; M394-F398 WeakPolarHBondContact O-CD1 3.25Å; M394-F398 PolarHBondContact O-N 2.92Å; T395-F398 PolarHBondContact O-N 2.94Å; M396-F398 VanDerWaalsContact C-N 3.25Å; M396-F398 PolarHBondContact O-N 2.83Å; F398-L401 PolarHBondContact O-N 3.34Å; F398-S402 WeakPolarHBondContact O-CB 3.33Å; F398-S402 PolarHBondContact O-N 2.83Å |
| 399 | L | 92 | Very high | 90.3 | Very high | 7 Ų | 7 | 44.9 Ų | 44.9 | 4% | 0.037 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -62.6 | -44.6 | 175.8 | -74.2 | 172.2 | 0 | 0 | 0 | 112.4 | Y318 P337 L385 T395 M396 S403 | Y318-L399 HydrophobicContact CD1-CD1 4.05Å; Y318-L399 HydrophobicContact CE1-CD1 4.14Å; P337-L399 HydrophobicContact CG-CB 4.44Å; L385-L399 HydrophobicContact CD1-CD2 3.84Å; L385-L399 HydrophobicContact CD1-CG 4.48Å; L385-L399 HydrophobicContact CD2-CG 4.39Å; T395-L399 HydrophobicContact CG2-CD1 4.44Å; T395-L399 WeakPolarHBondContact O-CG 3.35Å; T395-L399 PolarHBondContact O-N 2.96Å; M396-L399 PolarHBondContact O-N 2.58Å; L399-S403 PolarHBondContact O-N 3.31Å; L399-S403 VanDerWaalsContact O-N 3.12Å; L399-S403 PolarHBondContact O-OG 3.41Å |
| 400 | V | 94.1 | Very high | 91.2 | Very high | 29 Ų | 29 | 43.8 Ų | 43.8 | 18% | 0.176 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -65.6 | -47.5 | 177.3 | 173.2 | 0 | 0 | 0 | 0 | 110.6 | L336 P337 V340 M396 S402 S403 A404 | L336-V400 HydrophobicContact CB-CG2 3.95Å; P337-V400 HydrophobicContact CG-CG2 3.98Å; V340-V400 HydrophobicContact CB-CG1 3.89Å; V340-V400 HydrophobicContact CG1-CG1 3.94Å; V340-V400 HydrophobicContact CG2-CG1 3.77Å; M396-V400 WeakPolarHBondContact O-CB 3.41Å; M396-V400 WeakPolarHBondContact O-CG2 3.08Å; M396-V400 PolarHBondContact O-N 3.42Å; V400-S402 PolarHBondContact O-N 3.46Å; V400-S403 PolarHBondContact O-N 3.21Å; V400-A404 VanDerWaalsContact O-CB 3.27Å; V400-A404 WeakPolarHBondContact O-CB 3.36Å; V400-A404 PolarHBondContact O-N 3.4Å |
| 401 | L | 95.4 | Very high | 92 | Very high | 78 Ų | 78 | 38.4 Ų | 38.4 | 41% | 0.408 | 21% | 0.214 | S | C | . | . | H | α-helix | trans | -64.1 | -41 | -179.8 | -174.9 | 63.4 | 0 | 0 | 0 | 112 | I381 T397 F398 A404 I405 | I381-L401 HydrophobicContact CD1-CB 4.47Å; I381-L401 HydrophobicContact CD1-CD2 3.88Å; I381-L401 HydrophobicContact CD1-CG 3.88Å; T397-L401 WeakPolarHBondContact O-CB 3.39Å; T397-L401 PolarHBondContact O-N 2.97Å; F398-L401 PolarHBondContact O-N 3.34Å; L401-A404 PolarHBondContact O-N 3.02Å; L401-I405 HydrophobicContact CD1-CD1 3.82Å; L401-I405 HydrophobicContact CD1-CG1 4.19Å; L401-I405 HydrophobicContact CG-CD1 3.83Å; L401-I405 VanDerWaalsContact O-CG1 3.31Å; L401-I405 WeakPolarHBondContact O-CG1 3.39Å; L401-I405 PolarHBondContact O-N 3.25Å |
| 402 | S | 94.8 | Very high | 92.4 | Very high | 0 Ų | 0 | 36.1 Ų | 36.1 | 0% | 0 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -59.1 | -48.2 | 174.9 | -179.6 | 0 | 0 | 0 | 0 | 111.3 | P378 L382 F398 V400 I405 S406 | P378-S402 WeakPolarHBondContact CB-OG 3.13Å; P378-S402 WeakPolarHBondContact CG-O 3.37Å; L382-S402 WeakPolarHBondContact CG-OG 3.48Å; F398-S402 WeakPolarHBondContact O-CB 3.33Å; F398-S402 PolarHBondContact O-N 2.83Å; V400-S402 PolarHBondContact O-N 3.46Å; S402-I405 PolarHBondContact O-N 2.99Å; S402-S406 VanDerWaalsContact O-CB 3.24Å; S402-S406 WeakPolarHBondContact O-CB 3.15Å; S402-S406 PolarHBondContact O-N 2.96Å |
| 403 | S | 92.9 | Very high | 92.8 | Very high | 16 Ų | 16 | 31 Ų | 31 | 11% | 0.112 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -67.1 | -39 | 179 | -56.3 | 0 | 0 | 0 | 0 | 112.5 | P337 L399 V400 S406 S407 | P337-S403 WeakPolarHBondContact CB-OG 3.48Å; P337-S403 WeakPolarHBondContact O-CB 3.13Å; L399-S403 PolarHBondContact O-N 3.31Å; L399-S403 VanDerWaalsContact O-N 3.12Å; L399-S403 PolarHBondContact O-OG 3.41Å; V400-S403 PolarHBondContact O-N 3.21Å; S403-S406 PolarHBondContact O-N 3.01Å; S403-S407 PolarHBondContact O-N 3.26Å; S403-S407 PolarHBondContact O-OG 3.31Å |
| 404 | A | 95.7 | Very high | 93 | Very high | 9 Ų | 9 | 27.3 Ų | 27.3 | 7% | 0.074 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -60.2 | -48.3 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | V340 C344 V400 L401 S407 | V340-A404 HydrophobicContact CG1-CB 3.77Å; C344-A404 VanDerWaalsContact CB-O 3.25Å; C344-A404 WeakPolarHBondContact CB-O 3.17Å; V400-A404 VanDerWaalsContact O-CB 3.27Å; V400-A404 WeakPolarHBondContact O-CB 3.36Å; V400-A404 PolarHBondContact O-N 3.4Å; L401-A404 PolarHBondContact O-N 3.02Å; A404-S407 WeakPolarHBondContact O-CB 3.46Å; A404-S407 PolarHBondContact O-N 2.99Å |
| 405 | I | 96.1 | Very high | 93.2 | Very high | 29 Ų | 29 | 25.2 Ų | 25.2 | 15% | 0.149 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -74.1 | -36.6 | -179.4 | -58.9 | 167.2 | 0 | 0 | 0 | 110.8 | I373 G374 F377 P378 I381 L401 S402 S407 F408 | I373-I405 HydrophobicContact CG2-CG2 3.8Å; I373-I405 WeakPolarHBondContact O-CG2 3.48Å; G374-I405 VanDerWaalsContact CA-O 3.28Å; G374-I405 WeakPolarHBondContact CA-O 3.42Å; F377-I405 HydrophobicContact CB-CD1 4.04Å; F377-I405 HydrophobicContact CB-CG2 3.9Å; P378-I405 HydrophobicContact CG-CB 3.96Å; P378-I405 HydrophobicContact CG-CG2 4.06Å; I381-I405 HydrophobicContact CD1-CD1 3.96Å; L401-I405 HydrophobicContact CD1-CD1 3.82Å; L401-I405 HydrophobicContact CD1-CG1 4.19Å; L401-I405 HydrophobicContact CG-CD1 3.83Å; L401-I405 VanDerWaalsContact O-CG1 3.31Å; L401-I405 WeakPolarHBondContact O-CG1 3.39Å; L401-I405 PolarHBondContact O-N 3.25Å; S402-I405 PolarHBondContact O-N 2.99Å; I405-S407 PolarHBondContact O-N 3.49Å; I405-S407 VanDerWaalsContact O-N 3.15Å; I405-F408 WeakPolarHBondContact O-CB 3.24Å; I405-F408 WeakPolarHBondContact O-CD2 3.5Å; I405-F408 PolarHBondContact O-N 2.91Å; I405-F408 VanDerWaalsContact O-N 3.12Å |
| 406 | S | 95.1 | Very high | 93.5 | Very high | 31 Ų | 31 | 25.2 Ų | 25.2 | 22% | 0.217 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -59.8 | -27.9 | 176.8 | -172.3 | 0 | 0 | 0 | 0 | 112.9 | G374 S402 S403 F408 C409 | G374-S406 WeakPolarHBondContact O-CA 3.47Å; S402-S406 VanDerWaalsContact O-CB 3.24Å; S402-S406 WeakPolarHBondContact O-CB 3.15Å; S402-S406 PolarHBondContact O-N 2.96Å; S403-S406 PolarHBondContact O-N 3.01Å; S406-F408 PolarHBondContact O-N 2.8Å; S406-C409 WeakPolarHBondContact O-CB 3.47Å; S406-C409 PolarHBondContact O-N 3.45Å; S406-C409 VanDerWaalsContact O-N 3.15Å |
| 407 | S | 93.8 | Very high | 93.6 | Very high | 15 Ų | 15 | 25 Ų | 25 | 11% | 0.105 | 14% | 0.138 | C | C | . | . | G | 310 helix | trans | -64 | -19.8 | 178.9 | -64.7 | 0 | 0 | 0 | 0 | 113.9 | G341 S403 A404 I405 C409 E410 | G341-S407 VanDerWaalsContact C-OG 3.27Å; G341-S407 WeakPolarHBondContact CA-OG 3.39Å; G341-S407 WeakPolarHBondContact O-CB 3.4Å; G341-S407 PolarHBondContact O-OG 2.96Å; S403-S407 PolarHBondContact O-N 3.26Å; S403-S407 PolarHBondContact O-OG 3.31Å; A404-S407 WeakPolarHBondContact O-CB 3.46Å; A404-S407 PolarHBondContact O-N 2.99Å; I405-S407 PolarHBondContact O-N 3.49Å; I405-S407 VanDerWaalsContact O-N 3.15Å; S407-C409 PolarHBondContact O-N 3.38Å; S407-E410 WeakPolarHBondContact O-CB 3.35Å; S407-E410 PolarHBondContact O-N 3.08Å |
| 408 | F | 93.7 | Very high | 93.4 | Very high | 44 Ų | 44 | 25 Ų | 25 | 19% | 0.193 | 14% | 0.135 | C | C | . | . | G | 310 helix | trans | -65.7 | -22.3 | 175.2 | -75.7 | -95.2 | 0 | 0 | 0 | 112.8 | L351 F370 I405 S406 E410 S411 G412 | L351-F408 HydrophobicContact CD2-CE1 4.32Å; F370-F408 HydrophobicContact CD1-CB 4.21Å; F370-F408 AromaticContact CD1-CD1 3.73Å; F370-F408 HydrophobicContact CD1-CD1 3.73Å; F370-F408 HydrophobicContact CD1-CG 4.48Å; F370-F408 AromaticContact CE1-CD1 3.71Å; F370-F408 HydrophobicContact CE1-CD1 3.71Å; F370-F408 HydrophobicContact CE1-CE1 4.29Å; I405-F408 WeakPolarHBondContact O-CB 3.24Å; I405-F408 WeakPolarHBondContact O-CD2 3.5Å; I405-F408 PolarHBondContact O-N 2.91Å; I405-F408 VanDerWaalsContact O-N 3.12Å; S406-F408 PolarHBondContact O-N 2.8Å; F408-E410 PolarHBondContact O-N 3.35Å; F408-S411 PolarHBondContact O-N 3.08Å; F408-S411 VanDerWaalsContact O-N 3.07Å; F408-G412 PolarHBondContact O-N 2.88Å |
| 409 | C | 94.1 | Very high | 93.3 | Very high | 2 Ų | 2 | 24 Ų | 24 | 1% | 0.014 | 13% | 0.132 | C | C | . | . | G | 310 helix | trans | -61.1 | -26.4 | 175.4 | -72.3 | 0 | 0 | 0 | 0 | 113.5 | E304 G374 S406 S407 S411 G412 A413 L414 | E304-C409 VanDerWaalsContact CD-CB 3.48Å; E304-C409 HydrophobicContact CG-CB 4.48Å; E304-C409 PolarHBondContact OE1-SG 2.88Å; E304-C409 WeakPolarHBondContact OE2-CB 3.29Å; G374-C409 VanDerWaalsContact CA-SG 3.54Å; S406-C409 WeakPolarHBondContact O-CB 3.47Å; S406-C409 PolarHBondContact O-N 3.45Å; S406-C409 VanDerWaalsContact O-N 3.15Å; S407-C409 PolarHBondContact O-N 3.38Å; C409-S411 PolarHBondContact O-N 3.35Å; C409-G412 CarbonylContact O-C 3.34Å; C409-G412 WeakPolarHBondContact O-CA 3.37Å; C409-G412 PolarHBondContact O-N 3.5Å; C409-A413 PolarHBondContact O-N 3.47Å; C409-L414 PolarHBondContact O-N 3.45Å |
| 410 | E | 91.4 | Very high | 93.3 | Very high | 65 Ų | 65 | 23.7 Ų | 23.7 | 30% | 0.304 | 13% | 0.13 | S | C | . | . | G | 310 helix | trans | -60.1 | -33.9 | 174.3 | -71.4 | -70.5 | 176.5 | 0 | 0 | 112.1 | I345 S407 F408 G412 L414 V415 | I345-E410 HydrophobicContact CD1-CG 3.99Å; I345-E410 HydrophobicContact CG1-CB 4.43Å; I345-E410 HydrophobicContact CG1-CG 3.99Å; I345-E410 HydrophobicContact CG2-CB 3.97Å; I345-E410 HydrophobicContact CG2-CG 4.18Å; S407-E410 WeakPolarHBondContact O-CB 3.35Å; S407-E410 PolarHBondContact O-N 3.08Å; F408-E410 PolarHBondContact O-N 3.35Å; E410-G412 VanDerWaalsContact C-N 3.35Å; E410-L414 HydrophobicContact CG-CD1 3.97Å; E410-L414 WeakPolarHBondContact OE1-CD1 3.37Å; E410-L414 WeakPolarHBondContact OE2-CD1 3.25Å; E410-V415 WeakPolarHBondContact O-CG1 3.24Å; E410-V415 VanDerWaalsContact O-CG2 3.28Å; E410-V415 WeakPolarHBondContact O-CG2 3.48Å |
