| 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 | 36.6 | Very low | 62 | Low | 207 Ų | 207 | 114.7 Ų | 114.7 | 100% | 1.02 | 59% | 0.585 | S | S | * | * | 0 | -29.6 | 0 | -78.6 | -175.5 | -97.8 | 0 | 0 | 112.1 | N3 S4 | M1-N3 PolarHBondContact O-N 3.48Å; M1-S4 PolarHBondContact O-OG 2.86Å | |||
| 2 | E | 49.1 | Very low | 63.4 | Low | 148 Ų | 148 | 116.7 Ų | 116.7 | 69% | 0.692 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -65.4 | -30.3 | 178.7 | -75 | 171.9 | 155.6 | 0 | 0 | 115.9 | S4 W5 | E2-S4 VanDerWaalsContact C-N 3.32Å; E2-S4 PolarHBondContact O-N 3.14Å; E2-W5 HydrophobicContact CG-CZ3 4.43Å |
| 3 | N | 55.3 | Low | 64.3 | Low | 101 Ų | 101 | 122.1 Ų | 122.1 | 54% | 0.54 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -72 | -19 | -175.6 | -59.5 | -9.3 | 0 | 0 | 0 | 114.6 | M1 N7 | M1-N3 PolarHBondContact O-N 3.48Å; N3-N7 PolarHBondContact O-N 2.88Å |
| 4 | S | 61.7 | Low | 64.8 | Low | 62 Ų | 62 | 115.6 Ų | 115.6 | 43% | 0.434 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -68.5 | -41 | -177.8 | 59.7 | 0 | 0 | 0 | 0 | 111.3 | M1 E2 A6 N7 E8 | M1-S4 PolarHBondContact O-OG 2.86Å; E2-S4 VanDerWaalsContact C-N 3.32Å; E2-S4 PolarHBondContact O-N 3.14Å; S4-A6 VanDerWaalsContact C-N 3.34Å; S4-A6 PolarHBondContact O-N 3.19Å; S4-N7 PolarHBondContact O-N 3.44Å; S4-E8 WeakPolarHBondContact O-CB 3.43Å; S4-E8 PolarHBondContact O-N 2.98Å |
| 5 | W | 61.1 | Low | 65.2 | Low | 173 Ų | 173 | 116.3 Ų | 116.3 | 66% | 0.655 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -69.3 | -31.1 | -179.6 | -59.9 | -60.5 | 0 | 0 | 0 | 113.3 | E2 C9 | E2-W5 HydrophobicContact CG-CZ3 4.43Å; W5-C9 VanDerWaalsContact O-CB 3.26Å; W5-C9 WeakPolarHBondContact O-CB 3.46Å; W5-C9 PolarHBondContact O-N 3.5Å |
| 6 | A | 61.2 | Low | 65.3 | Low | 48 Ų | 48 | 112.2 Ų | 112.2 | 40% | 0.397 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -71.3 | -47 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | S4 E8 C9 E10 | S4-A6 VanDerWaalsContact C-N 3.34Å; S4-A6 PolarHBondContact O-N 3.19Å; A6-E8 VanDerWaalsContact C-N 3.34Å; A6-E8 PolarHBondContact O-N 3.5Å; A6-C9 WeakPolarHBondContact O-CB 3.32Å; A6-C9 PolarHBondContact O-N 2.93Å; A6-E10 PolarHBondContact O-N 3.35Å |
| 7 | N | 66.1 | Low | 65.1 | Low | 94 Ų | 94 | 112.8 Ų | 112.8 | 50% | 0.503 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -63.3 | -41.4 | 176.3 | -66.5 | -1.9 | 0 | 0 | 0 | 111.3 | N3 S4 C9 E10 D11 | N3-N7 PolarHBondContact O-N 2.88Å; S4-N7 PolarHBondContact O-N 3.44Å; N7-C9 VanDerWaalsContact C-N 3.26Å; N7-C9 PolarHBondContact O-N 3.24Å; N7-E10 PolarHBondContact O-N 3.38Å; N7-D11 WeakPolarHBondContact O-CB 3.29Å; N7-D11 PolarHBondContact O-N 2.91Å |
| 8 | E | 73.2 | Confident | 65.5 | Low | 115 Ų | 115 | 109.3 Ų | 109.3 | 54% | 0.537 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -67.8 | -27.2 | 177.7 | -166.5 | 156.2 | -163.5 | 0 | 0 | 112.3 | S4 A6 L12 | S4-E8 WeakPolarHBondContact O-CB 3.43Å; S4-E8 PolarHBondContact O-N 2.98Å; A6-E8 VanDerWaalsContact C-N 3.34Å; A6-E8 PolarHBondContact O-N 3.5Å; E8-L12 HydrophobicContact CG-CD1 4.47Å; E8-L12 WeakPolarHBondContact O-CB 3.27Å; E8-L12 WeakPolarHBondContact O-CD1 3.41Å; E8-L12 VanDerWaalsContact O-CG 3.25Å; E8-L12 WeakPolarHBondContact O-CG 3.27Å; E8-L12 PolarHBondContact O-N 3.02Å |
| 9 | C | 70.9 | Confident | 65.5 | Low | 46 Ų | 46 | 112.4 Ų | 112.4 | 31% | 0.311 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -73.3 | -41 | 171.7 | -170.9 | 0 | 0 | 0 | 0 | 112.2 | W5 A6 N7 L12 G14 | W5-C9 VanDerWaalsContact O-CB 3.26Å; W5-C9 WeakPolarHBondContact O-CB 3.46Å; W5-C9 PolarHBondContact O-N 3.5Å; A6-C9 WeakPolarHBondContact O-CB 3.32Å; A6-C9 PolarHBondContact O-N 2.93Å; N7-C9 VanDerWaalsContact C-N 3.26Å; N7-C9 PolarHBondContact O-N 3.24Å; C9-L12 PolarHBondContact O-N 3.32Å; C9-G14 WeakPolarHBondContact O-CA 3.34Å; C9-G14 PolarHBondContact O-N 3.39Å |
| 10 | E | 69.5 | Low | 65.4 | Low | 128 Ų | 128 | 114.5 Ų | 114.5 | 60% | 0.598 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -66 | -40.8 | 173.6 | -75.3 | -174.7 | 171.2 | 0 | 0 | 112.1 | A6 N7 L12 E13 | A6-E10 PolarHBondContact O-N 3.35Å; N7-E10 PolarHBondContact O-N 3.38Å; E10-L12 PolarHBondContact O-N 2.86Å; E10-E13 PolarHBondContact O-N 3.47Å; E10-E13 VanDerWaalsContact O-N 3.11Å |
| 11 | D | 77.7 | Confident | 65.3 | Low | 140 Ų | 140 | 112 Ų | 112 | 75% | 0.749 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -63.1 | -24.1 | 175.7 | -76 | -21.4 | 0 | 0 | 0 | 112.5 | N7 | N7-D11 WeakPolarHBondContact O-CB 3.29Å; N7-D11 PolarHBondContact O-N 2.91Å |
| 12 | L | 78.7 | Confident | 66.5 | Low | 138 Ų | 138 | 109.5 Ų | 109.5 | 72% | 0.723 | 60% | 0.596 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.4 | 17.5 | 177.2 | -69.5 | 169.9 | 0 | 0 | 0 | 113.3 | E8 C9 E10 G14 | E8-L12 HydrophobicContact CG-CD1 4.47Å; E8-L12 WeakPolarHBondContact O-CB 3.27Å; E8-L12 WeakPolarHBondContact O-CD1 3.41Å; E8-L12 VanDerWaalsContact O-CG 3.25Å; E8-L12 WeakPolarHBondContact O-CG 3.27Å; E8-L12 PolarHBondContact O-N 3.02Å; C9-L12 PolarHBondContact O-N 3.32Å; E10-L12 PolarHBondContact O-N 2.86Å; L12-G14 PolarHBondContact O-N 3.45Å; L12-G14 VanDerWaalsContact O-N 3.09Å |