| 411 | S | 92.2 | Very high | 93.1 | Very high | 10 Ų | 10 | 22.3 Ų | 22.3 | 7% | 0.07 | 12% | 0.122 | C | C | . | . | G | 310 helix | trans | -87.9 | -7.4 | 173.9 | -58.2 | 0 | 0 | 0 | 0 | 113.1 | G348 G349 R367 F408 C409 | G348-S411 VanDerWaalsContact C-OG 3.25Å; G349-S411 VanDerWaalsContact CA-OG 3.28Å; G349-S411 WeakPolarHBondContact CA-OG 3.27Å; G349-S411 PolarHBondContact N-OG 3.3Å; R367-S411 PolarHBondContact NH1-O 3.12Å; F408-S411 PolarHBondContact O-N 3.08Å; F408-S411 VanDerWaalsContact O-N 3.07Å; C409-S411 PolarHBondContact O-N 3.35Å |
| 412 | G | 93.7 | Very high | 92.5 | Very high | 0 Ų | 0 | 21.9 Ų | 21.9 | 0% | 0 | 12% | 0.123 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -95.6 | -112.1 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | R367 F408 C409 E410 L414 V415 | R367-G412 WeakPolarHBondContact CD-O 3.33Å; R367-G412 WeakPolarHBondContact O-CA 3.38Å; F408-G412 PolarHBondContact O-N 2.88Å; C409-G412 CarbonylContact O-C 3.34Å; C409-G412 WeakPolarHBondContact O-CA 3.37Å; C409-G412 PolarHBondContact O-N 3.5Å; E410-G412 VanDerWaalsContact C-N 3.35Å; G412-L414 PolarHBondContact O-N 2.8Å; G412-V415 WeakPolarHBondContact O-CG2 3.41Å |
| 413 | A | 92.4 | Very high | 91.9 | Very high | 1 Ų | 1 | 26.3 Ų | 26.3 | 1% | 0.008 | 14% | 0.14 | C | C | . | . | G | 310 helix | trans | -69.2 | -32.6 | -171.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | S300 T371 C409 V415 N416 Y477 | S300-A413 WeakPolarHBondContact OG-CB 3.41Å; T371-A413 HydrophobicContact CG2-CB 4.02Å; T371-A413 WeakPolarHBondContact OG1-CB 3.43Å; T371-A413 PolarHBondContact OG1-N 2.91Å; C409-A413 PolarHBondContact O-N 3.47Å; A413-V415 PolarHBondContact O-N 3.46Å; A413-N416 WeakPolarHBondContact O-CB 3.3Å; A413-N416 PolarHBondContact O-N 3.18Å; A413-N416 VanDerWaalsContact O-N 3.13Å; A413-Y477 WeakPolarHBondContact CA-OH 3.31Å; A413-Y477 HydrophobicContact CB-CD1 4.25Å; A413-Y477 HydrophobicContact CB-CD2 4.12Å; A413-Y477 HydrophobicContact CB-CE1 3.83Å; A413-Y477 HydrophobicContact CB-CE2 3.73Å; A413-Y477 HydrophobicContact CB-CG 4.37Å |
| 414 | L | 91.9 | Very high | 91.4 | Very high | 8 Ų | 8 | 27.2 Ų | 27.2 | 4% | 0.042 | 14% | 0.142 | C | C | . | . | G | 310 helix | trans | -69.1 | -20.5 | -171.4 | -59.9 | -178.4 | 0 | 0 | 0 | 114 | Y301 E304 Y305 C409 E410 G412 F417 | Y301-L414 HydrophobicContact CD2-CD2 3.2Å; Y301-L414 HydrophobicContact CD2-CG 4.46Å; Y301-L414 HydrophobicContact CE2-CB 4.18Å; Y301-L414 HydrophobicContact CE2-CD2 3.42Å; Y301-L414 VanDerWaalsContact CE2-CD2 3.42Å; Y301-L414 HydrophobicContact CE2-CG 4.37Å; Y301-L414 HydrophobicContact CG-CD2 3.89Å; E304-L414 VanDerWaalsContact OE2-CD1 3.28Å; E304-L414 WeakPolarHBondContact OE2-CD1 3.46Å; E304-L414 WeakPolarHBondContact OE2-CD2 3.45Å; E304-L414 WeakPolarHBondContact OE2-CG 3.26Å; Y305-L414 HydrophobicContact CE2-CD1 4.47Å; Y305-L414 HydrophobicContact CE2-CD2 4.1Å; C409-L414 PolarHBondContact O-N 3.45Å; E410-L414 HydrophobicContact CG-CD1 3.97Å; E410-L414 WeakPolarHBondContact OE1-CD1 3.37Å; E410-L414 WeakPolarHBondContact OE2-CD1 3.25Å; G412-L414 PolarHBondContact O-N 2.8Å; L414-F417 WeakPolarHBondContact O-CD1 3.32Å; L414-F417 VanDerWaalsContact O-CE1 3.23Å; L414-F417 WeakPolarHBondContact O-CE1 3.36Å |
| 415 | V | 93.1 | Very high | 90.7 | Very high | 38 Ų | 38 | 28.7 Ų | 28.7 | 23% | 0.23 | 15% | 0.15 | C | C | . | . | G | 310 helix | trans | -102.8 | -8.6 | 175.2 | -73 | 0 | 0 | 0 | 0 | 113.4 | R367 E410 G412 A413 F417 L418 | R367-V415 VanDerWaalsContact CZ-CG2 3.43Å; E410-V415 WeakPolarHBondContact O-CG1 3.24Å; E410-V415 VanDerWaalsContact O-CG2 3.28Å; E410-V415 WeakPolarHBondContact O-CG2 3.48Å; G412-V415 WeakPolarHBondContact O-CG2 3.41Å; A413-V415 PolarHBondContact O-N 3.46Å; V415-F417 PolarHBondContact O-N 3.42Å; V415-F417 VanDerWaalsContact O-N 3.11Å; V415-L418 WeakPolarHBondContact O-CB 3.35Å; V415-L418 WeakPolarHBondContact O-CG 3.25Å; V415-L418 PolarHBondContact O-N 2.93Å |
| 416 | N | 94.6 | Very high | 89.9 | Confident | 0 Ų | 0 | 30.1 Ų | 30.1 | 0% | 0 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -64.9 | -19.6 | -175 | -170 | 16.1 | 0 | 0 | 0 | 113.3 | I297 A413 L418 D419 I420 Y477 R482 | I297-N416 HydrophobicContact CD1-CB 3.98Å; I297-N416 HydrophobicContact CG1-CB 4.18Å; A413-N416 WeakPolarHBondContact O-CB 3.3Å; A413-N416 PolarHBondContact O-N 3.18Å; A413-N416 VanDerWaalsContact O-N 3.13Å; N416-L418 PolarHBondContact O-N 2.97Å; N416-D419 PolarHBondContact O-N 3.15Å; N416-D419 PolarHBondContact OD1-OD2 2.79Å; N416-I420 PolarHBondContact O-N 3.47Å; N416-I420 VanDerWaalsContact O-N 3.15Å; N416-Y477 PolarHBondContact ND2-OH 2.69Å; N416-R482 PolarHBondContact ND2-O 2.96Å; N416-R482 PolarHBondContact OD1-O 3.49Å; N416-R482 VanDerWaalsContact OD1-O 3.06Å |
| 417 | F | 92.5 | Very high | 89.4 | Confident | 17 Ų | 17 | 32 Ų | 32 | 8% | 0.075 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -60.8 | -27.7 | 173.5 | 76.6 | -83.2 | 0 | 0 | 0 | 113 | I297 L414 V415 D419 A421 T425 L428 K429 L432 | I297-F417 HydrophobicContact CG2-CB 4.46Å; L414-F417 WeakPolarHBondContact O-CD1 3.32Å; L414-F417 VanDerWaalsContact O-CE1 3.23Å; L414-F417 WeakPolarHBondContact O-CE1 3.36Å; V415-F417 PolarHBondContact O-N 3.42Å; V415-F417 VanDerWaalsContact O-N 3.11Å; F417-D419 VanDerWaalsContact C-N 3.33Å; F417-A421 PolarHBondContact O-N 2.91Å; F417-T425 HydrophobicContact CD2-CG2 4.3Å; F417-T425 HydrophobicContact CE2-CG2 4.29Å; F417-L428 HydrophobicContact CD2-CB 4.21Å; F417-K429 HydrophobicContact CE1-CD 4.35Å; F417-K429 HydrophobicContact CE2-CB 4.06Å; F417-K429 HydrophobicContact CE2-CD 4.44Å; F417-K429 HydrophobicContact CZ-CB 4.41Å; F417-K429 HydrophobicContact CZ-CD 3.97Å; F417-L432 HydrophobicContact CB-CD1 3.68Å; F417-L432 HydrophobicContact CD1-CD1 3.68Å; F417-L432 HydrophobicContact CD2-CD1 4.27Å; F417-L432 HydrophobicContact CE1-CD1 4.41Å; F417-L432 HydrophobicContact CG-CD1 3.61Å |
| 418 | L | 89.4 | Confident | 89.1 | Confident | 77 Ų | 77 | 31.3 Ų | 31.3 | 40% | 0.403 | 17% | 0.171 | S | C | . | . | H | α-helix | trans | -68.7 | -34.7 | 174.1 | -60.2 | 174.6 | 0 | 0 | 0 | 111.3 | V415 N416 P422 T425 | V415-L418 WeakPolarHBondContact O-CB 3.35Å; V415-L418 WeakPolarHBondContact O-CG 3.25Å; V415-L418 PolarHBondContact O-N 2.93Å; N416-L418 PolarHBondContact O-N 2.97Å; L418-P422 WeakPolarHBondContact O-CD 3.29Å; L418-P422 VanDerWaalsContact O-CG 3.24Å; L418-P422 WeakPolarHBondContact O-CG 3.42Å; L418-T425 HydrophobicContact CD2-CG2 3.51Å |
| 419 | D | 91.1 | Very high | 88.8 | Confident | 28 Ų | 28 | 31.9 Ų | 31.9 | 15% | 0.15 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -78.1 | -40.9 | -175.7 | -54.2 | -36.5 | 0 | 0 | 0 | 111.3 | L363 R367 N416 F417 A483 | L363-D419 HydrophobicContact CD2-CB 4.28Å; R367-D419 IonicContact CZ-OD2 3.32Å; R367-D419 IonicContact NE-OD2 2.73Å; R367-D419 PolarHBondContact NE-OD2 3.35Å; R367-D419 IonicContact NH2-OD1 3.24Å; R367-D419 PolarHBondContact NH2-OD1 2.82Å; R367-D419 IonicContact NH2-OD2 3.05Å; R367-D419 PolarHBondContact NH2-OD2 3.33Å; N416-D419 PolarHBondContact O-N 3.15Å; N416-D419 PolarHBondContact OD1-OD2 2.79Å; F417-D419 VanDerWaalsContact C-N 3.33Å; D419-A483 HydrophobicContact CB-CB 4.19Å |
| 420 | I | 92.4 | Very high | 88.5 | Confident | 0 Ų | 0 | 32.5 Ų | 32.5 | 0% | 0 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -76.6 | -30.1 | -175.9 | 59.4 | 149.5 | 0 | 0 | 0 | 114.1 | L294 I297 N416 L428 R482 V485 Q486 W488 | L294-I420 HydrophobicContact CB-CD1 4.34Å; L294-I420 HydrophobicContact CD1-CD1 4.17Å; I297-I420 HydrophobicContact CD1-CD1 3.55Å; I297-I420 HydrophobicContact CD1-CG1 3.77Å; I297-I420 HydrophobicContact CD1-CG2 4.09Å; N416-I420 PolarHBondContact O-N 3.47Å; N416-I420 VanDerWaalsContact O-N 3.15Å; I420-L428 HydrophobicContact CD1-CD1 4.5Å; I420-R482 VanDerWaalsContact CG2-O 3.28Å; I420-R482 WeakPolarHBondContact CG2-O 3.33Å; I420-V485 WeakPolarHBondContact O-CA 3.39Å; I420-Q486 HydrophobicContact CB-CG 3.96Å; I420-Q486 HydrophobicContact CG2-CG 4.45Å; I420-Q486 PolarHBondContact O-N 3.4Å; I420-W488 HydrophobicContact CD1-CZ2 4.44Å |
| 421 | A | 88.8 | Confident | 88.5 | Confident | 0 Ų | 0 | 31.2 Ų | 31.2 | 0% | 0 | 18% | 0.175 | C | C | . | . | trans | -156 | 69.2 | -175.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | F417 R423 Y424 T425 L428 W488 A489 | F417-A421 PolarHBondContact O-N 2.91Å; A421-R423 PolarHBondContact O-N 2.9Å; A421-Y424 HydrophobicContact CB-CD2 4.41Å; A421-Y424 PolarHBondContact O-N 3.21Å; A421-T425 PolarHBondContact O-N 3.44Å; A421-L428 HydrophobicContact CB-CD1 3.64Å; A421-W488 HydrophobicContact CB-CH2 3.37Å; A421-W488 HydrophobicContact CB-CZ2 4.23Å; A421-W488 HydrophobicContact CB-CZ3 3.65Å; A421-A489 HydrophobicContact CB-CB 3.62Å | ||
| 422 | P | 83.9 | Confident | 88.5 | Confident | 69 Ų | 69 | 30.9 Ų | 30.9 | 45% | 0.448 | 17% | 0.172 | S | C | . | . | G | 310 helix | trans | -51.7 | -34.8 | -179.6 | -22.5 | 26.9 | 0 | 0 | 0 | 114.2 | L418 Y424 T425 V485 | L418-P422 WeakPolarHBondContact O-CD 3.29Å; L418-P422 VanDerWaalsContact O-CG 3.24Å; L418-P422 WeakPolarHBondContact O-CG 3.42Å; P422-Y424 VanDerWaalsContact C-N 3.34Å; P422-Y424 PolarHBondContact O-N 3.04Å; P422-T425 WeakPolarHBondContact O-CG2 3.39Å; P422-T425 PolarHBondContact O-OG1 3.45Å; P422-T425 VanDerWaalsContact O-OG1 3.09Å; P422-V485 HydrophobicContact CG-CG2 4.45Å |