| 13 | E | 75.1 | Confident | 67.2 | Low | 187 Ų | 187 | 109.1 Ų | 109.1 | 87% | 0.874 | 59% | 0.593 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 55 | 23.4 | -176.9 | -63.8 | -177.4 | 163 | 0 | 0 | 114 | E10 | E10-E13 PolarHBondContact O-N 3.47Å; E10-E13 VanDerWaalsContact O-N 3.11Å |
| 14 | G | 70.7 | Confident | 67.8 | Low | 32 Ų | 32 | 108 Ų | 108 | 33% | 0.33 | 58% | 0.583 | S | S | . | * | trans | -78 | 132 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112 | C9 L12 | C9-G14 WeakPolarHBondContact O-CA 3.34Å; C9-G14 PolarHBondContact O-N 3.39Å; L12-G14 PolarHBondContact O-N 3.45Å; L12-G14 VanDerWaalsContact O-N 3.09Å | ||
| 15 | V | 71.2 | Confident | 68.2 | Low | 126 Ų | 126 | 108.1 Ų | 108.1 | 76% | 0.764 | 58% | 0.582 | S | S | * | * | trans | -90.6 | 107.1 | 170.8 | -177.3 | 0 | 0 | 0 | 0 | 108.8 | T17 | V15-T17 HydrophobicContact CG1-CG2 3.99Å; V15-T17 PolarHBondContact O-N 2.79Å; V15-T17 VanDerWaalsContact O-N 3.14Å | ||
| 16 | A | 66.2 | Low | 69.2 | Low | 50 Ų | 50 | 104.3 Ų | 104.3 | 41% | 0.413 | 58% | 0.575 | S | S | . | * | trans | -71.6 | 105.8 | 174.9 | 0 | 0 | 0 | 0 | 0 | 110.3 | C21 | A16-C21 HydrophobicContact CB-CB 3.71Š| ||
| 17 | T | 63.2 | Low | 70.4 | Confident | 122 Ų | 122 | 103.1 Ų | 103.1 | 75% | 0.748 | 56% | 0.563 | S | S | * | * | trans | -102.2 | 115.5 | 179.7 | 58 | 0 | 0 | 0 | 0 | 111.6 | V15 | V15-T17 HydrophobicContact CG1-CG2 3.99Å; V15-T17 PolarHBondContact O-N 2.79Å; V15-T17 VanDerWaalsContact O-N 3.14Å | ||
| 18 | G | 70.7 | Confident | 71.3 | Confident | 51 Ų | 51 | 106.2 Ų | 106.2 | 53% | 0.526 | 57% | 0.572 | S | S | . | * | S | Bend | trans | 156.5 | 152.1 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | Q20 C21 | G18-Q20 PolarHBondContact O-N 2.96Å; G18-Q20 VanDerWaalsContact O-N 3.15Å; G18-C21 PolarHBondContact O-N 2.84Å |
| 19 | L | 65.8 | Low | 72 | Confident | 167 Ų | 167 | 103.9 Ų | 103.9 | 87% | 0.874 | 57% | 0.568 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.3 | -24.2 | 178 | -76.2 | 153.8 | 0 | 0 | 0 | 113 | ||
| 20 | Q | 64.4 | Low | 72.9 | Confident | 155 Ų | 155 | 102.6 Ų | 102.6 | 72% | 0.724 | 56% | 0.557 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.3 | -19.4 | -177.9 | -114.1 | 83.3 | -31 | 0 | 0 | 114.5 | G18 H22 F23 | G18-Q20 PolarHBondContact O-N 2.96Å; G18-Q20 VanDerWaalsContact O-N 3.15Å; Q20-H22 PolarHBondContact O-N 2.65Å; Q20-F23 WeakPolarHBondContact O-CB 3.29Å; Q20-F23 PolarHBondContact O-N 2.84Å; Q20-F23 VanDerWaalsContact O-N 3.16Å |
| 21 | C | 62.6 | Low | 73.9 | Confident | 61 Ų | 61 | 99.1 Ų | 99.1 | 41% | 0.412 | 55% | 0.547 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -66.7 | -32.5 | -168.2 | -68.3 | 0 | 0 | 0 | 0 | 114.1 | A16 G18 | A16-C21 HydrophobicContact CB-CB 3.71Å; G18-C21 PolarHBondContact O-N 2.84Å |
| 22 | H | 61.1 | Low | 74.6 | Confident | 155 Ų | 155 | 96.1 Ų | 96.1 | 72% | 0.718 | 53% | 0.531 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -109.3 | 14.1 | 173.9 | -73.6 | -77.6 | 0 | 0 | 0 | 112.7 | Q20 K24 | Q20-H22 PolarHBondContact O-N 2.65Å; H22-K24 PolarHBondContact O-N 3.03Å |
| 23 | F | 64.2 | Low | 75.3 | Confident | 141 Ų | 141 | 94.3 Ų | 94.3 | 62% | 0.618 | 52% | 0.521 | S | S | * | . | trans | -76.4 | 97.9 | -176.8 | -172.1 | -100.3 | 0 | 0 | 0 | 110.2 | Q20 P25 | Q20-F23 WeakPolarHBondContact O-CB 3.29Å; Q20-F23 PolarHBondContact O-N 2.84Å; Q20-F23 VanDerWaalsContact O-N 3.16Å; F23-P25 HydrophobicContact CD1-CB 4.46Å; F23-P25 HydrophobicContact CE1-CB 3.88Å; F23-P25 VanDerWaalsContact O-CD 3.3Å; F23-P25 WeakPolarHBondContact O-CD 3.47Å | ||
| 24 | K | 69.3 | Low | 76.1 | Confident | 77 Ų | 77 | 86.6 Ų | 86.6 | 34% | 0.335 | 49% | 0.486 | S | S | . | . | trans | -96.4 | 99.7 | 172.9 | -163.1 | 166.6 | 179.9 | 152.1 | 0 | 109.6 | H22 D26 V27 P84 | H22-K24 PolarHBondContact O-N 3.03Å; K24-D26 VanDerWaalsContact C-N 3.26Å; K24-D26 PolarHBondContact O-N 3.2Å; K24-V27 HydrophobicContact CB-CB 4.49Å; K24-V27 HydrophobicContact CB-CG2 3.75Å; K24-V27 HydrophobicContact CD-CG2 3.6Å; K24-V27 HydrophobicContact CG-CG2 3.65Å; K24-V27 PolarHBondContact O-N 2.81Å; K24-P84 HydrophobicContact CD-CG 3.71Å; K24-P84 VanDerWaalsContact NZ-CD 3.3Å | ||
| 25 | P | 70.4 | Confident | 77.1 | Confident | 64 Ų | 64 | 91 Ų | 91 | 42% | 0.416 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -60.4 | -33.9 | -169 | 22 | -33 | 0 | 0 | 0 | 113.3 | F23 V27 | F23-P25 HydrophobicContact CD1-CB 4.46Å; F23-P25 HydrophobicContact CE1-CB 3.88Å; F23-P25 VanDerWaalsContact O-CD 3.3Å; F23-P25 WeakPolarHBondContact O-CD 3.47Å; P25-V27 VanDerWaalsContact C-N 3.32Å; P25-V27 PolarHBondContact O-N 3.41Å |
| 26 | D | 81.9 | Confident | 78.3 | Confident | 94 Ų | 94 | 90 Ų | 90 | 50% | 0.503 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -76.4 | -17 | -174.9 | -57 | -31.4 | 0 | 0 | 0 | 113.9 | K24 S29 F30 | K24-D26 VanDerWaalsContact C-N 3.26Å; K24-D26 PolarHBondContact O-N 3.2Å; D26-S29 PolarHBondContact O-OG 3.27Å; D26-S29 VanDerWaalsContact O-OG 3.13Å; D26-F30 VanDerWaalsContact O-CB 3.26Å; D26-F30 WeakPolarHBondContact O-CB 3.4Å; D26-F30 PolarHBondContact O-N 3.43Å; D26-F30 VanDerWaalsContact O-N 3.13Å |