| 423 | R | 80.7 | Confident | 88.3 | Confident | 93 Ų | 93 | 32.5 Ų | 32.5 | 35% | 0.351 | 18% | 0.18 | S | C | . | . | G | 310 helix | trans | -68.1 | -28.8 | -178.7 | -69 | -174.5 | 169.5 | -156.4 | -9.5 | 114 | W281 A421 E491 | W281-R423 HydrophobicContact CZ3-CB 4.26Å; W281-R423 HydrophobicContact CZ3-CG 4.32Å; A421-R423 PolarHBondContact O-N 2.9Å; R423-E491 IonicContact CZ-OE1 2.78Å; R423-E491 IonicContact NH1-OE1 2.84Å; R423-E491 PolarHBondContact NH1-OE1 2.85Å; R423-E491 IonicContact NH2-OE1 3.66Å; R423-E491 PolarHBondContact NH2-OE1 2.61Å; R423-E491 IonicContact NH2-OE2 3.32Å; R423-E491 PolarHBondContact NH2-OE2 2.97Å |
| 424 | Y | 82.7 | Confident | 88.3 | Confident | 36 Ų | 36 | 33.3 Ų | 33.3 | 14% | 0.141 | 19% | 0.185 | C | C | . | . | G | 310 helix | trans | -111.7 | 18.8 | -173.7 | -58.2 | -66.5 | 0 | 0 | 0 | 112.6 | L283 P284 A421 P422 G426 F427 L428 W488 A489 | L283-Y424 HydrophobicContact CD2-CD1 3.84Å; L283-Y424 HydrophobicContact CD2-CE1 4.16Å; P284-Y424 WeakPolarHBondContact CD-OH 3.41Å; P284-Y424 HydrophobicContact CG-CE2 4.05Å; A421-Y424 HydrophobicContact CB-CD2 4.41Å; A421-Y424 PolarHBondContact O-N 3.21Å; P422-Y424 VanDerWaalsContact C-N 3.34Å; P422-Y424 PolarHBondContact O-N 3.04Å; Y424-G426 VanDerWaalsContact C-N 3.33Å; Y424-G426 PolarHBondContact O-N 2.91Å; Y424-F427 PolarHBondContact O-N 2.92Å; Y424-L428 WeakPolarHBondContact O-CB 3.42Å; Y424-L428 WeakPolarHBondContact O-CG 3.45Å; Y424-L428 PolarHBondContact O-N 3.01Å; Y424-W488 AromaticContact CD2-CE3 3.99Å; Y424-W488 HydrophobicContact CD2-CE3 3.99Å; Y424-W488 AromaticContact CD2-CZ3 3.58Å; Y424-W488 HydrophobicContact CD2-CZ3 3.58Å; Y424-W488 HydrophobicContact CE2-CE3 4.05Å; Y424-W488 HydrophobicContact CE2-CZ3 4.12Å; Y424-W488 HydrophobicContact CG-CZ3 4.41Å; Y424-A489 HydrophobicContact CD2-CB 4.22Å; Y424-A489 HydrophobicContact CE2-CB 4.29Å |
| 425 | T | 81.1 | Confident | 88.5 | Confident | 40 Ų | 40 | 35 Ų | 35 | 25% | 0.245 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -58.4 | -38.1 | -172.4 | 45.8 | 0 | 0 | 0 | 0 | 113.9 | F417 L418 A421 P422 K429 | F417-T425 HydrophobicContact CD2-CG2 4.3Å; F417-T425 HydrophobicContact CE2-CG2 4.29Å; L418-T425 HydrophobicContact CD2-CG2 3.51Å; A421-T425 PolarHBondContact O-N 3.44Å; P422-T425 WeakPolarHBondContact O-CG2 3.39Å; P422-T425 PolarHBondContact O-OG1 3.45Å; P422-T425 VanDerWaalsContact O-OG1 3.09Å; T425-K429 VanDerWaalsContact O-CB 3.24Å; T425-K429 WeakPolarHBondContact O-CB 3.37Å; T425-K429 PolarHBondContact O-N 3.1Å |
| 426 | G | 79.1 | Confident | 88.5 | Confident | 58 Ų | 58 | 33.3 Ų | 33.3 | 60% | 0.598 | 18% | 0.182 | S | C | * | . | H | α-helix | trans | -61.5 | -50.6 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | Y424 K429 G430 | Y424-G426 VanDerWaalsContact C-N 3.33Å; Y424-G426 PolarHBondContact O-N 2.91Å; G426-K429 PolarHBondContact O-N 3.48Å; G426-G430 PolarHBondContact O-N 2.92Å; G426-G430 VanDerWaalsContact O-N 3.12Å |
| 427 | F | 84.7 | Confident | 88.5 | Confident | 71 Ų | 71 | 34.2 Ų | 34.2 | 31% | 0.311 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -64.4 | -44.4 | 177.2 | 175.2 | -95.9 | 0 | 0 | 0 | 111.7 | L283 M288 Y424 K429 G430 L431 | L283-F427 HydrophobicContact CD1-CD2 4.18Å; L283-F427 HydrophobicContact CD1-CE2 4.39Å; L283-F427 HydrophobicContact CD2-CB 4.4Å; L283-F427 HydrophobicContact CD2-CG 4.29Å; M288-F427 HydrophobicContact CE-CD1 3.72Å; M288-F427 HydrophobicContact CE-CE1 3.72Å; M288-F427 HydrophobicContact SD-CD1 4.41Å; M288-F427 HydrophobicContact SD-CE1 4.18Å; Y424-F427 PolarHBondContact O-N 2.92Å; F427-K429 VanDerWaalsContact C-N 3.35Å; F427-K429 PolarHBondContact O-N 3.16Å; F427-G430 PolarHBondContact O-N 3.42Å; F427-L431 PolarHBondContact O-N 3.4Å |
| 428 | L | 88.8 | Confident | 88.7 | Confident | 1 Ų | 1 | 35.8 Ų | 35.8 | 1% | 0.005 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -62.5 | -40.4 | 178 | -74.4 | -178.9 | 0 | 0 | 0 | 112.5 | M288 L294 F417 I420 A421 Y424 G430 L431 L432 W488 | M288-L428 HydrophobicContact CE-CD2 3.36Å; M288-L428 HydrophobicContact CE-CG 4.04Å; L294-L428 HydrophobicContact CD1-CD2 3.47Å; L294-L428 VanDerWaalsContact CD1-CD2 3.47Å; L294-L428 HydrophobicContact CD2-CD2 4.08Å; L294-L428 HydrophobicContact CG-CD2 4.45Å; F417-L428 HydrophobicContact CD2-CB 4.21Å; I420-L428 HydrophobicContact CD1-CD1 4.5Å; A421-L428 HydrophobicContact CB-CD1 3.64Å; Y424-L428 WeakPolarHBondContact O-CB 3.42Å; Y424-L428 WeakPolarHBondContact O-CG 3.45Å; Y424-L428 PolarHBondContact O-N 3.01Å; L428-G430 VanDerWaalsContact C-N 3.33Å; L428-G430 PolarHBondContact O-N 2.96Å; L428-L431 PolarHBondContact O-N 2.76Å; L428-L432 VanDerWaalsContact O-CG 3.24Å; L428-L432 WeakPolarHBondContact O-CG 3.11Å; L428-L432 PolarHBondContact O-N 2.84Å; L428-W488 HydrophobicContact CD1-CH2 4.27Å |
| 429 | K | 87 | Confident | 89 | Confident | 55 Ų | 55 | 32.1 Ų | 32.1 | 24% | 0.239 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -63.1 | -41.4 | 175.7 | -174.4 | 58.5 | 173.3 | -178.9 | 0 | 111.4 | Y301 F417 T425 G426 F427 L432 Q433 | Y301-K429 PolarHBondContact OH-NZ 2.95Å; F417-K429 HydrophobicContact CE1-CD 4.35Å; F417-K429 HydrophobicContact CE2-CB 4.06Å; F417-K429 HydrophobicContact CE2-CD 4.44Å; F417-K429 HydrophobicContact CZ-CB 4.41Å; F417-K429 HydrophobicContact CZ-CD 3.97Å; T425-K429 VanDerWaalsContact O-CB 3.24Å; T425-K429 WeakPolarHBondContact O-CB 3.37Å; T425-K429 PolarHBondContact O-N 3.1Å; G426-K429 PolarHBondContact O-N 3.48Å; F427-K429 VanDerWaalsContact C-N 3.35Å; F427-K429 PolarHBondContact O-N 3.16Å; K429-L432 PolarHBondContact O-N 3.41Å; K429-Q433 WeakPolarHBondContact O-CG 3.22Å; K429-Q433 PolarHBondContact O-N 3.03Å |
| 430 | G | 86.9 | Confident | 89.2 | Confident | 15 Ų | 15 | 30.8 Ų | 30.8 | 16% | 0.155 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -59.3 | -46.6 | 172.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | G426 F427 L428 L432 Q433 V434 | G426-G430 PolarHBondContact O-N 2.92Å; G426-G430 VanDerWaalsContact O-N 3.12Å; F427-G430 PolarHBondContact O-N 3.42Å; L428-G430 VanDerWaalsContact C-N 3.33Å; L428-G430 PolarHBondContact O-N 2.96Å; G430-L432 PolarHBondContact O-N 3.09Å; G430-Q433 WeakPolarHBondContact O-CB 3.31Å; G430-Q433 PolarHBondContact O-N 2.88Å; G430-V434 WeakPolarHBondContact O-CG2 3.45Å; G430-V434 PolarHBondContact O-N 3.28Å; G430-V434 VanDerWaalsContact O-N 3.13Å |
| 431 | L | 90.7 | Very high | 89.3 | Confident | 39 Ų | 39 | 31.2 Ų | 31.2 | 20% | 0.204 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -61.6 | -41.7 | 176.6 | -174.1 | 62.8 | 0 | 0 | 0 | 112.2 | L298 F427 L428 Q433 V434 F435 | L298-L431 HydrophobicContact CD1-CD2 3.94Å; L298-L431 HydrophobicContact CD1-CG 4.48Å; L298-L431 HydrophobicContact CD2-CB 4.49Å; L298-L431 HydrophobicContact CD2-CD2 3.91Å; L298-L431 HydrophobicContact CD2-CG 3.74Å; F427-L431 PolarHBondContact O-N 3.4Å; L428-L431 PolarHBondContact O-N 2.76Å; L431-Q433 VanDerWaalsContact C-N 3.34Å; L431-Q433 PolarHBondContact O-N 3.3Å; L431-V434 WeakPolarHBondContact O-CB 3.26Å; L431-V434 PolarHBondContact O-N 3.3Å; L431-F435 HydrophobicContact CD1-CE2 4.16Å; L431-F435 HydrophobicContact CG-CE2 4.43Å; L431-F435 WeakPolarHBondContact O-CD2 3.45Å; L431-F435 PolarHBondContact O-N 3.37Å |
| 432 | L | 92.4 | Very high | 89.7 | Confident | 2 Ų | 2 | 34.9 Ų | 34.9 | 1% | 0.01 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -61.9 | -41 | 175.5 | -71 | 163.5 | 0 | 0 | 0 | 112 | I297 L298 Y301 F417 L428 K429 G430 V434 F435 A436 | I297-L432 HydrophobicContact CG2-CD1 4.5Å; I297-L432 HydrophobicContact CG2-CD2 3.76Å; L298-L432 HydrophobicContact CD2-CD2 3.7Å; L298-L432 HydrophobicContact CD2-CG 4.18Å; L298-L432 HydrophobicContact CG-CD2 4.47Å; Y301-L432 HydrophobicContact CD1-CB 4Å; Y301-L432 HydrophobicContact CD1-CD2 4.38Å; Y301-L432 VanDerWaalsContact CD1-O 3.23Å; Y301-L432 WeakPolarHBondContact CD1-O 3.09Å; Y301-L432 HydrophobicContact CD2-CB 4.04Å; Y301-L432 HydrophobicContact CD2-CD1 4.26Å; Y301-L432 HydrophobicContact CD2-CD2 3.53Å; Y301-L432 HydrophobicContact CD2-CG 4.15Å; Y301-L432 HydrophobicContact CE1-CB 3.96Å; Y301-L432 WeakPolarHBondContact CE1-O 3.22Å; Y301-L432 HydrophobicContact CE2-CB 4Å; Y301-L432 HydrophobicContact CE2-CD1 4.2Å; Y301-L432 HydrophobicContact CE2-CD2 4.23Å; Y301-L432 HydrophobicContact CE2-CG 4.37Å; Y301-L432 HydrophobicContact CG-CB 4.06Å; Y301-L432 HydrophobicContact CG-CD2 3.64Å; Y301-L432 HydrophobicContact CG-CG 4.4Å; F417-L432 HydrophobicContact CB-CD1 3.68Å; F417-L432 HydrophobicContact CD1-CD1 3.68Å; F417-L432 HydrophobicContact CD2-CD1 4.27Å; F417-L432 HydrophobicContact CE1-CD1 4.41Å; F417-L432 HydrophobicContact CG-CD1 3.61Å; L428-L432 VanDerWaalsContact O-CG 3.24Å; L428-L432 WeakPolarHBondContact O-CG 3.11Å; L428-L432 PolarHBondContact O-N 2.84Å; K429-L432 PolarHBondContact O-N 3.41Å; G430-L432 PolarHBondContact O-N 3.09Å; L432-V434 VanDerWaalsContact C-N 3.3Å; L432-V434 PolarHBondContact O-N 3.29Å; L432-F435 PolarHBondContact O-N 2.95Å; L432-A436 PolarHBondContact O-N 3.32Å |
| 433 | Q | 90.6 | Very high | 90.3 | Very high | 34 Ų | 34 | 31.6 Ų | 31.6 | 16% | 0.159 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -61.4 | -37.3 | 175.5 | -76.7 | 179.9 | -28.7 | 0 | 0 | 112.5 | P125 K429 G430 L431 F435 A436 H437 | P125-Q433 HydrophobicContact CB-CB 4.42Å; P125-Q433 HydrophobicContact CG-CB 4.29Å; K429-Q433 WeakPolarHBondContact O-CG 3.22Å; K429-Q433 PolarHBondContact O-N 3.03Å; G430-Q433 WeakPolarHBondContact O-CB 3.31Å; G430-Q433 PolarHBondContact O-N 2.88Å; L431-Q433 VanDerWaalsContact C-N 3.34Å; L431-Q433 PolarHBondContact O-N 3.3Å; Q433-F435 VanDerWaalsContact C-N 3.34Å; Q433-F435 PolarHBondContact O-N 3.4Å; Q433-A436 PolarHBondContact O-N 3.12Å; Q433-H437 PolarHBondContact O-CD2 2.83Å; Q433-H437 PolarHBondContact O-N 3.11Å |
| 434 | V | 93.1 | Very high | 91.1 | Very high | 19 Ų | 19 | 27.3 Ų | 27.3 | 12% | 0.115 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -56.9 | -50 | 173.4 | 176.5 | 0 | 0 | 0 | 0 | 110.1 | F122 P125 I126 G430 L431 L432 A436 H437 I438 | F122-V434 HydrophobicContact CB-CG1 4.39Å; F122-V434 HydrophobicContact CD2-CG1 4.49Å; F122-V434 WeakPolarHBondContact O-CG2 3.29Å; P125-V434 HydrophobicContact CG-CG2 4.32Å; I126-V434 HydrophobicContact CD1-CG2 4.11Å; I126-V434 HydrophobicContact CG1-CG2 4.26Å; G430-V434 WeakPolarHBondContact O-CG2 3.45Å; G430-V434 PolarHBondContact O-N 3.28Å; G430-V434 VanDerWaalsContact O-N 3.13Å; L431-V434 WeakPolarHBondContact O-CB 3.26Å; L431-V434 PolarHBondContact O-N 3.3Å; L432-V434 VanDerWaalsContact C-N 3.3Å; L432-V434 PolarHBondContact O-N 3.29Å; V434-A436 PolarHBondContact O-N 3.48Å; V434-H437 PolarHBondContact O-N 3.23Å; V434-I438 HydrophobicContact CG1-CD1 3.87Å; V434-I438 HydrophobicContact CG1-CG1 4.46Å; V434-I438 VanDerWaalsContact O-CG1 3.26Å; V434-I438 WeakPolarHBondContact O-CG1 3.39Å; V434-I438 PolarHBondContact O-N 2.63Å |
| 435 | F | 95 | Very high | 91.7 | Very high | 42 Ų | 42 | 27.6 Ų | 27.6 | 18% | 0.184 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -64.2 | -38.1 | 179.2 | -82.7 | -102.7 | 0 | 0 | 0 | 112.8 | W295 L298 F302 L431 L432 Q433 I438 A439 | W295-F435 HydrophobicContact CH2-CZ 4.48Å; W295-F435 HydrophobicContact CZ3-CE1 4.29Å; W295-F435 AromaticContact CZ3-CZ 3.86Å; W295-F435 HydrophobicContact CZ3-CZ 3.86Å; L298-F435 HydrophobicContact CB-CD1 4.4Å; L298-F435 HydrophobicContact CB-CE1 4.35Å; L298-F435 HydrophobicContact CB-CE2 4.47Å; L298-F435 HydrophobicContact CB-CG 4.48Å; L298-F435 HydrophobicContact CB-CZ 4.38Å; L298-F435 HydrophobicContact CD1-CE2 4.19Å; L298-F435 HydrophobicContact CD1-CZ 4.34Å; L298-F435 HydrophobicContact CD2-CD2 3.87Å; L298-F435 HydrophobicContact CD2-CE2 4.04Å; L298-F435 HydrophobicContact CD2-CG 4.42Å; L298-F435 HydrophobicContact CG-CE2 4.48Å; F302-F435 HydrophobicContact CB-CB 4.37Å; F302-F435 HydrophobicContact CB-CD1 4.2Å; L431-F435 HydrophobicContact CD1-CE2 4.16Å; L431-F435 HydrophobicContact CG-CE2 4.43Å; L431-F435 WeakPolarHBondContact O-CD2 3.45Å; L431-F435 PolarHBondContact O-N 3.37Å; L432-F435 PolarHBondContact O-N 2.95Å; Q433-F435 VanDerWaalsContact C-N 3.34Å; Q433-F435 PolarHBondContact O-N 3.4Å; F435-I438 PolarHBondContact O-N 2.89Å; F435-A439 PolarHBondContact O-N 3.32Å |
| 436 | A | 94.1 | Very high | 92.4 | Very high | 4 Ų | 4 | 26.6 Ų | 26.6 | 3% | 0.033 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -62.1 | -45.4 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | Y301 Y305 Y309 L432 Q433 V434 A439 G440 | Y301-A436 HydrophobicContact CD1-CB 3.8Å; Y301-A436 HydrophobicContact CE1-CB 3.65Å; Y305-A436 HydrophobicContact CD1-CB 3.63Å; Y305-A436 HydrophobicContact CD2-CB 3.83Å; Y305-A436 HydrophobicContact CE1-CB 4.06Å; Y305-A436 HydrophobicContact CE2-CB 4.25Å; Y305-A436 HydrophobicContact CG-CB 3.48Å; Y305-A436 VanDerWaalsContact CG-CB 3.48Å; Y309-A436 VanDerWaalsContact CE2-O 3.28Å; Y309-A436 WeakPolarHBondContact CE2-O 3.35Å; L432-A436 PolarHBondContact O-N 3.32Å; Q433-A436 PolarHBondContact O-N 3.12Å; V434-A436 PolarHBondContact O-N 3.48Å; A436-A439 WeakPolarHBondContact O-CB 3.45Å; A436-A439 PolarHBondContact O-N 3.23Å; A436-G440 PolarHBondContact O-N 2.74Å |
| 437 | H | 93.7 | Very high | 93.1 | Very high | 19 Ų | 19 | 24 Ų | 24 | 9% | 0.088 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -69.3 | -32.6 | 178 | -72.5 | -60.5 | 0 | 0 | 0 | 112.4 | N118 F122 Y309 Q433 V434 A439 G440 A441 | N118-H437 PolarHBondContact OD1-ND1 3.42Å; F122-H437 HydrophobicContact CB-CB 3.54Å; Y309-H437 PolarHBondContact OH-ND1 3.23Å; Q433-H437 PolarHBondContact O-CD2 2.83Å; Q433-H437 PolarHBondContact O-N 3.11Å; V434-H437 PolarHBondContact O-N 3.23Å; H437-A439 VanDerWaalsContact C-N 3.31Å; H437-G440 CarbonylContact O-C 3.53Å; H437-G440 PolarHBondContact O-N 3.49Å; H437-A441 WeakPolarHBondContact O-CB 3.39Å; H437-A441 PolarHBondContact O-N 3.28Å |
| 438 | I | 95.9 | Very high | 93.5 | Very high | 50 Ų | 50 | 20.6 Ų | 20.6 | 26% | 0.256 | 11% | 0.113 | S | C | . | . | H | α-helix | trans | -61.1 | -43.9 | 169.7 | -65.6 | 166.7 | 0 | 0 | 0 | 109.7 | F122 F302 V434 F435 G440 A441 I442 | F122-I438 HydrophobicContact CB-CG1 3.9Å; F122-I438 HydrophobicContact CD1-CG1 4.45Å; F122-I438 HydrophobicContact CD2-CD1 4.48Å; F122-I438 HydrophobicContact CD2-CG1 4.04Å; F122-I438 HydrophobicContact CG-CG1 3.89Å; F302-I438 HydrophobicContact CD2-CG2 4.43Å; F302-I438 HydrophobicContact CE2-CG2 3.99Å; V434-I438 HydrophobicContact CG1-CD1 3.87Å; V434-I438 HydrophobicContact CG1-CG1 4.46Å; V434-I438 VanDerWaalsContact O-CG1 3.26Å; V434-I438 WeakPolarHBondContact O-CG1 3.39Å; V434-I438 PolarHBondContact O-N 2.63Å; F435-I438 PolarHBondContact O-N 2.89Å; I438-G440 PolarHBondContact O-N 3.32Å; I438-A441 WeakPolarHBondContact O-CB 3.37Å; I438-A441 PolarHBondContact O-N 3.4Å; I438-I442 HydrophobicContact CG2-CD1 3.72Å; I438-I442 HydrophobicContact CG2-CG1 4.45Å; I438-I442 WeakPolarHBondContact O-CG1 3.15Å; I438-I442 PolarHBondContact O-N 3.33Å |
| 439 | A | 96.8 | Very high | 93.8 | Very high | 0 Ų | 0 | 25.3 Ų | 25.3 | 0% | 0 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -60.3 | -45.7 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | F302 W306 F435 A436 H437 A441 I442 S443 | F302-A439 HydrophobicContact CD2-CB 3.63Å; F302-A439 HydrophobicContact CE2-CB 3.79Å; F302-A439 HydrophobicContact CG-CB 4.24Å; F302-A439 VanDerWaalsContact O-CB 3.22Å; F302-A439 WeakPolarHBondContact O-CB 3.43Å; W306-A439 HydrophobicContact CB-CB 4.3Å; F435-A439 PolarHBondContact O-N 3.32Å; A436-A439 WeakPolarHBondContact O-CB 3.45Å; A436-A439 PolarHBondContact O-N 3.23Å; H437-A439 VanDerWaalsContact C-N 3.31Å; A439-A441 VanDerWaalsContact C-N 3.27Å; A439-A441 PolarHBondContact O-N 3.29Å; A439-I442 PolarHBondContact O-N 2.99Å; A439-S443 VanDerWaalsContact O-CB 3.28Å; A439-S443 WeakPolarHBondContact O-CB 3.32Å; A439-S443 PolarHBondContact O-N 3.43Å; A439-S443 PolarHBondContact O-OG 2.84Å |
| 440 | G | 94.9 | Very high | 94.1 | Very high | 0 Ų | 0 | 25.2 Ų | 25.2 | 0% | 0 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -70.2 | -18.2 | 177.3 | 0 | 0 | 0 | 0 | 0 | 115.1 | N118 Y309 A436 H437 I438 P444 | N118-G440 VanDerWaalsContact CB-C 3.49Å; N118-G440 VanDerWaalsContact ND2-C 3.29Å; N118-G440 PolarHBondContact ND2-O 3.16Å; Y309-G440 VanDerWaalsContact CG-CA 3.42Å; A436-G440 PolarHBondContact O-N 2.74Å; H437-G440 CarbonylContact O-C 3.53Å; H437-G440 PolarHBondContact O-N 3.49Å; I438-G440 PolarHBondContact O-N 3.32Å; G440-P444 WeakPolarHBondContact O-CD 3.48Å; G440-P444 WeakPolarHBondContact O-CG 3.27Å |
| 441 | A | 95.4 | Very high | 94.3 | Very high | 8 Ų | 8 | 25.5 Ų | 25.5 | 7% | 0.066 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -77.8 | -43.9 | 170.7 | 0 | 0 | 0 | 0 | 0 | 110.7 | S115 N118 Y119 H437 I438 A439 T445 | S115-A441 WeakPolarHBondContact CB-O 3.36Å; S115-A441 PolarHBondContact OG-O 3.12Å; N118-A441 HydrophobicContact CB-CB 4Å; Y119-A441 HydrophobicContact CD1-CB 3.64Å; Y119-A441 HydrophobicContact CE1-CB 4.01Å; Y119-A441 WeakPolarHBondContact CE1-O 3.49Å; H437-A441 WeakPolarHBondContact O-CB 3.39Å; H437-A441 PolarHBondContact O-N 3.28Å; I438-A441 WeakPolarHBondContact O-CB 3.37Å; I438-A441 PolarHBondContact O-N 3.4Å; A439-A441 VanDerWaalsContact C-N 3.27Å; A439-A441 PolarHBondContact O-N 3.29Å; A441-T445 PolarHBondContact O-OG1 3.31Å |
| 442 | I | 96.9 | Very high | 94.2 | Very high | 78 Ų | 78 | 25.4 Ų | 25.4 | 40% | 0.4 | 13% | 0.134 | S | C | . | . | H | α-helix | trans | -82.6 | -43.2 | -174.4 | -57.6 | 169.5 | 0 | 0 | 0 | 111.3 | F302 W306 I438 A439 T445 A446 | F302-I442 HydrophobicContact CE2-CD1 4.33Å; F302-I442 HydrophobicContact CZ-CD1 4.45Å; W306-I442 HydrophobicContact CH2-CB 4.32Å; W306-I442 HydrophobicContact CH2-CG2 3.56Å; W306-I442 HydrophobicContact CZ3-CB 3.8Å; W306-I442 HydrophobicContact CZ3-CG2 3.44Å; W306-I442 VanDerWaalsContact CZ3-CG2 3.44Å; I438-I442 HydrophobicContact CG2-CD1 3.72Å; I438-I442 HydrophobicContact CG2-CG1 4.45Å; I438-I442 WeakPolarHBondContact O-CG1 3.15Å; I438-I442 PolarHBondContact O-N 3.33Å; A439-I442 PolarHBondContact O-N 2.99Å; I442-T445 PolarHBondContact O-N 3.48Å; I442-A446 WeakPolarHBondContact O-CB 3.02Å; I442-A446 PolarHBondContact O-N 3.25Å |
| 443 | S | 96.7 | Very high | 93.8 | Very high | 0 Ų | 0 | 30.9 Ų | 30.9 | 0% | 0 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -62.9 | -43.8 | -167.1 | 76.2 | 0 | 0 | 0 | 0 | 113.9 | W306 T310 A439 A446 A447 | W306-S443 VanDerWaalsContact CD2-CB 3.44Å; W306-S443 PolarHBondContact O-OG 2.87Å; T310-S443 WeakPolarHBondContact OG1-CB 3.1Å; T310-S443 PolarHBondContact OG1-OG 2.87Å; A439-S443 VanDerWaalsContact O-CB 3.28Å; A439-S443 WeakPolarHBondContact O-CB 3.32Å; A439-S443 PolarHBondContact O-N 3.43Å; A439-S443 PolarHBondContact O-OG 2.84Å; S443-A446 PolarHBondContact O-N 3.15Å; S443-A447 WeakPolarHBondContact O-CB 3.48Å; S443-A447 PolarHBondContact O-N 3.41Å |
| 444 | P | 95.8 | Very high | 93.3 | Very high | 2 Ų | 2 | 32.4 Ų | 32.4 | 1% | 0.013 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -71.4 | -35.9 | 179 | -16.6 | 31.4 | 0 | 0 | 0 | 113.1 | G111 L114 S115 A313 Y314 G440 A447 G448 | G111-P444 WeakPolarHBondContact CA-O 3.38Å; L114-P444 HydrophobicContact CB-CB 3.92Å; S115-P444 WeakPolarHBondContact OG-CB 3.37Å; S115-P444 VanDerWaalsContact OG-CD 3.29Å; S115-P444 WeakPolarHBondContact OG-CD 3.39Å; A313-P444 HydrophobicContact CB-CB 4.18Å; A313-P444 HydrophobicContact CB-CG 4.16Å; Y314-P444 HydrophobicContact CE2-CB 3.94Å; Y314-P444 PolarHBondContact OH-O 3.4Å; G440-P444 WeakPolarHBondContact O-CD 3.48Å; G440-P444 WeakPolarHBondContact O-CG 3.27Å; P444-A447 PolarHBondContact O-N 2.97Å; P444-G448 PolarHBondContact O-N 2.69Å |