| 27 | V | 85 | Confident | 79.7 | Confident | 23 Ų | 23 | 88.8 Ų | 88.8 | 14% | 0.139 | 47% | 0.474 | C | S | . | . | H | α-helix | trans | -71.4 | -40.1 | -176.5 | 175.4 | 0 | 0 | 0 | 0 | 111 | K24 P25 S31 I85 | K24-V27 HydrophobicContact CB-CB 4.49Å; K24-V27 HydrophobicContact CB-CG2 3.75Å; K24-V27 HydrophobicContact CD-CG2 3.6Å; K24-V27 HydrophobicContact CG-CG2 3.65Å; K24-V27 PolarHBondContact O-N 2.81Å; P25-V27 VanDerWaalsContact C-N 3.32Å; P25-V27 PolarHBondContact O-N 3.41Å; V27-S31 WeakPolarHBondContact O-CB 3.41Å; V27-S31 PolarHBondContact O-N 3.11Å; V27-I85 HydrophobicContact CG1-CG1 4.29Å |
| 28 | F | 86.1 | Confident | 81.2 | Confident | 159 Ų | 159 | 84.7 Ų | 84.7 | 70% | 0.697 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -67.5 | -49 | -178.8 | 177.9 | -102.2 | 0 | 0 | 0 | 111.8 | F30 S31 L32 | F28-F30 VanDerWaalsContact C-N 3.31Å; F28-F30 PolarHBondContact O-N 2.73Å; F28-S31 PolarHBondContact O-N 3.31Å; F28-L32 PolarHBondContact O-N 3.1Å |
| 29 | S | 87.8 | Confident | 82.4 | Confident | 66 Ų | 66 | 84.6 Ų | 84.6 | 46% | 0.462 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -62.3 | -39.4 | 178.8 | 58.6 | 0 | 0 | 0 | 0 | 111.5 | D26 L32 L33 | D26-S29 PolarHBondContact O-OG 3.27Å; D26-S29 VanDerWaalsContact O-OG 3.13Å; S29-L32 WeakPolarHBondContact O-CB 3.48Å; S29-L32 PolarHBondContact O-N 3.17Å; S29-L33 PolarHBondContact O-N 3.36Å |
| 30 | F | 90.4 | Very high | 83.9 | Confident | 18 Ų | 18 | 82.2 Ų | 82.2 | 8% | 0.079 | 43% | 0.429 | C | S | . | . | H | α-helix | trans | -70 | -38.3 | 176.2 | -171.5 | -123.9 | 0 | 0 | 0 | 112.8 | D26 F28 L32 L33 L34 V77 V81 L83 I85 | D26-F30 VanDerWaalsContact O-CB 3.26Å; D26-F30 WeakPolarHBondContact O-CB 3.4Å; D26-F30 PolarHBondContact O-N 3.43Å; D26-F30 VanDerWaalsContact O-N 3.13Å; F28-F30 VanDerWaalsContact C-N 3.31Å; F28-F30 PolarHBondContact O-N 2.73Å; F30-L32 VanDerWaalsContact C-N 3.27Å; F30-L32 PolarHBondContact O-N 3.25Å; F30-L33 HydrophobicContact CD2-CD2 4.28Å; F30-L33 HydrophobicContact CE2-CD2 4.15Å; F30-L33 CarbonylContact O-C 3.59Å; F30-L33 WeakPolarHBondContact O-CB 3.36Å; F30-L33 PolarHBondContact O-N 2.81Å; F30-L34 HydrophobicContact CD1-CD1 4.16Å; F30-L34 HydrophobicContact CD1-CG 4.4Å; F30-L34 HydrophobicContact CE1-CD1 3.8Å; F30-L34 HydrophobicContact CE1-CD2 4.31Å; F30-L34 HydrophobicContact CE1-CG 4.08Å; F30-L34 HydrophobicContact CE2-CD2 4.21Å; F30-L34 HydrophobicContact CE2-CG 4.32Å; F30-L34 HydrophobicContact CZ-CD1 4.18Å; F30-L34 HydrophobicContact CZ-CD2 3.84Å; F30-L34 HydrophobicContact CZ-CG 4.02Å; F30-L34 WeakPolarHBondContact O-CG 3.23Å; F30-L34 PolarHBondContact O-N 3.1Å; F30-V77 HydrophobicContact CE2-CG1 4.39Å; F30-V77 HydrophobicContact CZ-CG1 4.26Å; F30-V81 HydrophobicContact CD1-CG1 4.31Å; F30-V81 HydrophobicContact CD2-CG1 4.26Å; F30-V81 HydrophobicContact CE1-CB 4.01Å; F30-V81 HydrophobicContact CE1-CG1 3.87Å; F30-V81 HydrophobicContact CE2-CB 4.02Å; F30-V81 HydrophobicContact CE2-CG1 3.82Å; F30-V81 HydrophobicContact CE2-CG2 3.9Å; F30-V81 HydrophobicContact CZ-CB 3.52Å; F30-V81 HydrophobicContact CZ-CG1 3.62Å; F30-V81 HydrophobicContact CZ-CG2 3.77Å; F30-L83 HydrophobicContact CB-CD1 3.64Å; F30-L83 HydrophobicContact CD1-CB 4.04Å; F30-L83 HydrophobicContact CD1-CD1 3.54Å; F30-L83 HydrophobicContact CD1-CG 4.34Å; F30-L83 HydrophobicContact CD2-CD1 4.35Å; F30-L83 HydrophobicContact CE1-CB 4.43Å; F30-L83 HydrophobicContact CE1-CD1 4.28Å; F30-L83 HydrophobicContact CG-CD1 3.6Å; F30-I85 HydrophobicContact CD1-CD1 3.18Å; F30-I85 HydrophobicContact CD1-CG1 3.99Å; F30-I85 HydrophobicContact CE1-CD1 3.39Å; F30-I85 HydrophobicContact CE1-CG1 4.49Å; F30-I85 HydrophobicContact CG-CD1 4.38Å |
| 31 | S | 89.9 | Confident | 85.4 | Confident | 56 Ų | 56 | 76.7 Ų | 76.7 | 39% | 0.392 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -60.8 | -37.8 | 172 | -174.1 | 0 | 0 | 0 | 0 | 111.9 | V27 F28 L34 F35 | V27-S31 WeakPolarHBondContact O-CB 3.41Å; V27-S31 PolarHBondContact O-N 3.11Å; F28-S31 PolarHBondContact O-N 3.31Å; S31-L34 PolarHBondContact O-N 2.82Å; S31-F35 WeakPolarHBondContact O-CB 3.44Å; S31-F35 PolarHBondContact O-N 3.31Å |
| 32 | L | 91.9 | Very high | 86.9 | Confident | 76 Ų | 76 | 75 Ų | 75 | 40% | 0.398 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -66.1 | -41.2 | 175.2 | -166.7 | 68.5 | 0 | 0 | 0 | 111.3 | F28 S29 F30 F35 F36 | F28-L32 PolarHBondContact O-N 3.1Å; S29-L32 WeakPolarHBondContact O-CB 3.48Å; S29-L32 PolarHBondContact O-N 3.17Å; F30-L32 VanDerWaalsContact C-N 3.27Å; F30-L32 PolarHBondContact O-N 3.25Å; L32-F35 PolarHBondContact O-N 3.49Å; L32-F36 HydrophobicContact CD1-CD2 3.87Å; L32-F36 HydrophobicContact CD1-CE2 3.34Å; L32-F36 HydrophobicContact CD1-CZ 4.22Å; L32-F36 HydrophobicContact CD2-CD2 4.47Å; L32-F36 HydrophobicContact CD2-CE2 4.09Å; L32-F36 HydrophobicContact CG-CD2 3.68Å; L32-F36 HydrophobicContact CG-CE2 3.54Å; L32-F36 VanDerWaalsContact O-CD2 3.31Å; L32-F36 WeakPolarHBondContact O-CD2 3.5Å; L32-F36 PolarHBondContact O-N 3.02Å |