| 445 | T | 95.7 | Very high | 92.1 | Very high | 42 Ų | 42 | 36 Ų | 36 | 26% | 0.258 | 19% | 0.194 | S | C | . | . | H | α-helix | trans | -62.7 | -45.5 | 175.1 | -59.2 | 0 | 0 | 0 | 0 | 111 | V112 S115 Y119 A441 I442 A447 G448 F449 | V112-T445 HydrophobicContact CG2-CG2 4.02Å; S115-T445 WeakPolarHBondContact CB-OG1 3.31Å; S115-T445 PolarHBondContact OG-N 3.48Å; S115-T445 PolarHBondContact OG-OG1 2.87Å; Y119-T445 PolarHBondContact OH-OG1 3.38Å; A441-T445 PolarHBondContact O-OG1 3.31Å; I442-T445 PolarHBondContact O-N 3.48Å; T445-A447 VanDerWaalsContact C-N 3.34Å; T445-A447 PolarHBondContact O-N 2.85Å; T445-G448 PolarHBondContact O-N 3.02Å; T445-F449 PolarHBondContact O-N 3.4Å; T445-F449 VanDerWaalsContact O-N 3.08Å |
| 446 | A | 96.2 | Very high | 90.9 | Very high | 20 Ų | 20 | 40.5 Ų | 40.5 | 17% | 0.165 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -60.6 | -45 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111 | W306 I442 S443 G448 F449 F450 L465 | W306-A446 HydrophobicContact CH2-CB 4.05Å; W306-A446 HydrophobicContact CZ2-CB 4Å; I442-A446 WeakPolarHBondContact O-CB 3.02Å; I442-A446 PolarHBondContact O-N 3.25Å; S443-A446 PolarHBondContact O-N 3.15Å; A446-G448 PolarHBondContact O-N 3.3Å; A446-F449 PolarHBondContact O-N 2.8Å; A446-F450 WeakPolarHBondContact O-CD2 3.01Å; A446-F450 PolarHBondContact O-N 3.39Å; A446-F450 VanDerWaalsContact O-N 3.09Å; A446-L465 HydrophobicContact CB-CD2 4.43Å |
| 447 | A | 94.6 | Very high | 90.3 | Very high | 3 Ų | 3 | 44.8 Ų | 44.8 | 3% | 0.025 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -62.4 | -43.8 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | Y314 S443 P444 T445 F449 F450 I451 V462 | Y314-A447 HydrophobicContact CD2-CB 3.98Å; Y314-A447 HydrophobicContact CE2-CB 3.5Å; Y314-A447 VanDerWaalsContact CE2-CB 3.5Å; S443-A447 WeakPolarHBondContact O-CB 3.48Å; S443-A447 PolarHBondContact O-N 3.41Å; P444-A447 PolarHBondContact O-N 2.97Å; T445-A447 VanDerWaalsContact C-N 3.34Å; T445-A447 PolarHBondContact O-N 2.85Å; A447-F449 VanDerWaalsContact C-N 3.3Å; A447-F449 PolarHBondContact O-N 3.14Å; A447-F450 PolarHBondContact O-N 3.18Å; A447-I451 WeakPolarHBondContact O-CD1 3.46Å; A447-I451 WeakPolarHBondContact O-CG1 3.3Å; A447-I451 PolarHBondContact O-N 3.14Å; A447-V462 HydrophobicContact CB-CG1 3.9Å; A447-V462 HydrophobicContact CB-CG2 3.86Å |
| 448 | G | 93.2 | Very high | 90 | Very high | 0 Ų | 0 | 43.9 Ų | 43.9 | 0% | 0 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -57.7 | -40.6 | 175 | 0 | 0 | 0 | 0 | 0 | 113.2 | P107 E108 Y314 P444 T445 A446 I451 S452 | P107-G448 CarbonylContact C-O 3.17Å; P107-G448 WeakPolarHBondContact O-CA 3.4Å; E108-G448 PolarHBondContact N-O 3.21Å; Y314-G448 VanDerWaalsContact OH-CA 3.31Å; Y314-G448 WeakPolarHBondContact OH-CA 3.46Å; Y314-G448 PolarHBondContact OH-N 3.44Å; Y314-G448 VanDerWaalsContact OH-N 3.13Å; P444-G448 PolarHBondContact O-N 2.69Å; T445-G448 PolarHBondContact O-N 3.02Å; A446-G448 PolarHBondContact O-N 3.3Å; G448-I451 PolarHBondContact O-N 3.49Å; G448-S452 PolarHBondContact O-N 3.44Å |
| 449 | F | 93.9 | Very high | 89.7 | Confident | 99 Ų | 99 | 42.3 Ų | 42.3 | 43% | 0.434 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -66.7 | -38.1 | 175.7 | 178.9 | -99.9 | 0 | 0 | 0 | 113.6 | E108 T445 A446 A447 S452 | E108-F449 HydrophobicContact CG-CB 4.32Å; E108-F449 HydrophobicContact CG-CD2 4.22Å; T445-F449 PolarHBondContact O-N 3.4Å; T445-F449 VanDerWaalsContact O-N 3.08Å; A446-F449 PolarHBondContact O-N 2.8Å; A447-F449 VanDerWaalsContact C-N 3.3Å; A447-F449 PolarHBondContact O-N 3.14Å; F449-S452 PolarHBondContact O-OG 2.97Å |
| 450 | F | 93.2 | Very high | 89.4 | Confident | 54 Ų | 54 | 46.5 Ų | 46.5 | 24% | 0.237 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -69.7 | -37.2 | 174.7 | -75.1 | -67.9 | 0 | 0 | 0 | 112.2 | A446 A447 S452 G458 N461 V462 L465 | A446-F450 WeakPolarHBondContact O-CD2 3.01Å; A446-F450 PolarHBondContact O-N 3.39Å; A446-F450 VanDerWaalsContact O-N 3.09Å; A447-F450 PolarHBondContact O-N 3.18Å; F450-S452 VanDerWaalsContact C-N 3.33Å; F450-G458 WeakPolarHBondContact O-CA 3.1Å; F450-N461 HydrophobicContact CB-CB 4.29Å; F450-N461 HydrophobicContact CD1-CB 3.76Å; F450-N461 HydrophobicContact CE1-CB 4.38Å; F450-N461 HydrophobicContact CG-CB 4.09Å; F450-V462 HydrophobicContact CB-CG2 3.84Å; F450-L465 HydrophobicContact CD2-CD2 4.17Å; F450-L465 HydrophobicContact CE2-CD2 3.45Å; F450-L465 VanDerWaalsContact CE2-CD2 3.45Å; F450-L465 HydrophobicContact CZ-CD2 4.2Å |
| 451 | I | 91 | Very high | 89.3 | Confident | 20 Ų | 20 | 49 Ų | 49 | 10% | 0.103 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -70.7 | -28.8 | 180 | -63.5 | 163.3 | 0 | 0 | 0 | 111.5 | P107 Y314 A447 G448 W459 V462 | P107-I451 HydrophobicContact CB-CB 3.96Å; P107-I451 HydrophobicContact CB-CG2 3.72Å; P107-I451 HydrophobicContact CG-CG2 4.01Å; Y314-I451 HydrophobicContact CD1-CD1 3.99Å; Y314-I451 HydrophobicContact CE1-CD1 3.76Å; A447-I451 WeakPolarHBondContact O-CD1 3.46Å; A447-I451 WeakPolarHBondContact O-CG1 3.3Å; A447-I451 PolarHBondContact O-N 3.14Å; G448-I451 PolarHBondContact O-N 3.49Å; I451-W459 HydrophobicContact CD1-CD2 4.17Å; I451-W459 HydrophobicContact CD1-CE3 4.04Å; I451-W459 HydrophobicContact CD1-CH2 3.76Å; I451-W459 HydrophobicContact CD1-CZ2 3.86Å; I451-W459 HydrophobicContact CD1-CZ3 3.84Å; I451-W459 HydrophobicContact CG1-CD2 4.26Å; I451-W459 HydrophobicContact CG1-CE3 4.47Å; I451-V462 HydrophobicContact CD1-CG2 4.38Å; I451-V462 HydrophobicContact CG1-CG2 4.1Å |
| 452 | S | 88.2 | Confident | 89.2 | Confident | 37 Ų | 37 | 48.7 Ų | 48.7 | 26% | 0.259 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -72.9 | -32 | 178.7 | 64.4 | 0 | 0 | 0 | 0 | 113.9 | E108 G448 F449 F450 | E108-S452 VanDerWaalsContact CD-OG 3.31Å; E108-S452 VanDerWaalsContact CG-OG 3.3Å; E108-S452 WeakPolarHBondContact CG-OG 3.24Å; E108-S452 VanDerWaalsContact OE1-CB 3.31Å; E108-S452 WeakPolarHBondContact OE1-CB 3.49Å; E108-S452 PolarHBondContact OE1-OG 3.47Å; G448-S452 PolarHBondContact O-N 3.44Å; F449-S452 PolarHBondContact O-OG 2.97Å; F450-S452 VanDerWaalsContact C-N 3.33Å |
| 453 | Q | 84.9 | Confident | 89.1 | Confident | 118 Ų | 118 | 45.8 Ų | 45.8 | 55% | 0.551 | 23% | 0.232 | S | C | * | . | H | α-helix | trans | -67.4 | -46.3 | -178.9 | -71.1 | -175 | -4.3 | 0 | 0 | 112 | ||
| 454 | D | 80.6 | Confident | 88.9 | Confident | 65 Ų | 65 | 49.2 Ų | 49.2 | 35% | 0.348 | 25% | 0.25 | S | C | . | . | trans | -151.8 | 125.2 | -179.6 | -169.8 | -63.9 | 0 | 0 | 0 | 109.2 | E456 F457 G458 | D454-E456 VanDerWaalsContact C-N 3.29Å; D454-E456 PolarHBondContact O-N 3.14Å; D454-E456 PolarHBondContact OD1-N 3.29Å; D454-F457 HydrophobicContact CB-CB 4.09Å; D454-F457 HydrophobicContact CB-CD2 4.47Å; D454-F457 PolarHBondContact OD1-N 3Å; D454-F457 WeakPolarHBondContact OD2-CD2 3.3Å; D454-G458 WeakPolarHBondContact O-CA 3.3Å; D454-G458 PolarHBondContact O-N 3.25Å | ||
| 455 | S | 68.1 | Low | 88.9 | Confident | 94 Ų | 94 | 51.6 Ų | 51.6 | 66% | 0.657 | 26% | 0.262 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.3 | -25 | -175 | 61.9 | 0 | 0 | 0 | 0 | 113.2 | ||
| 456 | E | 68.9 | Low | 88.9 | Confident | 138 Ų | 138 | 49.7 Ų | 49.7 | 65% | 0.645 | 25% | 0.251 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -95.5 | -46.9 | -178.3 | -162.4 | 176.5 | -177.4 | 0 | 0 | 111.2 | D454 | D454-E456 VanDerWaalsContact C-N 3.29Å; D454-E456 PolarHBondContact O-N 3.14Å; D454-E456 PolarHBondContact OD1-N 3.29Å |
| 457 | F | 81.3 | Confident | 88.9 | Confident | 94 Ų | 94 | 49.2 Ų | 49.2 | 41% | 0.412 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -79 | -22.2 | 177.5 | -64.6 | -57.8 | 0 | 0 | 0 | 113.6 | D454 W459 R460 N461 | D454-F457 HydrophobicContact CB-CB 4.09Å; D454-F457 HydrophobicContact CB-CD2 4.47Å; D454-F457 PolarHBondContact OD1-N 3Å; D454-F457 WeakPolarHBondContact OD2-CD2 3.3Å; F457-W459 PolarHBondContact O-N 3.06Å; F457-R460 WeakPolarHBondContact O-CB 3.47Å; F457-R460 PolarHBondContact O-N 3.37Å; F457-N461 VanDerWaalsContact O-CG 3.27Å; F457-N461 PolarHBondContact O-N 3Å; F457-N461 PolarHBondContact O-ND2 3.27Å |
| 458 | G | 87.7 | Confident | 89 | Confident | 0 Ų | 0 | 51.9 Ų | 51.9 | 0% | 0 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -58.3 | -50.2 | -179.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | F450 D454 R460 N461 V462 | F450-G458 WeakPolarHBondContact O-CA 3.1Å; D454-G458 WeakPolarHBondContact O-CA 3.3Å; D454-G458 PolarHBondContact O-N 3.25Å; G458-R460 VanDerWaalsContact C-N 3.32Å; G458-R460 PolarHBondContact O-N 3.15Å; G458-N461 WeakPolarHBondContact O-CB 3.37Å; G458-N461 PolarHBondContact O-N 3.03Å; G458-N461 VanDerWaalsContact O-N 3.08Å; G458-V462 WeakPolarHBondContact O-CG2 3.19Å; G458-V462 PolarHBondContact O-N 2.82Å |