| 33 | L | 92.5 | Very high | 88.5 | Confident | 100 Ų | 100 | 72.5 Ų | 72.5 | 52% | 0.524 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -64.1 | -41.5 | 174.3 | -173.7 | 150.5 | 0 | 0 | 0 | 111.5 | S29 F30 G37 | S29-L33 PolarHBondContact O-N 3.36Å; F30-L33 HydrophobicContact CD2-CD2 4.28Å; F30-L33 HydrophobicContact CE2-CD2 4.15Å; F30-L33 CarbonylContact O-C 3.59Å; F30-L33 WeakPolarHBondContact O-CB 3.36Å; F30-L33 PolarHBondContact O-N 2.81Å; L33-G37 VanDerWaalsContact O-CA 3.24Å; L33-G37 WeakPolarHBondContact O-CA 3.42Å; L33-G37 PolarHBondContact O-N 3Å |
| 34 | L | 92.3 | Very high | 90 | Very high | 25 Ų | 25 | 72.3 Ų | 72.3 | 13% | 0.131 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -65 | -40.3 | 175.1 | -70 | -179.8 | 0 | 0 | 0 | 111.4 | F30 S31 S38 M74 V77 N78 I85 | F30-L34 HydrophobicContact CD1-CD1 4.16Å; F30-L34 HydrophobicContact CD1-CG 4.4Å; F30-L34 HydrophobicContact CE1-CD1 3.8Å; F30-L34 HydrophobicContact CE1-CD2 4.31Å; F30-L34 HydrophobicContact CE1-CG 4.08Å; F30-L34 HydrophobicContact CE2-CD2 4.21Å; F30-L34 HydrophobicContact CE2-CG 4.32Å; F30-L34 HydrophobicContact CZ-CD1 4.18Å; F30-L34 HydrophobicContact CZ-CD2 3.84Å; F30-L34 HydrophobicContact CZ-CG 4.02Å; F30-L34 WeakPolarHBondContact O-CG 3.23Å; F30-L34 PolarHBondContact O-N 3.1Å; S31-L34 PolarHBondContact O-N 2.82Å; L34-S38 WeakPolarHBondContact O-CB 3.39Å; L34-S38 PolarHBondContact O-N 3.31Å; L34-S38 PolarHBondContact O-OG 2.9Å; L34-M74 HydrophobicContact CB-CE 4.21Å; L34-M74 HydrophobicContact CD2-CE 3.53Å; L34-M74 HydrophobicContact CG-CE 4.45Å; L34-M74 WeakPolarHBondContact O-CE 3.49Å; L34-V77 HydrophobicContact CD2-CG1 4.26Å; L34-N78 HydrophobicContact CD1-CB 4.09Å; L34-N78 HydrophobicContact CD2-CB 4.4Å; L34-I85 HydrophobicContact CD1-CD1 3.46Å; L34-I85 VanDerWaalsContact CD1-CD1 3.46Å |
| 35 | F | 93.2 | Very high | 91.1 | Very high | 124 Ų | 124 | 69.6 Ų | 69.6 | 54% | 0.544 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -64.1 | -55.3 | 177.3 | 175 | -96.9 | 0 | 0 | 0 | 112.4 | S31 L32 S38 S39 | S31-F35 WeakPolarHBondContact O-CB 3.44Å; S31-F35 PolarHBondContact O-N 3.31Å; L32-F35 PolarHBondContact O-N 3.49Å; F35-S38 PolarHBondContact O-N 3.4Å; F35-S39 WeakPolarHBondContact O-CB 3.01Å; F35-S39 PolarHBondContact O-N 3.49Å; F35-S39 PolarHBondContact O-OG 3.35Å |
| 36 | F | 95.9 | Very high | 92.2 | Very high | 106 Ų | 106 | 69.8 Ų | 69.8 | 47% | 0.465 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -70.3 | -37.4 | 179.9 | -72.7 | -58.9 | 0 | 0 | 0 | 112 | L32 S39 L40 | L32-F36 HydrophobicContact CD1-CD2 3.87Å; L32-F36 HydrophobicContact CD1-CE2 3.34Å; L32-F36 HydrophobicContact CD1-CZ 4.22Å; L32-F36 HydrophobicContact CD2-CD2 4.47Å; L32-F36 HydrophobicContact CD2-CE2 4.09Å; L32-F36 HydrophobicContact CG-CD2 3.68Å; L32-F36 HydrophobicContact CG-CE2 3.54Å; L32-F36 VanDerWaalsContact O-CD2 3.31Å; L32-F36 WeakPolarHBondContact O-CD2 3.5Å; L32-F36 PolarHBondContact O-N 3.02Å; F36-S39 PolarHBondContact O-N 2.83Å; F36-L40 VanDerWaalsContact O-CB 3.27Å; F36-L40 WeakPolarHBondContact O-CB 3.25Å; F36-L40 VanDerWaalsContact O-CG 3.23Å; F36-L40 WeakPolarHBondContact O-CG 3.43Å; F36-L40 PolarHBondContact O-N 3.16Å |
| 37 | G | 95.4 | Very high | 92.7 | Very high | 24 Ų | 24 | 69.9 Ų | 69.9 | 25% | 0.247 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -59.8 | -45.9 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | L33 L41 | L33-G37 VanDerWaalsContact O-CA 3.24Å; L33-G37 WeakPolarHBondContact O-CA 3.42Å; L33-G37 PolarHBondContact O-N 3Å; G37-L41 WeakPolarHBondContact O-CB 3.25Å; G37-L41 PolarHBondContact O-N 3Å |
| 38 | S | 94.6 | Very high | 92.9 | Very high | 37 Ų | 37 | 69.6 Ų | 69.6 | 26% | 0.259 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -62.2 | -46.9 | 175.8 | -58.4 | 0 | 0 | 0 | 0 | 111.1 | L34 F35 L41 A42 T70 M74 | L34-S38 WeakPolarHBondContact O-CB 3.39Å; L34-S38 PolarHBondContact O-N 3.31Å; L34-S38 PolarHBondContact O-OG 2.9Å; F35-S38 PolarHBondContact O-N 3.4Å; S38-L41 PolarHBondContact O-N 2.94Å; S38-A42 WeakPolarHBondContact O-CB 3.44Å; S38-A42 PolarHBondContact O-N 2.98Å; S38-T70 VanDerWaalsContact O-CG2 3.23Å; S38-T70 WeakPolarHBondContact O-CG2 3.36Å; S38-M74 VanDerWaalsContact OG-CG 3.29Å; S38-M74 WeakPolarHBondContact OG-CG 3.45Å |
| 39 | S | 95.9 | Very high | 93 | Very high | 48 Ų | 48 | 67.2 Ų | 67.2 | 34% | 0.336 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -63.6 | -48.3 | -178.5 | -57.9 | 0 | 0 | 0 | 0 | 112 | F35 F36 A42 L43 | F35-S39 WeakPolarHBondContact O-CB 3.01Å; F35-S39 PolarHBondContact O-N 3.49Å; F35-S39 PolarHBondContact O-OG 3.35Å; F36-S39 PolarHBondContact O-N 2.83Å; S39-A42 PolarHBondContact O-N 2.92Å; S39-L43 WeakPolarHBondContact O-CB 3.17Å; S39-L43 VanDerWaalsContact O-CG 3.27Å; S39-L43 WeakPolarHBondContact O-CG 3.46Å; S39-L43 PolarHBondContact O-N 3.31Å |
| 40 | L | 96.7 | Very high | 93 | Very high | 117 Ų | 117 | 68.6 Ų | 68.6 | 61% | 0.613 | 37% | 0.367 | S | S | * | . | H | α-helix | trans | -64.4 | -41.5 | 178.4 | -71.7 | 172.7 | 0 | 0 | 0 | 111.6 | F36 L43 F44 | F36-L40 VanDerWaalsContact O-CB 3.27Å; F36-L40 WeakPolarHBondContact O-CB 3.25Å; F36-L40 VanDerWaalsContact O-CG 3.23Å; F36-L40 WeakPolarHBondContact O-CG 3.43Å; F36-L40 PolarHBondContact O-N 3.16Å; L40-L43 PolarHBondContact O-N 3.37Å; L40-F44 VanDerWaalsContact O-CB 3.26Å; L40-F44 WeakPolarHBondContact O-CB 3.49Å; L40-F44 PolarHBondContact O-N 2.9Å |
| 41 | L | 96.4 | Very high | 93 | Very high | 40 Ų | 40 | 70 Ų | 70 | 21% | 0.209 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -66.1 | -43.8 | 178.3 | -177 | 60.3 | 0 | 0 | 0 | 111.6 | G37 S38 F44 L45 T70 I73 M74 | G37-L41 WeakPolarHBondContact O-CB 3.25Å; G37-L41 PolarHBondContact O-N 3Å; S38-L41 PolarHBondContact O-N 2.94Å; L41-F44 PolarHBondContact O-N 3.21Å; L41-L45 HydrophobicContact CD1-CD1 4.31Å; L41-L45 HydrophobicContact CD1-CG 4.21Å; L41-L45 HydrophobicContact CG-CD1 4.24Å; L41-L45 WeakPolarHBondContact O-CB 3.39Å; L41-L45 WeakPolarHBondContact O-CG 3.45Å; L41-L45 PolarHBondContact O-N 3.22Å; L41-T70 HydrophobicContact CB-CG2 4.23Å; L41-T70 HydrophobicContact CD2-CG2 4.24Å; L41-T70 HydrophobicContact CG-CG2 4.34Å; L41-I73 HydrophobicContact CD2-CB 3.96Å; L41-I73 HydrophobicContact CD2-CD1 4.08Å; L41-I73 HydrophobicContact CD2-CG2 3.79Å; L41-M74 HydrophobicContact CD2-CG 4.36Å; L41-M74 HydrophobicContact CD2-SD 4.39Å |
| 42 | A | 95.4 | Very high | 92.8 | Very high | 26 Ų | 26 | 78.9 Ų | 78.9 | 22% | 0.215 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -61.6 | -44.7 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | S38 S39 L45 N46 T70 | S38-A42 WeakPolarHBondContact O-CB 3.44Å; S38-A42 PolarHBondContact O-N 2.98Å; S39-A42 PolarHBondContact O-N 2.92Å; A42-L45 PolarHBondContact O-N 3.13Å; A42-N46 VanDerWaalsContact O-CB 3.27Å; A42-N46 WeakPolarHBondContact O-CB 3.11Å; A42-N46 PolarHBondContact O-N 3.24Å; A42-T70 WeakPolarHBondContact CA-OG1 3.5Å; A42-T70 HydrophobicContact CB-CG2 4.15Å; A42-T70 PolarHBondContact N-OG1 2.89Å |
| 43 | L | 94.6 | Very high | 92.4 | Very high | 101 Ų | 101 | 82.7 Ų | 82.7 | 53% | 0.529 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -63.9 | -41.8 | 176.1 | -70.8 | 174.6 | 0 | 0 | 0 | 111.8 | S39 L40 N46 N47 | S39-L43 WeakPolarHBondContact O-CB 3.17Å; S39-L43 VanDerWaalsContact O-CG 3.27Å; S39-L43 WeakPolarHBondContact O-CG 3.46Å; S39-L43 PolarHBondContact O-N 3.31Å; L40-L43 PolarHBondContact O-N 3.37Å; L43-N46 PolarHBondContact O-N 2.93Å; L43-N47 VanDerWaalsContact O-CB 3.23Å; L43-N47 WeakPolarHBondContact O-CB 3.15Å; L43-N47 PolarHBondContact O-N 3.39Å; L43-N47 PolarHBondContact O-ND2 3.42Å |
| 44 | F | 94.3 | Very high | 92 | Very high | 137 Ų | 137 | 85.5 Ų | 85.5 | 60% | 0.601 | 42% | 0.424 | S | S | * | . | H | α-helix | trans | -60.9 | -51 | 176.2 | 176.9 | -99.6 | 0 | 0 | 0 | 111.4 | L40 L41 N46 N47 V48 | L40-F44 VanDerWaalsContact O-CB 3.26Å; L40-F44 WeakPolarHBondContact O-CB 3.49Å; L40-F44 PolarHBondContact O-N 2.9Å; L41-F44 PolarHBondContact O-N 3.21Å; F44-N46 PolarHBondContact O-N 2.88Å; F44-N47 PolarHBondContact O-N 3.06Å; F44-V48 PolarHBondContact O-N 2.92Å; F44-V48 VanDerWaalsContact O-N 3.09Å |
| 45 | L | 93 | Very high | 91.7 | Very high | 20 Ų | 20 | 88.4 Ų | 88.4 | 11% | 0.105 | 44% | 0.443 | C | S | . | . | H | α-helix | trans | -63.9 | -38.4 | 178.9 | -68.1 | 179 | 0 | 0 | 0 | 112.3 | L41 A42 V48 I62 I69 | L41-L45 HydrophobicContact CD1-CD1 4.31Å; L41-L45 HydrophobicContact CD1-CG 4.21Å; L41-L45 HydrophobicContact CG-CD1 4.24Å; L41-L45 WeakPolarHBondContact O-CB 3.39Å; L41-L45 WeakPolarHBondContact O-CG 3.45Å; L41-L45 PolarHBondContact O-N 3.22Å; A42-L45 PolarHBondContact O-N 3.13Å; L45-V48 VanDerWaalsContact O-CB 3.26Å; L45-V48 WeakPolarHBondContact O-CB 3.47Å; L45-V48 PolarHBondContact O-N 3.26Å; L45-I62 HydrophobicContact CB-CG2 4.46Å; L45-I62 HydrophobicContact CD2-CG2 3.86Å; L45-I69 HydrophobicContact CD1-CB 3.96Å; L45-I69 HydrophobicContact CD1-CG2 3.67Å |
| 46 | N | 92.5 | Very high | 91.4 | Very high | 69 Ų | 69 | 87.8 Ų | 87.8 | 37% | 0.369 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -68.1 | -37.8 | 175 | -171.1 | 34.2 | 0 | 0 | 0 | 111.7 | A42 L43 F44 V48 R49 | A42-N46 VanDerWaalsContact O-CB 3.27Å; A42-N46 WeakPolarHBondContact O-CB 3.11Å; A42-N46 PolarHBondContact O-N 3.24Å; L43-N46 PolarHBondContact O-N 2.93Å; F44-N46 PolarHBondContact O-N 2.88Å; N46-V48 PolarHBondContact O-N 3.07Å; N46-R49 VanDerWaalsContact O-CB 3.28Å; N46-R49 WeakPolarHBondContact O-CB 3.3Å; N46-R49 PolarHBondContact O-N 3.17Å; N46-R49 VanDerWaalsContact O-N 3.16Å |
| 47 | N | 92.5 | Very high | 90.9 | Very high | 95 Ų | 95 | 92.8 Ų | 92.8 | 51% | 0.508 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -66.7 | -20.6 | 175.1 | -78.6 | -23.2 | 0 | 0 | 0 | 113 | L43 F44 R49 S50 | L43-N47 VanDerWaalsContact O-CB 3.23Å; L43-N47 WeakPolarHBondContact O-CB 3.15Å; L43-N47 PolarHBondContact O-N 3.39Å; L43-N47 PolarHBondContact O-ND2 3.42Å; F44-N47 PolarHBondContact O-N 3.06Å; N47-R49 PolarHBondContact O-N 2.9Å; N47-R49 VanDerWaalsContact O-N 3.07Å; N47-S50 PolarHBondContact O-N 3.12Å; N47-S50 PolarHBondContact O-OG 3.41Å |