| 459 | W | 89.7 | Confident | 89.2 | Confident | 17 Ų | 17 | 52.9 Ų | 52.9 | 6% | 0.064 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -60.4 | -39.8 | 177.6 | -72.5 | 109.4 | 0 | 0 | 0 | 113.1 | Y314 T317 Y318 V322 I451 F457 N461 V462 F463 | Y314-W459 AromaticContact CD1-CH2 3.76Å; Y314-W459 HydrophobicContact CD1-CH2 3.76Å; Y314-W459 HydrophobicContact CD1-CZ3 4.23Å; Y314-W459 HydrophobicContact CG-CH2 4.2Å; Y314-W459 HydrophobicContact CG-CZ3 4.29Å; T317-W459 HydrophobicContact CG2-CZ2 4.39Å; Y318-W459 AromaticContact CD2-CD2 3.62Å; Y318-W459 HydrophobicContact CD2-CD2 3.62Å; Y318-W459 AromaticContact CD2-CE2 3.93Å; Y318-W459 AromaticContact CD2-CE3 3.51Å; Y318-W459 HydrophobicContact CD2-CE3 3.51Å; Y318-W459 HydrophobicContact CD2-CG 4.24Å; Y318-W459 AromaticContact CD2-CH2 3.98Å; Y318-W459 HydrophobicContact CD2-CH2 3.98Å; Y318-W459 HydrophobicContact CD2-CZ2 4.11Å; Y318-W459 AromaticContact CD2-CZ3 3.7Å; Y318-W459 HydrophobicContact CD2-CZ3 3.7Å; Y318-W459 HydrophobicContact CE2-CB 4.42Å; Y318-W459 HydrophobicContact CE2-CD2 4.05Å; Y318-W459 HydrophobicContact CE2-CE3 4.11Å; Y318-W459 HydrophobicContact CE2-CG 4.21Å; Y318-W459 HydrophobicContact CG-CH2 4.41Å; Y318-W459 HydrophobicContact CG-CZ3 4.32Å; V322-W459 HydrophobicContact CG2-CG 4.32Å; I451-W459 HydrophobicContact CD1-CD2 4.17Å; I451-W459 HydrophobicContact CD1-CE3 4.04Å; I451-W459 HydrophobicContact CD1-CH2 3.76Å; I451-W459 HydrophobicContact CD1-CZ2 3.86Å; I451-W459 HydrophobicContact CD1-CZ3 3.84Å; I451-W459 HydrophobicContact CG1-CD2 4.26Å; I451-W459 HydrophobicContact CG1-CE3 4.47Å; F457-W459 PolarHBondContact O-N 3.06Å; W459-N461 VanDerWaalsContact C-N 3.33Å; W459-N461 PolarHBondContact O-N 3.3Å; W459-V462 PolarHBondContact O-N 3.27Å; W459-F463 HydrophobicContact CB-CE2 4.48Å; W459-F463 HydrophobicContact CE3-CZ 4.46Å; W459-F463 WeakPolarHBondContact O-CD2 3.49Å; W459-F463 WeakPolarHBondContact O-CG 3.15Å; W459-F463 PolarHBondContact O-N 3.3Å; W459-F463 VanDerWaalsContact O-N 3.08Å |
| 460 | R | 91.3 | Very high | 89.3 | Confident | 88 Ų | 88 | 48.4 Ų | 48.4 | 33% | 0.332 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -60.5 | -44.7 | 174.3 | -178.1 | 179.8 | 72.6 | -169.2 | 0.9 | 110.9 | P386 F457 G458 V462 F463 L464 | P386-R460 HydrophobicContact CG-CB 4.03Å; P386-R460 HydrophobicContact CG-CG 4.08Å; F457-R460 WeakPolarHBondContact O-CB 3.47Å; F457-R460 PolarHBondContact O-N 3.37Å; G458-R460 VanDerWaalsContact C-N 3.32Å; G458-R460 PolarHBondContact O-N 3.15Å; R460-V462 VanDerWaalsContact C-N 3.35Å; R460-V462 PolarHBondContact O-N 3.23Å; R460-F463 PolarHBondContact O-N 3.43Å; R460-L464 HydrophobicContact CG-CD1 3.91Å; R460-L464 HydrophobicContact CG-CG 4.42Å; R460-L464 WeakPolarHBondContact O-CB 3.23Å; R460-L464 VanDerWaalsContact O-CG 3.31Å; R460-L464 WeakPolarHBondContact O-CG 3.23Å; R460-L464 PolarHBondContact O-N 3.42Å |
| 461 | N | 92.4 | Very high | 89.5 | Confident | 51 Ų | 51 | 48.6 Ų | 48.6 | 27% | 0.273 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -65.6 | -37.3 | 178.8 | -66.4 | -17.1 | 0 | 0 | 0 | 111.9 | F450 F457 G458 W459 L464 L465 | F450-N461 HydrophobicContact CB-CB 4.29Å; F450-N461 HydrophobicContact CD1-CB 3.76Å; F450-N461 HydrophobicContact CE1-CB 4.38Å; F450-N461 HydrophobicContact CG-CB 4.09Å; F457-N461 VanDerWaalsContact O-CG 3.27Å; F457-N461 PolarHBondContact O-N 3Å; F457-N461 PolarHBondContact O-ND2 3.27Å; G458-N461 WeakPolarHBondContact O-CB 3.37Å; G458-N461 PolarHBondContact O-N 3.03Å; G458-N461 VanDerWaalsContact O-N 3.08Å; W459-N461 VanDerWaalsContact C-N 3.33Å; W459-N461 PolarHBondContact O-N 3.3Å; N461-L464 PolarHBondContact O-N 3.34Å; N461-L465 VanDerWaalsContact O-CB 3.28Å; N461-L465 WeakPolarHBondContact O-CB 3.24Å; N461-L465 PolarHBondContact O-N 2.97Å |
| 462 | V | 93.9 | Very high | 89.8 | Confident | 3 Ų | 3 | 50.9 Ų | 50.9 | 2% | 0.018 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -60 | -47 | 174 | 174 | 0 | 0 | 0 | 0 | 111.7 | T310 A447 F450 I451 G458 W459 R460 S466 | T310-V462 HydrophobicContact CG2-CG1 3.83Å; A447-V462 HydrophobicContact CB-CG1 3.9Å; A447-V462 HydrophobicContact CB-CG2 3.86Å; F450-V462 HydrophobicContact CB-CG2 3.84Å; I451-V462 HydrophobicContact CD1-CG2 4.38Å; I451-V462 HydrophobicContact CG1-CG2 4.1Å; G458-V462 WeakPolarHBondContact O-CG2 3.19Å; G458-V462 PolarHBondContact O-N 2.82Å; W459-V462 PolarHBondContact O-N 3.27Å; R460-V462 VanDerWaalsContact C-N 3.35Å; R460-V462 PolarHBondContact O-N 3.23Å; V462-S466 WeakPolarHBondContact O-CB 3.31Å; V462-S466 PolarHBondContact O-N 2.81Å; V462-S466 PolarHBondContact O-OG 2.97Å |
| 463 | F | 93 | Very high | 90.2 | Very high | 16 Ų | 16 | 49.1 Ų | 49.1 | 7% | 0.07 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -69.1 | -40.6 | 178.8 | -63.2 | -45.1 | 0 | 0 | 0 | 112.4 | Y318 L382 L385 P386 W459 R460 S466 A467 | Y318-F463 HydrophobicContact CD2-CZ 4.1Å; Y318-F463 AromaticContact CE2-CE2 3.75Å; Y318-F463 HydrophobicContact CE2-CE2 3.75Å; Y318-F463 AromaticContact CE2-CZ 3.71Å; Y318-F463 HydrophobicContact CE2-CZ 3.71Å; L382-F463 HydrophobicContact CB-CB 4.47Å; L382-F463 HydrophobicContact CB-CD1 4.46Å; L382-F463 HydrophobicContact CD2-CD1 4.13Å; L382-F463 HydrophobicContact CD2-CE1 4.25Å; L385-F463 HydrophobicContact CB-CD2 4.29Å; L385-F463 HydrophobicContact CB-CE2 4.14Å; L385-F463 HydrophobicContact CD1-CD1 4.49Å; L385-F463 HydrophobicContact CD1-CD2 4.4Å; L385-F463 HydrophobicContact CD1-CE1 4.09Å; L385-F463 HydrophobicContact CD1-CE2 3.98Å; L385-F463 HydrophobicContact CD1-CZ 3.82Å; P386-F463 HydrophobicContact CG-CD2 4.31Å; W459-F463 HydrophobicContact CB-CE2 4.48Å; W459-F463 HydrophobicContact CE3-CZ 4.46Å; W459-F463 WeakPolarHBondContact O-CD2 3.49Å; W459-F463 WeakPolarHBondContact O-CG 3.15Å; W459-F463 PolarHBondContact O-N 3.3Å; W459-F463 VanDerWaalsContact O-N 3.08Å; R460-F463 PolarHBondContact O-N 3.43Å; F463-S466 PolarHBondContact O-N 3.19Å; F463-A467 WeakPolarHBondContact O-CB 3.18Å; F463-A467 PolarHBondContact O-N 2.59Å |
| 464 | L | 94.5 | Very high | 90.8 | Very high | 73 Ų | 73 | 43.8 Ų | 43.8 | 38% | 0.382 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -61.8 | -44.1 | 175 | -75.4 | 170.3 | 0 | 0 | 0 | 112.1 | V383 R460 N461 A467 A468 | V383-L464 HydrophobicContact CG1-CD2 3.94Å; V383-L464 HydrophobicContact CG2-CD2 4.02Å; R460-L464 HydrophobicContact CG-CD1 3.91Å; R460-L464 HydrophobicContact CG-CG 4.42Å; R460-L464 WeakPolarHBondContact O-CB 3.23Å; R460-L464 VanDerWaalsContact O-CG 3.31Å; R460-L464 WeakPolarHBondContact O-CG 3.23Å; R460-L464 PolarHBondContact O-N 3.42Å; N461-L464 PolarHBondContact O-N 3.34Å; L464-A467 PolarHBondContact O-N 2.9Å; L464-A468 WeakPolarHBondContact O-CB 3.5Å; L464-A468 PolarHBondContact O-N 3.46Å |
| 465 | L | 95.6 | Very high | 91.6 | Very high | 52 Ų | 52 | 44.3 Ų | 44.3 | 27% | 0.272 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -62.9 | -46.3 | 176.5 | 177.7 | 61.3 | 0 | 0 | 0 | 111.1 | W306 A446 F450 N461 A467 A468 V469 | W306-L465 HydrophobicContact CZ2-CD2 3.8Å; W306-L465 HydrophobicContact CZ2-CG 4.19Å; A446-L465 HydrophobicContact CB-CD2 4.43Å; F450-L465 HydrophobicContact CD2-CD2 4.17Å; F450-L465 HydrophobicContact CE2-CD2 3.45Å; F450-L465 VanDerWaalsContact CE2-CD2 3.45Å; F450-L465 HydrophobicContact CZ-CD2 4.2Å; N461-L465 VanDerWaalsContact O-CB 3.28Å; N461-L465 WeakPolarHBondContact O-CB 3.24Å; N461-L465 PolarHBondContact O-N 2.97Å; L465-A467 VanDerWaalsContact C-N 3.31Å; L465-A467 PolarHBondContact O-N 3.47Å; L465-A468 PolarHBondContact O-N 2.86Å; L465-V469 HydrophobicContact CD1-CG2 4.05Å; L465-V469 HydrophobicContact CG-CG2 4.41Å; L465-V469 WeakPolarHBondContact O-CG2 3.44Å; L465-V469 PolarHBondContact O-N 3.48Å |
| 466 | S | 95.3 | Very high | 93.1 | Very high | 2 Ų | 2 | 42.4 Ų | 42.4 | 1% | 0.014 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -60.8 | -41.8 | 178.8 | -59.1 | 0 | 0 | 0 | 0 | 111.4 | V462 F463 N470 | V462-S466 WeakPolarHBondContact O-CB 3.31Å; V462-S466 PolarHBondContact O-N 2.81Å; V462-S466 PolarHBondContact O-OG 2.97Å; F463-S466 PolarHBondContact O-N 3.19Å; S466-N470 WeakPolarHBondContact O-CB 3.32Å; S466-N470 PolarHBondContact O-N 3.45Å; S466-N470 PolarHBondContact O-ND2 2.94Å |
| 467 | A | 96.1 | Very high | 94.5 | Very high | 9 Ų | 9 | 35.9 Ų | 35.9 | 7% | 0.074 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -64.1 | -46 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | V383 F463 L464 L465 V469 N470 I471 | V383-A467 HydrophobicContact CG2-CB 3.56Å; F463-A467 WeakPolarHBondContact O-CB 3.18Å; F463-A467 PolarHBondContact O-N 2.59Å; L464-A467 PolarHBondContact O-N 2.9Å; L465-A467 VanDerWaalsContact C-N 3.31Å; L465-A467 PolarHBondContact O-N 3.47Å; A467-V469 PolarHBondContact O-N 3.29Å; A467-N470 PolarHBondContact O-N 3.49Å; A467-I471 WeakPolarHBondContact O-CB 3.49Å; A467-I471 WeakPolarHBondContact O-CG1 3.44Å; A467-I471 PolarHBondContact O-N 3.26Å |
| 468 | A | 96.8 | Very high | 95.2 | Very high | 59 Ų | 59 | 34.5 Ų | 34.5 | 49% | 0.488 | 19% | 0.19 | S | C | . | . | H | α-helix | trans | -60.1 | -45.6 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | L464 L465 S472 | L464-A468 WeakPolarHBondContact O-CB 3.5Å; L464-A468 PolarHBondContact O-N 3.46Å; L465-A468 PolarHBondContact O-N 2.86Å; A468-S472 WeakPolarHBondContact O-CB 3.41Å; A468-S472 PolarHBondContact O-N 3.36Å; A468-S472 PolarHBondContact O-OG 3.08Å |
| 469 | V | 97.2 | Very high | 95.7 | Very high | 22 Ų | 22 | 39.2 Ų | 39.2 | 13% | 0.133 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -60.8 | -48.4 | 176.5 | 171.5 | 0 | 0 | 0 | 0 | 110.6 | F302 C303 W306 L465 A467 S472 G473 | F302-V469 HydrophobicContact CE1-CG1 4.38Å; C303-V469 HydrophobicContact CB-CG1 4.07Å; C303-V469 PolarHBondContact SG-O 2.9Å; W306-V469 HydrophobicContact CB-CG1 4.22Å; W306-V469 HydrophobicContact CD2-CG1 4.29Å; W306-V469 HydrophobicContact CG-CG1 4.12Å; L465-V469 HydrophobicContact CD1-CG2 4.05Å; L465-V469 HydrophobicContact CG-CG2 4.41Å; L465-V469 WeakPolarHBondContact O-CG2 3.44Å; L465-V469 PolarHBondContact O-N 3.48Å; A467-V469 PolarHBondContact O-N 3.29Å; V469-S472 PolarHBondContact O-N 3.42Å; V469-S472 PolarHBondContact O-OG 3.45Å; V469-G473 PolarHBondContact O-N 3.3Å; V469-G473 VanDerWaalsContact O-N 3.09Å |
| 470 | N | 95.6 | Very high | 96 | Very high | 5 Ų | 5 | 41.7 Ų | 41.7 | 3% | 0.027 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -64.6 | -46.5 | -179.9 | -82.8 | -75.7 | 0 | 0 | 0 | 113.3 | C303 L307 V375 S466 A467 S472 G473 L474 | C303-N470 PolarHBondContact O-ND2 3.34Å; C303-N470 PolarHBondContact O-OD1 2.98Å; L307-N470 WeakPolarHBondContact CB-ND2 3.32Å; V375-N470 HydrophobicContact CG1-CB 3.82Å; S466-N470 WeakPolarHBondContact O-CB 3.32Å; S466-N470 PolarHBondContact O-N 3.45Å; S466-N470 PolarHBondContact O-ND2 2.94Å; A467-N470 PolarHBondContact O-N 3.49Å; N470-S472 VanDerWaalsContact C-N 3.29Å; N470-S472 PolarHBondContact O-N 3.41Å; N470-G473 PolarHBondContact O-N 2.8Å; N470-L474 PolarHBondContact O-N 3.36Å |