| 48 | V | 89.7 | Confident | 90.5 | Very high | 18 Ų | 18 | 95.5 Ų | 95.5 | 11% | 0.109 | 47% | 0.468 | C | S | . | . | G | 310 helix | trans | -51.7 | -33.4 | 171.3 | 173.9 | 0 | 0 | 0 | 0 | 110.5 | F44 L45 N46 S50 T51 R59 I62 | F44-V48 PolarHBondContact O-N 2.92Å; F44-V48 VanDerWaalsContact O-N 3.09Å; L45-V48 VanDerWaalsContact O-CB 3.26Å; L45-V48 WeakPolarHBondContact O-CB 3.47Å; L45-V48 PolarHBondContact O-N 3.26Å; N46-V48 PolarHBondContact O-N 3.07Å; V48-S50 PolarHBondContact O-N 3.04Å; V48-S50 VanDerWaalsContact O-N 3.15Å; V48-T51 PolarHBondContact O-N 3.49Å; V48-T51 PolarHBondContact O-OG1 3.08Å; V48-R59 HydrophobicContact CG1-CG 3.88Å; V48-R59 WeakPolarHBondContact O-CD 3.21Å; V48-R59 WeakPolarHBondContact O-CG 3.48Å; V48-I62 HydrophobicContact CB-CG2 4.37Å; V48-I62 HydrophobicContact CG1-CB 4.47Å; V48-I62 HydrophobicContact CG1-CG2 4.33Å; V48-I62 HydrophobicContact CG2-CG2 4.41Å |
| 49 | R | 89.1 | Confident | 90.2 | Very high | 109 Ų | 109 | 96.2 Ų | 96.2 | 41% | 0.411 | 47% | 0.465 | S | S | . | . | G | 310 helix | trans | -52.1 | -36 | 175.6 | -167.4 | 176.5 | -78.6 | 157.9 | -5.7 | 114.2 | N46 N47 R59 A63 D64 | N46-R49 VanDerWaalsContact O-CB 3.28Å; N46-R49 WeakPolarHBondContact O-CB 3.3Å; N46-R49 PolarHBondContact O-N 3.17Å; N46-R49 VanDerWaalsContact O-N 3.16Å; N47-R49 PolarHBondContact O-N 2.9Å; N47-R49 VanDerWaalsContact O-N 3.07Å; R49-R59 VanDerWaalsContact O-CD 3.27Å; R49-R59 WeakPolarHBondContact O-CD 3.48Å; R49-R59 PolarHBondContact O-NE 2.99Å; R49-A63 HydrophobicContact CB-CB 3.75Å; R49-A63 HydrophobicContact CG-CB 4.38Å; R49-D64 IonicContact CZ-OD1 3.81Å; R49-D64 IonicContact NH2-OD1 2.63Å; R49-D64 PolarHBondContact NH2-OD1 3.23Å |
| 50 | S | 87.9 | Confident | 89.9 | Confident | 95 Ų | 95 | 98.2 Ų | 98.2 | 66% | 0.664 | 47% | 0.469 | S | S | * | . | G | 310 helix | trans | -92.6 | -11.3 | -178.3 | 65.8 | 0 | 0 | 0 | 0 | 113.3 | N47 V48 | N47-S50 PolarHBondContact O-N 3.12Å; N47-S50 PolarHBondContact O-OG 3.41Å; V48-S50 PolarHBondContact O-N 3.04Å; V48-S50 VanDerWaalsContact O-N 3.15Å |
| 51 | T | 88.6 | Confident | 89.3 | Confident | 47 Ų | 47 | 96.4 Ų | 96.4 | 29% | 0.288 | 46% | 0.457 | S | S | . | . | trans | -70.8 | 155.8 | -179.4 | 69 | 0 | 0 | 0 | 0 | 112.2 | V48 R59 | V48-T51 PolarHBondContact O-N 3.49Å; V48-T51 PolarHBondContact O-OG1 3.08Å; T51-R59 WeakPolarHBondContact O-CD 3.29Å; T51-R59 PolarHBondContact O-NH1 3.25Å | ||
| 52 | R | 86.3 | Confident | 89 | Confident | 242 Ų | 242 | 96.5 Ų | 96.5 | 91% | 0.913 | 46% | 0.457 | S | S | * | . | S | Bend | trans | -90 | -1.6 | 176.5 | -63 | -175.8 | -178.2 | 175.8 | 0.5 | 113.3 | ||
| 53 | F | 83 | Confident | 88.7 | Confident | 157 Ų | 157 | 95.4 Ų | 95.4 | 69% | 0.689 | 45% | 0.448 | S | S | * | . | S | Bend | trans | -84.6 | 144.8 | 179.7 | -63.2 | -73.8 | 0 | 0 | 0 | 110.1 | ||
| 54 | F | 84.7 | Confident | 88.4 | Confident | 159 Ų | 159 | 95.5 Ų | 95.5 | 70% | 0.697 | 45% | 0.449 | S | S | * | . | S | Bend | trans | 67 | 169.4 | -176.7 | -54.4 | -78.2 | 0 | 0 | 0 | 116.1 | I58 | F54-I58 HydrophobicContact CB-CB 4.48Å; F54-I58 HydrophobicContact CB-CG2 4.4Å |
| 55 | T | 86.6 | Confident | 88.3 | Confident | 86 Ų | 86 | 91.1 Ų | 91.1 | 53% | 0.528 | 43% | 0.43 | S | S | . | . | trans | -72.7 | 151 | 177.6 | 63.2 | 0 | 0 | 0 | 0 | 111 | R57 I58 R59 | T55-R57 PolarHBondContact O-N 3.2Å; T55-R57 VanDerWaalsContact O-N 3.14Å; T55-I58 PolarHBondContact O-N 3.49Å; T55-I58 VanDerWaalsContact O-N 3.12Å; T55-I58 WeakPolarHBondContact OG1-CD1 3.43Å; T55-I58 WeakPolarHBondContact OG1-CG1 3.34Å; T55-R59 WeakPolarHBondContact O-CB 3.24Å; T55-R59 PolarHBondContact O-N 2.94Å; T55-R59 VanDerWaalsContact O-N 3.1Å | ||
| 56 | L | 86.6 | Confident | 88.2 | Confident | 110 Ų | 110 | 91 Ų | 91 | 58% | 0.576 | 43% | 0.43 | S | S | * | . | H | α-helix | trans | -46.2 | -45.8 | 179.3 | -79.6 | 156.8 | 0 | 0 | 0 | 113.2 | R59 E60 | L56-R59 PolarHBondContact O-N 3.07Å; L56-E60 WeakPolarHBondContact O-CG 3.42Å; L56-E60 PolarHBondContact O-N 3.28Å |
| 57 | R | 84.4 | Confident | 88.2 | Confident | 212 Ų | 212 | 93.4 Ų | 93.4 | 80% | 0.8 | 44% | 0.443 | S | S | * | . | H | α-helix | trans | -63.7 | -44.8 | -178.2 | -65.3 | -174.8 | -172.9 | 164.4 | 2.4 | 113.4 | T55 R59 F61 | T55-R57 PolarHBondContact O-N 3.2Å; T55-R57 VanDerWaalsContact O-N 3.14Å; R57-R59 VanDerWaalsContact C-N 3.28Å; R57-F61 WeakPolarHBondContact O-CB 3.16Å; R57-F61 PolarHBondContact O-N 3.27Å; R57-F61 VanDerWaalsContact O-N 3.09Å |
| 58 | I | 87.1 | Confident | 88.1 | Confident | 81 Ų | 81 | 90 Ų | 90 | 42% | 0.415 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -67.6 | -37.9 | -179.3 | -64.4 | 172.1 | 0 | 0 | 0 | 109.7 | F54 T55 F61 I62 | F54-I58 HydrophobicContact CB-CB 4.48Å; F54-I58 HydrophobicContact CB-CG2 4.4Å; T55-I58 PolarHBondContact O-N 3.49Å; T55-I58 VanDerWaalsContact O-N 3.12Å; T55-I58 WeakPolarHBondContact OG1-CD1 3.43Å; T55-I58 WeakPolarHBondContact OG1-CG1 3.34Å; I58-F61 WeakPolarHBondContact O-CB 3.33Å; I58-F61 PolarHBondContact O-N 2.98Å; I58-I62 HydrophobicContact CG2-CD1 3.84Å; I58-I62 HydrophobicContact CG2-CG1 4.46Å; I58-I62 WeakPolarHBondContact O-CG1 3.32Å; I58-I62 PolarHBondContact O-N 3.09Å |