| 471 | I | 97.3 | Very high | 96.2 | Very high | 57 Ų | 57 | 37.5 Ų | 37.5 | 29% | 0.292 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -61.8 | -40 | 178.4 | -65.3 | -69.9 | 0 | 0 | 0 | 110.8 | V375 L376 A467 G473 L474 V475 | V375-I471 HydrophobicContact CG1-CD1 4.12Å; L376-I471 HydrophobicContact CD2-CD1 3.59Å; A467-I471 WeakPolarHBondContact O-CB 3.49Å; A467-I471 WeakPolarHBondContact O-CG1 3.44Å; A467-I471 PolarHBondContact O-N 3.26Å; I471-G473 PolarHBondContact O-N 3.31Å; I471-L474 PolarHBondContact O-N 3Å; I471-V475 HydrophobicContact CG2-CG2 4.38Å; I471-V475 VanDerWaalsContact O-CG2 3.3Å; I471-V475 WeakPolarHBondContact O-CG2 3.22Å; I471-V475 PolarHBondContact O-N 3.34Å |
| 472 | S | 97.2 | Very high | 96.3 | Very high | 69 Ų | 69 | 41.1 Ų | 41.1 | 48% | 0.483 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -62.2 | -43 | 175.9 | 74.8 | 0 | 0 | 0 | 0 | 112.3 | A468 V469 N470 V475 F476 | A468-S472 WeakPolarHBondContact O-CB 3.41Å; A468-S472 PolarHBondContact O-N 3.36Å; A468-S472 PolarHBondContact O-OG 3.08Å; V469-S472 PolarHBondContact O-N 3.42Å; V469-S472 PolarHBondContact O-OG 3.45Å; N470-S472 VanDerWaalsContact C-N 3.29Å; N470-S472 PolarHBondContact O-N 3.41Å; S472-V475 PolarHBondContact O-N 3.47Å; S472-F476 PolarHBondContact O-N 3.45Å; S472-F476 VanDerWaalsContact O-N 3.09Å |
| 473 | G | 96.9 | Very high | 96.3 | Very high | 0 Ų | 0 | 41.5 Ų | 41.5 | 0% | 0 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -63.7 | -43.5 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | C303 V469 N470 I471 F476 Y477 | C303-G473 VanDerWaalsContact SG-CA 3.59Å; V469-G473 PolarHBondContact O-N 3.3Å; V469-G473 VanDerWaalsContact O-N 3.09Å; N470-G473 PolarHBondContact O-N 2.8Å; I471-G473 PolarHBondContact O-N 3.31Å; G473-F476 PolarHBondContact O-N 3.3Å; G473-Y477 WeakPolarHBondContact O-CB 3.26Å; G473-Y477 PolarHBondContact O-N 3.15Å |
| 474 | L | 97.9 | Very high | 96.2 | Very high | 5 Ų | 5 | 45.9 Ų | 45.9 | 3% | 0.026 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -59.7 | -49.2 | 175.2 | 173.1 | 67.1 | 0 | 0 | 0 | 111.5 | T371 A372 V375 L376 N470 I471 F476 Y477 L478 | T371-L474 HydrophobicContact CG2-CD1 3.81Å; A372-L474 HydrophobicContact CB-CD1 4.06Å; A372-L474 HydrophobicContact CB-CD2 4.48Å; V375-L474 HydrophobicContact CB-CB 4.17Å; V375-L474 HydrophobicContact CB-CD2 4.03Å; V375-L474 HydrophobicContact CB-CG 4.46Å; V375-L474 HydrophobicContact CG1-CB 3.73Å; V375-L474 HydrophobicContact CG1-CD2 3.86Å; V375-L474 HydrophobicContact CG1-CG 4.33Å; V375-L474 HydrophobicContact CG2-CB 4.45Å; L376-L474 HydrophobicContact CD1-CD2 4.22Å; L376-L474 HydrophobicContact CD2-CD2 3.75Å; L376-L474 HydrophobicContact CG-CD2 3.59Å; N470-L474 PolarHBondContact O-N 3.36Å; I471-L474 PolarHBondContact O-N 3Å; L474-F476 VanDerWaalsContact C-N 3.3Å; L474-F476 PolarHBondContact O-N 2.95Å; L474-Y477 PolarHBondContact O-N 2.68Å; L474-Y477 VanDerWaalsContact O-N 3.17Å; L474-L478 HydrophobicContact CD1-CD1 3.89Å; L474-L478 HydrophobicContact CD1-CD2 4.19Å; L474-L478 HydrophobicContact CD1-CG 3.77Å; L474-L478 HydrophobicContact CD2-CD1 4.36Å; L474-L478 HydrophobicContact CG-CD1 3.86Å; L474-L478 HydrophobicContact CG-CG 4.13Å; L474-L478 WeakPolarHBondContact O-CB 3.39Å; L474-L478 VanDerWaalsContact O-CG 3.29Å; L474-L478 WeakPolarHBondContact O-CG 3.44Å; L474-L478 PolarHBondContact O-N 3.43Å |
| 475 | V | 98 | Very high | 96.1 | Very high | 76 Ų | 76 | 45.1 Ų | 45.1 | 46% | 0.461 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -57.9 | -46.6 | 179.9 | 168.7 | 0 | 0 | 0 | 0 | 110.1 | I471 S472 Y477 L478 I479 | I471-V475 HydrophobicContact CG2-CG2 4.38Å; I471-V475 VanDerWaalsContact O-CG2 3.3Å; I471-V475 WeakPolarHBondContact O-CG2 3.22Å; I471-V475 PolarHBondContact O-N 3.34Å; S472-V475 PolarHBondContact O-N 3.47Å; V475-Y477 VanDerWaalsContact C-N 3.35Å; V475-Y477 PolarHBondContact O-N 2.88Å; V475-L478 PolarHBondContact O-N 3.22Å; V475-I479 HydrophobicContact CG1-CD1 3.83Å; V475-I479 WeakPolarHBondContact O-CD1 3.27Å; V475-I479 VanDerWaalsContact O-CG1 3.27Å; V475-I479 WeakPolarHBondContact O-CG1 2.98Å; V475-I479 PolarHBondContact O-N 2.98Å; V475-I479 VanDerWaalsContact O-N 3.13Å |
| 476 | F | 97.9 | Very high | 95.9 | Very high | 55 Ų | 55 | 44.1 Ų | 44.1 | 24% | 0.241 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -61.9 | -42.6 | 177.6 | -167.6 | -98.5 | 0 | 0 | 0 | 112.1 | W295 A296 I299 S472 G473 L474 I479 F480 | W295-F476 HydrophobicContact CB-CE1 4.26Å; A296-F476 HydrophobicContact CB-CD1 4.23Å; A296-F476 HydrophobicContact CB-CE1 4.15Å; I299-F476 HydrophobicContact CB-CD1 4.26Å; I299-F476 HydrophobicContact CD1-CD1 3.75Å; I299-F476 HydrophobicContact CD1-CE1 3.54Å; I299-F476 HydrophobicContact CD1-CG 4.4Å; I299-F476 HydrophobicContact CD1-CZ 4.02Å; I299-F476 HydrophobicContact CG2-CD1 4.42Å; S472-F476 PolarHBondContact O-N 3.45Å; S472-F476 VanDerWaalsContact O-N 3.09Å; G473-F476 PolarHBondContact O-N 3.3Å; L474-F476 VanDerWaalsContact C-N 3.3Å; L474-F476 PolarHBondContact O-N 2.95Å; F476-I479 PolarHBondContact O-N 3.06Å; F476-F480 HydrophobicContact CD1-CD2 4.28Å; F476-F480 AromaticContact CD2-CD2 3.6Å; F476-F480 HydrophobicContact CD2-CD2 3.6Å; F476-F480 AromaticContact CD2-CE2 3.69Å; F476-F480 HydrophobicContact CD2-CE2 3.69Å; F476-F480 HydrophobicContact CE1-CD2 4.06Å; F476-F480 AromaticContact CE2-CD2 3.37Å; F476-F480 HydrophobicContact CE2-CD2 3.37Å; F476-F480 AromaticContact CE2-CE2 3.4Å; F476-F480 HydrophobicContact CE2-CE2 3.4Å; F476-F480 HydrophobicContact CE2-CG 4.47Å; F476-F480 HydrophobicContact CG-CD2 4.05Å; F476-F480 AromaticContact CZ-CD2 3.62Å; F476-F480 HydrophobicContact CZ-CD2 3.62Å; F476-F480 HydrophobicContact CZ-CE2 4.04Å; F476-F480 HydrophobicContact CZ-CG 4.36Å; F476-F480 WeakPolarHBondContact O-CD2 3.32Å; F476-F480 PolarHBondContact O-N 3.21Å |
| 477 | Y | 97.9 | Very high | 95.6 | Very high | 0 Ų | 0 | 50 Ų | 50 | 0% | 0 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -66 | -39.6 | 177.1 | -176.2 | -105.3 | 0 | 0 | 0 | 113.4 | A296 I297 K368 T371 A413 N416 G473 L474 V475 I479 G481 | A296-Y477 HydrophobicContact CB-CD2 4.16Å; I297-Y477 HydrophobicContact CG1-CE2 4.04Å; K368-Y477 HydrophobicContact CG-CE1 4.26Å; T371-Y477 HydrophobicContact CG2-CD1 3.84Å; T371-Y477 HydrophobicContact CG2-CE1 4.16Å; A413-Y477 WeakPolarHBondContact CA-OH 3.31Å; A413-Y477 HydrophobicContact CB-CD1 4.25Å; A413-Y477 HydrophobicContact CB-CD2 4.12Å; A413-Y477 HydrophobicContact CB-CE1 3.83Å; A413-Y477 HydrophobicContact CB-CE2 3.73Å; A413-Y477 HydrophobicContact CB-CG 4.37Å; N416-Y477 PolarHBondContact ND2-OH 2.69Å; G473-Y477 WeakPolarHBondContact O-CB 3.26Å; G473-Y477 PolarHBondContact O-N 3.15Å; L474-Y477 PolarHBondContact O-N 2.68Å; L474-Y477 VanDerWaalsContact O-N 3.17Å; V475-Y477 VanDerWaalsContact C-N 3.35Å; V475-Y477 PolarHBondContact O-N 2.88Å; Y477-I479 VanDerWaalsContact C-N 3.3Å; Y477-I479 PolarHBondContact O-N 3.35Å; Y477-G481 WeakPolarHBondContact O-CA 3.49Å; Y477-G481 PolarHBondContact O-N 2.74Å |
| 478 | L | 97.6 | Very high | 95.2 | Very high | 66 Ų | 66 | 51.3 Ų | 51.3 | 35% | 0.346 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -65.3 | -34.7 | 176.9 | -71 | 178.8 | 0 | 0 | 0 | 112 | K368 L474 V475 | K368-L478 HydrophobicContact CB-CD2 3.73Å; K368-L478 HydrophobicContact CD-CD2 4.14Å; K368-L478 WeakPolarHBondContact CE-O 3.13Å; K368-L478 HydrophobicContact CG-CD2 3.98Å; K368-L478 PolarHBondContact NZ-O 2.82Å; L474-L478 HydrophobicContact CD1-CD1 3.89Å; L474-L478 HydrophobicContact CD1-CD2 4.19Å; L474-L478 HydrophobicContact CD1-CG 3.77Å; L474-L478 HydrophobicContact CD2-CD1 4.36Å; L474-L478 HydrophobicContact CG-CD1 3.86Å; L474-L478 HydrophobicContact CG-CG 4.13Å; L474-L478 WeakPolarHBondContact O-CB 3.39Å; L474-L478 VanDerWaalsContact O-CG 3.29Å; L474-L478 WeakPolarHBondContact O-CG 3.44Å; L474-L478 PolarHBondContact O-N 3.43Å; V475-L478 PolarHBondContact O-N 3.22Å |
| 479 | I | 97.4 | Very high | 94.6 | Very high | 99 Ų | 99 | 48.6 Ų | 48.6 | 51% | 0.508 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -75.7 | -53.2 | 178.7 | -63.8 | 166.1 | 0 | 0 | 0 | 110.8 | V475 F476 Y477 | V475-I479 HydrophobicContact CG1-CD1 3.83Å; V475-I479 WeakPolarHBondContact O-CD1 3.27Å; V475-I479 VanDerWaalsContact O-CG1 3.27Å; V475-I479 WeakPolarHBondContact O-CG1 2.98Å; V475-I479 PolarHBondContact O-N 2.98Å; V475-I479 VanDerWaalsContact O-N 3.13Å; F476-I479 PolarHBondContact O-N 3.06Å; Y477-I479 VanDerWaalsContact C-N 3.3Å; Y477-I479 PolarHBondContact O-N 3.35Å |
| 480 | F | 97.1 | Very high | 93.9 | Very high | 69 Ų | 69 | 52.9 Ų | 52.9 | 30% | 0.303 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -102.9 | -13.3 | -167.5 | -61.9 | -69.2 | 0 | 0 | 0 | 114.9 | L292 A296 F476 R482 | L292-F480 HydrophobicContact CB-CB 4.41Å; L292-F480 HydrophobicContact CB-CD1 4.2Å; L292-F480 HydrophobicContact CD1-CD1 3.96Å; L292-F480 HydrophobicContact CD1-CE1 4.05Å; A296-F480 HydrophobicContact CB-CB 3.95Å; F476-F480 HydrophobicContact CD1-CD2 4.28Å; F476-F480 AromaticContact CD2-CD2 3.6Å; F476-F480 HydrophobicContact CD2-CD2 3.6Å; F476-F480 AromaticContact CD2-CE2 3.69Å; F476-F480 HydrophobicContact CD2-CE2 3.69Å; F476-F480 HydrophobicContact CE1-CD2 4.06Å; F476-F480 AromaticContact CE2-CD2 3.37Å; F476-F480 HydrophobicContact CE2-CD2 3.37Å; F476-F480 AromaticContact CE2-CE2 3.4Å; F476-F480 HydrophobicContact CE2-CE2 3.4Å; F476-F480 HydrophobicContact CE2-CG 4.47Å; F476-F480 HydrophobicContact CG-CD2 4.05Å; F476-F480 AromaticContact CZ-CD2 3.62Å; F476-F480 HydrophobicContact CZ-CD2 3.62Å; F476-F480 HydrophobicContact CZ-CE2 4.04Å; F476-F480 HydrophobicContact CZ-CG 4.36Å; F476-F480 WeakPolarHBondContact O-CD2 3.32Å; F476-F480 PolarHBondContact O-N 3.21Å; F480-R482 PolarHBondContact O-N 3.07Å |