| 59 | R | 89.8 | Confident | 88.2 | Confident | 51 Ų | 51 | 91.2 Ų | 91.2 | 19% | 0.192 | 43% | 0.43 | C | S | . | . | H | α-helix | trans | -66.8 | -47.1 | -178.8 | -167.9 | -173.2 | 63.6 | 178.1 | 5.8 | 112.6 | V48 R49 T51 T55 L56 R57 F61 A63 | V48-R59 HydrophobicContact CG1-CG 3.88Å; V48-R59 WeakPolarHBondContact O-CD 3.21Å; V48-R59 WeakPolarHBondContact O-CG 3.48Å; R49-R59 VanDerWaalsContact O-CD 3.27Å; R49-R59 WeakPolarHBondContact O-CD 3.48Å; R49-R59 PolarHBondContact O-NE 2.99Å; T51-R59 WeakPolarHBondContact O-CD 3.29Å; T51-R59 PolarHBondContact O-NH1 3.25Å; T55-R59 WeakPolarHBondContact O-CB 3.24Å; T55-R59 PolarHBondContact O-N 2.94Å; T55-R59 VanDerWaalsContact O-N 3.1Å; L56-R59 PolarHBondContact O-N 3.07Å; R57-R59 VanDerWaalsContact C-N 3.28Å; R59-F61 VanDerWaalsContact C-N 3.34Å; R59-A63 PolarHBondContact O-N 2.93Å |
| 60 | E | 88.4 | Confident | 88.4 | Confident | 90 Ų | 90 | 86.1 Ų | 86.1 | 42% | 0.421 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -61.4 | -45.2 | 174.7 | -73.7 | 166 | -177.1 | 0 | 0 | 110.7 | L56 I62 A63 D64 | L56-E60 WeakPolarHBondContact O-CG 3.42Å; L56-E60 PolarHBondContact O-N 3.28Å; E60-I62 PolarHBondContact O-N 2.77Å; E60-A63 PolarHBondContact O-N 3.21Å; E60-D64 WeakPolarHBondContact O-CB 3.15Å; E60-D64 PolarHBondContact O-N 3.18Å |
| 61 | F | 85.6 | Confident | 88.6 | Confident | 80 Ų | 80 | 84.7 Ų | 84.7 | 35% | 0.351 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -56 | -52.5 | 176.9 | 177.6 | -89.9 | 0 | 0 | 0 | 113 | R57 I58 R59 A63 D64 F65 I287 | R57-F61 WeakPolarHBondContact O-CB 3.16Å; R57-F61 PolarHBondContact O-N 3.27Å; R57-F61 VanDerWaalsContact O-N 3.09Å; I58-F61 WeakPolarHBondContact O-CB 3.33Å; I58-F61 PolarHBondContact O-N 2.98Å; R59-F61 VanDerWaalsContact C-N 3.34Å; F61-A63 PolarHBondContact O-N 3.46Å; F61-D64 PolarHBondContact O-N 3.07Å; F61-F65 HydrophobicContact CD1-CD2 4.36Å; F61-F65 AromaticContact CD2-CD2 3.78Å; F61-F65 HydrophobicContact CD2-CD2 3.78Å; F61-F65 AromaticContact CD2-CE2 3.55Å; F61-F65 HydrophobicContact CD2-CE2 3.55Å; F61-F65 HydrophobicContact CE1-CD2 4.22Å; F61-F65 AromaticContact CE2-CD2 3.65Å; F61-F65 HydrophobicContact CE2-CD2 3.65Å; F61-F65 AromaticContact CE2-CE2 3.42Å; F61-F65 HydrophobicContact CE2-CE2 3.42Å; F61-F65 VanDerWaalsContact CE2-CE2 3.42Å; F61-F65 HydrophobicContact CE2-CZ 4.4Å; F61-F65 HydrophobicContact CG-CD2 4.14Å; F61-F65 HydrophobicContact CG-CE2 4.33Å; F61-F65 AromaticContact CZ-CD2 3.87Å; F61-F65 HydrophobicContact CZ-CD2 3.87Å; F61-F65 HydrophobicContact CZ-CE2 4.07Å; F61-F65 WeakPolarHBondContact O-CD2 3.33Å; F61-F65 PolarHBondContact O-N 3.38Å; F61-F65 VanDerWaalsContact O-N 3.14Å; F61-I287 HydrophobicContact CE2-CB 4.4Å; F61-I287 HydrophobicContact CE2-CD1 3.43Å; F61-I287 VanDerWaalsContact CE2-CD1 3.43Å; F61-I287 HydrophobicContact CE2-CG1 3.67Å; F61-I287 HydrophobicContact CE2-CG2 3.82Å; F61-I287 HydrophobicContact CZ-CB 4.47Å; F61-I287 HydrophobicContact CZ-CD1 3.36Å; F61-I287 HydrophobicContact CZ-CG1 3.99Å; F61-I287 HydrophobicContact CZ-CG2 3.74Å |
| 62 | I | 89.4 | Confident | 88.7 | Confident | 42 Ų | 42 | 84.5 Ų | 84.5 | 22% | 0.215 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -60.5 | -38.3 | -179.6 | -68.9 | 167.9 | 0 | 0 | 0 | 111.1 | L45 V48 I58 E60 S66 | L45-I62 HydrophobicContact CB-CG2 4.46Å; L45-I62 HydrophobicContact CD2-CG2 3.86Å; V48-I62 HydrophobicContact CB-CG2 4.37Å; V48-I62 HydrophobicContact CG1-CB 4.47Å; V48-I62 HydrophobicContact CG1-CG2 4.33Å; V48-I62 HydrophobicContact CG2-CG2 4.41Å; I58-I62 HydrophobicContact CG2-CD1 3.84Å; I58-I62 HydrophobicContact CG2-CG1 4.46Å; I58-I62 WeakPolarHBondContact O-CG1 3.32Å; I58-I62 PolarHBondContact O-N 3.09Å; E60-I62 PolarHBondContact O-N 2.77Å; I62-S66 WeakPolarHBondContact O-CA 2.93Å; I62-S66 PolarHBondContact O-N 2.9Å |
| 63 | A | 89.6 | Confident | 89.1 | Confident | 3 Ų | 3 | 76.6 Ų | 76.6 | 3% | 0.025 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -70.6 | -40.8 | 179.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | R49 R59 E60 F61 F65 S66 | R49-A63 HydrophobicContact CB-CB 3.75Å; R49-A63 HydrophobicContact CG-CB 4.38Å; R59-A63 PolarHBondContact O-N 2.93Å; E60-A63 PolarHBondContact O-N 3.21Å; F61-A63 PolarHBondContact O-N 3.46Å; A63-F65 VanDerWaalsContact C-N 3.33Å; A63-F65 PolarHBondContact O-N 2.97Å; A63-S66 VanDerWaalsContact O-CB 3.22Å; A63-S66 WeakPolarHBondContact O-CB 3.4Å; A63-S66 PolarHBondContact O-N 2.85Å; A63-S66 PolarHBondContact O-OG 3.14Å |
| 64 | D | 88.3 | Confident | 89.6 | Confident | 103 Ų | 103 | 70.1 Ų | 70.1 | 55% | 0.551 | 34% | 0.342 | S | S | * | . | H | α-helix | trans | -64.8 | -36.6 | 179.4 | -67.8 | -11.5 | 0 | 0 | 0 | 111.9 | R49 E60 F61 | R49-D64 IonicContact CZ-OD1 3.81Å; R49-D64 IonicContact NH2-OD1 2.63Å; R49-D64 PolarHBondContact NH2-OD1 3.23Å; E60-D64 WeakPolarHBondContact O-CB 3.15Å; E60-D64 PolarHBondContact O-N 3.18Å; F61-D64 PolarHBondContact O-N 3.07Å |