| 481 | G | 94.8 | Very high | 92.6 | Very high | 0 Ų | 0 | 58.5 Ų | 58.5 | 0% | 0 | 30% | 0.295 | C | S | . | . | trans | -61.7 | 132.1 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | K368 Y477 | K368-G481 WeakPolarHBondContact CE-O 3.31Å; K368-G481 PolarHBondContact NZ-O 3.23Å; Y477-G481 WeakPolarHBondContact O-CA 3.49Å; Y477-G481 PolarHBondContact O-N 2.74Å | ||
| 482 | R | 95.3 | Very high | 90.7 | Very high | 127 Ų | 127 | 63.2 Ų | 63.2 | 48% | 0.479 | 32% | 0.315 | S | S | . | . | trans | -129.5 | 157.1 | 173.9 | -61 | -67 | -174.4 | -153.9 | -2.5 | 108.8 | P293 N416 I420 F480 | P293-R482 HydrophobicContact CB-CB 3.99Å; P293-R482 HydrophobicContact CB-CG 4.12Å; P293-R482 HydrophobicContact CG-CB 3.99Å; P293-R482 HydrophobicContact CG-CG 3.6Å; N416-R482 PolarHBondContact ND2-O 2.96Å; N416-R482 PolarHBondContact OD1-O 3.49Å; N416-R482 VanDerWaalsContact OD1-O 3.06Å; I420-R482 VanDerWaalsContact CG2-O 3.28Å; I420-R482 WeakPolarHBondContact CG2-O 3.33Å; F480-R482 PolarHBondContact O-N 3.07Å | ||
| 483 | A | 92.3 | Very high | 88.2 | Confident | 10 Ų | 10 | 65.8 Ų | 65.8 | 8% | 0.083 | 33% | 0.328 | C | S | . | . | trans | -128.3 | 21.1 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.2 | L363 I364 R367 D419 | L363-A483 HydrophobicContact CD2-CB 4.12Å; L363-A483 HydrophobicContact CG-CB 4.04Å; I364-A483 HydrophobicContact CB-CB 3.9Å; I364-A483 HydrophobicContact CD1-CB 3.9Å; I364-A483 HydrophobicContact CG1-CB 4.43Å; R367-A483 HydrophobicContact CG-CB 4.47Å; D419-A483 HydrophobicContact CB-CB 4.19Å | ||
| 484 | D | 92.4 | Very high | 85.7 | Confident | 108 Ų | 108 | 73.4 Ų | 73.4 | 58% | 0.578 | 36% | 0.362 | S | S | * | . | S | Bend | trans | -102.5 | 145.4 | 174.2 | -52.4 | -65.3 | 0 | 0 | 0 | 108.7 | Q486 | D484-Q486 PolarHBondContact O-N 3.42Å; D484-Q486 PolarHBondContact O-NE2 3.45Å |
| 485 | V | 90.7 | Very high | 82.8 | Confident | 58 Ų | 58 | 78.6 Ų | 78.6 | 35% | 0.352 | 39% | 0.393 | S | S | . | . | P | Polyproline II helix | trans | -58.5 | 124.7 | 178.4 | -175.8 | 0 | 0 | 0 | 0 | 109.6 | I420 P422 A489 K490 | I420-V485 WeakPolarHBondContact O-CA 3.39Å; P422-V485 HydrophobicContact CG-CG2 4.45Å; V485-A489 HydrophobicContact CG1-CB 4.05Å; V485-K490 HydrophobicContact CG1-CG 3.98Å; V485-K490 WeakPolarHBondContact O-CE 3.22Å |
| 486 | Q | 91.8 | Very high | 80.1 | Confident | 31 Ų | 31 | 83.9 Ų | 83.9 | 15% | 0.145 | 41% | 0.413 | C | S | . | . | P | Polyproline II helix | trans | -75.1 | 152.4 | -176.4 | -61.2 | -61.6 | -67.8 | 0 | 0 | 111.5 | I420 D484 W488 A489 K490 | I420-Q486 HydrophobicContact CB-CG 3.96Å; I420-Q486 HydrophobicContact CG2-CG 4.45Å; I420-Q486 PolarHBondContact O-N 3.4Å; D484-Q486 PolarHBondContact O-N 3.42Å; D484-Q486 PolarHBondContact O-NE2 3.45Å; Q486-W488 VanDerWaalsContact C-N 3.26Å; Q486-W488 HydrophobicContact CB-CD2 4.27Å; Q486-W488 HydrophobicContact CB-CG 4.37Å; Q486-W488 HydrophobicContact CB-CZ2 4.09Å; Q486-W488 VanDerWaalsContact CB-NE1 3.35Å; Q486-W488 HydrophobicContact CG-CZ2 4.24Å; Q486-W488 PolarHBondContact O-N 3.48Å; Q486-A489 CarbonylContact O-C 3.56Å; Q486-A489 WeakPolarHBondContact O-CA 3.14Å; Q486-A489 WeakPolarHBondContact O-CB 3.43Å; Q486-A489 PolarHBondContact O-N 3.14Å; Q486-K490 PolarHBondContact O-N 2.97Å; Q486-K490 VanDerWaalsContact O-N 3.16Å |
| 487 | D | 88.8 | Confident | 77.4 | Confident | 124 Ų | 124 | 92.3 Ų | 92.3 | 66% | 0.663 | 46% | 0.459 | S | S | * | . | G | 310 helix | trans | -61.4 | -34.1 | -173 | -60.7 | -38.5 | 0 | 0 | 0 | 113.5 | A489 K490 | D487-A489 PolarHBondContact O-N 3.18Å; D487-K490 PolarHBondContact O-N 3.03Å; D487-K490 IonicContact OD1-NZ 3.05Å; D487-K490 PolarHBondContact OD1-NZ 3.45Å |
| 488 | W | 88.3 | Confident | 76.4 | Confident | 37 Ų | 37 | 96.9 Ų | 96.9 | 14% | 0.14 | 48% | 0.482 | C | S | . | . | G | 310 helix | trans | -71.8 | -11 | 174.4 | 57.4 | -98.8 | 0 | 0 | 0 | 113.7 | P284 A287 M288 S291 I420 A421 Y424 L428 Q486 | P284-W488 HydrophobicContact CG-CB 4.47Å; P284-W488 HydrophobicContact CG-CE3 4.14Å; A287-W488 HydrophobicContact CB-CB 3.63Å; A287-W488 HydrophobicContact CB-CG 4.18Å; M288-W488 HydrophobicContact CE-CH2 3.93Å; M288-W488 HydrophobicContact CE-CZ3 3.81Å; M288-W488 HydrophobicContact CG-CD2 4.01Å; M288-W488 HydrophobicContact CG-CE3 3.63Å; M288-W488 HydrophobicContact CG-CH2 4.01Å; M288-W488 HydrophobicContact CG-CZ2 4.37Å; M288-W488 HydrophobicContact CG-CZ3 3.62Å; M288-W488 HydrophobicContact SD-CE3 4.44Å; M288-W488 HydrophobicContact SD-CZ3 4.07Å; S291-W488 VanDerWaalsContact CB-NE1 3.33Å; S291-W488 PolarHBondContact OG-NE1 3.06Å; S291-W488 VanDerWaalsContact OG-NE1 3.11Å; I420-W488 HydrophobicContact CD1-CZ2 4.44Å; A421-W488 HydrophobicContact CB-CH2 3.37Å; A421-W488 HydrophobicContact CB-CZ2 4.23Å; A421-W488 HydrophobicContact CB-CZ3 3.65Å; Y424-W488 AromaticContact CD2-CE3 3.99Å; Y424-W488 HydrophobicContact CD2-CE3 3.99Å; Y424-W488 AromaticContact CD2-CZ3 3.58Å; Y424-W488 HydrophobicContact CD2-CZ3 3.58Å; Y424-W488 HydrophobicContact CE2-CE3 4.05Å; Y424-W488 HydrophobicContact CE2-CZ3 4.12Å; Y424-W488 HydrophobicContact CG-CZ3 4.41Å; L428-W488 HydrophobicContact CD1-CH2 4.27Å; Q486-W488 VanDerWaalsContact C-N 3.26Å; Q486-W488 HydrophobicContact CB-CD2 4.27Å; Q486-W488 HydrophobicContact CB-CG 4.37Å; Q486-W488 HydrophobicContact CB-CZ2 4.09Å; Q486-W488 VanDerWaalsContact CB-NE1 3.35Å; Q486-W488 HydrophobicContact CG-CZ2 4.24Å; Q486-W488 PolarHBondContact O-N 3.48Å |
| 489 | A | 83.9 | Confident | 75.3 | Confident | 3 Ų | 3 | 98.5 Ų | 98.5 | 3% | 0.025 | 49% | 0.489 | C | S | . | . | G | 310 helix | trans | -105.6 | -5.9 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.9 | A421 Y424 V485 Q486 D487 | A421-A489 HydrophobicContact CB-CB 3.62Å; Y424-A489 HydrophobicContact CD2-CB 4.22Å; Y424-A489 HydrophobicContact CE2-CB 4.29Å; V485-A489 HydrophobicContact CG1-CB 4.05Å; Q486-A489 CarbonylContact O-C 3.56Å; Q486-A489 WeakPolarHBondContact O-CA 3.14Å; Q486-A489 WeakPolarHBondContact O-CB 3.43Å; Q486-A489 PolarHBondContact O-N 3.14Å; D487-A489 PolarHBondContact O-N 3.18Å |
| 490 | K | 82.4 | Confident | 74.1 | Confident | 111 Ų | 111 | 98.5 Ų | 98.5 | 48% | 0.483 | 49% | 0.488 | S | S | . | . | S | Bend | trans | -78.7 | 153.7 | 173.9 | -68.5 | 175.9 | -172 | 160.3 | 0 | 110.8 | V485 Q486 D487 Q492 | V485-K490 HydrophobicContact CG1-CG 3.98Å; V485-K490 WeakPolarHBondContact O-CE 3.22Å; Q486-K490 PolarHBondContact O-N 2.97Å; Q486-K490 VanDerWaalsContact O-N 3.16Å; D487-K490 PolarHBondContact O-N 3.03Å; D487-K490 IonicContact OD1-NZ 3.05Å; D487-K490 PolarHBondContact OD1-NZ 3.45Å; K490-Q492 PolarHBondContact O-N 3.31Å |
| 491 | E | 68.8 | Low | 72.7 | Confident | 124 Ų | 124 | 100.2 Ų | 100.2 | 58% | 0.579 | 50% | 0.499 | S | S | * | . | trans | -68 | 125.2 | 171.4 | -164.1 | 145.7 | -116.3 | 0 | 0 | 109.4 | R423 T493 | R423-E491 IonicContact CZ-OE1 2.78Å; R423-E491 IonicContact NH1-OE1 2.84Å; R423-E491 PolarHBondContact NH1-OE1 2.85Å; R423-E491 IonicContact NH2-OE1 3.66Å; R423-E491 PolarHBondContact NH2-OE1 2.61Å; R423-E491 IonicContact NH2-OE2 3.32Å; R423-E491 PolarHBondContact NH2-OE2 2.97Å; E491-T493 VanDerWaalsContact C-N 3.34Å; E491-T493 PolarHBondContact O-N 2.94Å | ||
| 492 | Q | 57.9 | Low | 71.3 | Confident | 155 Ų | 155 | 106.5 Ų | 106.5 | 72% | 0.724 | 53% | 0.53 | S | S | * | . | trans | -73.4 | 96.2 | 166.7 | -74.9 | -176.5 | -14.5 | 0 | 0 | 107.1 | K490 F494 | K490-Q492 PolarHBondContact O-N 3.31Å; Q492-F494 VanDerWaalsContact C-N 3.27Å; Q492-F494 HydrophobicContact CB-CD2 4.32Å; Q492-F494 HydrophobicContact CB-CE2 4.15Å; Q492-F494 PolarHBondContact O-N 2.66Å | ||
| 493 | T | 43.6 | Very low | 69.7 | Low | 123 Ų | 123 | 105.1 Ų | 105.1 | 76% | 0.755 | 53% | 0.534 | S | S | * | . | trans | -65.7 | 94.1 | 165.8 | -15.3 | 0 | 0 | 0 | 0 | 106.8 | E491 T495 | E491-T493 VanDerWaalsContact C-N 3.34Å; E491-T493 PolarHBondContact O-N 2.94Å; T493-T495 PolarHBondContact O-N 3.29Å | ||
| 494 | F | 45.8 | Very low | 68.1 | Low | 161 Ų | 161 | 111.9 Ų | 111.9 | 71% | 0.706 | 57% | 0.566 | S | S | * | * | trans | -66.8 | 92.7 | 164.7 | -80.9 | -83.3 | 0 | 0 | 0 | 106.7 | Q492 H496 | Q492-F494 VanDerWaalsContact C-N 3.27Å; Q492-F494 HydrophobicContact CB-CD2 4.32Å; Q492-F494 HydrophobicContact CB-CE2 4.15Å; Q492-F494 PolarHBondContact O-N 2.66Å; F494-H496 VanDerWaalsContact C-N 3.31Å; F494-H496 PolarHBondContact O-N 3.01Å | ||
| 495 | T | 36.1 | Very low | 66.2 | Low | 113 Ų | 113 | 112.2 Ų | 112.2 | 69% | 0.693 | 57% | 0.565 | S | S | * | * | trans | -63.7 | 100 | 160.3 | 41.9 | 0 | 0 | 0 | 0 | 106.4 | T493 L497 | T493-T495 PolarHBondContact O-N 3.29Å; T495-L497 VanDerWaalsContact C-N 3.32Å; T495-L497 PolarHBondContact O-N 3.45Å | ||
| 496 | H | 41.8 | Very low | 64.2 | Low | 188 Ų | 188 | 116.8 Ų | 116.8 | 87% | 0.87 | 58% | 0.583 | S | S | * | * | trans | -59.5 | 102.3 | 159.6 | -86.4 | -85.4 | 0 | 0 | 0 | 106.6 | F494 | F494-H496 VanDerWaalsContact C-N 3.31Å; F494-H496 PolarHBondContact O-N 3.01Å | ||
| 497 | L | 41.2 | Very low | 61.7 | Low | 231 Ų | 231 | 124.5 Ų | 124.5 | 100% | 1.209 | 62% | 0.623 | S | S | * | * | trans | -79.1 | 0 | 169.7 | -91.6 | 161.2 | 0 | 0 | 0 | 110.1 | T495 | T495-L497 VanDerWaalsContact C-N 3.32Å; T495-L497 PolarHBondContact O-N 3.45Å |
Retrieved 497 of 497 residues in 173.5 ms
(Link to these results)