| 65 | F | 90.6 | Very high | 89.9 | Confident | 45 Ų | 45 | 66.5 Ų | 66.5 | 20% | 0.197 | 33% | 0.333 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -96.2 | 11.8 | 176.8 | -61.9 | -74.9 | 0 | 0 | 0 | 113.9 | F61 A63 L67 L68 I69 P283 I287 | F61-F65 HydrophobicContact CD1-CD2 4.36Å; F61-F65 AromaticContact CD2-CD2 3.78Å; F61-F65 HydrophobicContact CD2-CD2 3.78Å; F61-F65 AromaticContact CD2-CE2 3.55Å; F61-F65 HydrophobicContact CD2-CE2 3.55Å; F61-F65 HydrophobicContact CE1-CD2 4.22Å; F61-F65 AromaticContact CE2-CD2 3.65Å; F61-F65 HydrophobicContact CE2-CD2 3.65Å; F61-F65 AromaticContact CE2-CE2 3.42Å; F61-F65 HydrophobicContact CE2-CE2 3.42Å; F61-F65 VanDerWaalsContact CE2-CE2 3.42Å; F61-F65 HydrophobicContact CE2-CZ 4.4Å; F61-F65 HydrophobicContact CG-CD2 4.14Å; F61-F65 HydrophobicContact CG-CE2 4.33Å; F61-F65 AromaticContact CZ-CD2 3.87Å; F61-F65 HydrophobicContact CZ-CD2 3.87Å; F61-F65 HydrophobicContact CZ-CE2 4.07Å; F61-F65 WeakPolarHBondContact O-CD2 3.33Å; F61-F65 PolarHBondContact O-N 3.38Å; F61-F65 VanDerWaalsContact O-N 3.14Å; A63-F65 VanDerWaalsContact C-N 3.33Å; A63-F65 PolarHBondContact O-N 2.97Å; F65-L67 PolarHBondContact O-N 2.81Å; F65-L68 PolarHBondContact O-N 3.17Å; F65-L68 VanDerWaalsContact O-N 3.13Å; F65-I69 HydrophobicContact CB-CD1 4.05Å; F65-I69 HydrophobicContact CB-CG1 4.3Å; F65-I69 WeakPolarHBondContact O-CG1 3.49Å; F65-I69 PolarHBondContact O-N 2.98Å; F65-P283 HydrophobicContact CD1-CB 4.05Å; F65-P283 HydrophobicContact CE1-CB 3.55Å; F65-I287 HydrophobicContact CD1-CD1 3.96Å; F65-I287 HydrophobicContact CD2-CD1 3.79Å; F65-I287 HydrophobicContact CE1-CD1 3.63Å; F65-I287 HydrophobicContact CE1-CG1 4.37Å; F65-I287 HydrophobicContact CE2-CD1 3.5Å; F65-I287 HydrophobicContact CE2-CG1 4.1Å; F65-I287 HydrophobicContact CG-CD1 4.04Å; F65-I287 HydrophobicContact CZ-CD1 3.41Å; F65-I287 VanDerWaalsContact CZ-CD1 3.41Å; F65-I287 HydrophobicContact CZ-CG1 3.84Å |
| 66 | S | 92.4 | Very high | 90.1 | Very high | 16 Ų | 16 | 64.4 Ų | 64.4 | 11% | 0.112 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -52 | -51.9 | -174.7 | 53.7 | 0 | 0 | 0 | 0 | 112.7 | I62 A63 L68 I69 T70 | I62-S66 WeakPolarHBondContact O-CA 2.93Å; I62-S66 PolarHBondContact O-N 2.9Å; A63-S66 VanDerWaalsContact O-CB 3.22Å; A63-S66 WeakPolarHBondContact O-CB 3.4Å; A63-S66 PolarHBondContact O-N 2.85Å; A63-S66 PolarHBondContact O-OG 3.14Å; S66-L68 PolarHBondContact O-N 3.09Å; S66-I69 PolarHBondContact O-N 3.13Å; S66-T70 WeakPolarHBondContact O-CB 3.29Å; S66-T70 PolarHBondContact O-N 3.22Å; S66-T70 PolarHBondContact O-OG1 2.86Å |
| 67 | L | 91.4 | Very high | 90.4 | Very high | 121 Ų | 121 | 61.6 Ų | 61.6 | 63% | 0.634 | 31% | 0.312 | S | S | * | . | H | α-helix | trans | -59.2 | -45.1 | 179.1 | 179.7 | 63.1 | 0 | 0 | 0 | 112.2 | F65 T70 V71 | F65-L67 PolarHBondContact O-N 2.81Å; L67-T70 PolarHBondContact O-N 3.02Å; L67-V71 HydrophobicContact CD1-CG2 4.34Å; L67-V71 VanDerWaalsContact O-CG2 3.31Å; L67-V71 WeakPolarHBondContact O-CG2 3.45Å; L67-V71 PolarHBondContact O-N 3.45Å |
| 68 | L | 90.5 | Very high | 90.8 | Very high | 23 Ų | 23 | 53.2 Ų | 53.2 | 12% | 0.12 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -64.1 | -50.5 | -179.3 | -173.3 | 154.1 | 0 | 0 | 0 | 110.3 | F65 S66 T70 V71 L72 P283 L284 | F65-L68 PolarHBondContact O-N 3.17Å; F65-L68 VanDerWaalsContact O-N 3.13Å; S66-L68 PolarHBondContact O-N 3.09Å; L68-T70 VanDerWaalsContact C-N 3.28Å; L68-T70 PolarHBondContact O-N 3.43Å; L68-V71 PolarHBondContact O-N 2.95Å; L68-L72 HydrophobicContact CD2-CD1 3.62Å; L68-L72 HydrophobicContact CD2-CG 4.03Å; L68-L72 WeakPolarHBondContact O-CG 3.29Å; L68-L72 PolarHBondContact O-N 3.37Å; L68-P283 HydrophobicContact CD1-CB 3.99Å; L68-P283 HydrophobicContact CD1-CG 3.81Å; L68-L284 HydrophobicContact CD1-CG 4.19Å; L68-L284 HydrophobicContact CD2-CD1 3.38Å; L68-L284 HydrophobicContact CD2-CD2 3.85Å; L68-L284 HydrophobicContact CD2-CG 3.41Å; L68-L284 VanDerWaalsContact CD2-CG 3.41Å; L68-L284 HydrophobicContact CG-CG 4.49Å |
| 69 | I | 91.4 | Very high | 90.9 | Very high | 43 Ų | 43 | 58.3 Ų | 58.3 | 22% | 0.221 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -58.3 | -43 | 178.4 | -67.1 | 168.4 | 0 | 0 | 0 | 110.5 | L45 F65 S66 L72 I73 | L45-I69 HydrophobicContact CD1-CB 3.96Å; L45-I69 HydrophobicContact CD1-CG2 3.67Å; F65-I69 HydrophobicContact CB-CD1 4.05Å; F65-I69 HydrophobicContact CB-CG1 4.3Å; F65-I69 WeakPolarHBondContact O-CG1 3.49Å; F65-I69 PolarHBondContact O-N 2.98Å; S66-I69 PolarHBondContact O-N 3.13Å; I69-L72 PolarHBondContact O-N 2.94Å; I69-I73 HydrophobicContact CG2-CD1 3.59Å; I69-I73 HydrophobicContact CG2-CG1 4.32Å; I69-I73 VanDerWaalsContact O-CG1 3.3Å; I69-I73 WeakPolarHBondContact O-CG1 3.48Å; I69-I73 PolarHBondContact O-N 2.72Å |
| 70 | T | 94.8 | Very high | 91.1 | Very high | 3 Ų | 3 | 66 Ų | 66 | 2% | 0.018 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -58.6 | -50.6 | 175.3 | -66.6 | 0 | 0 | 0 | 0 | 111.8 | S38 L41 A42 S66 L67 L68 L72 I73 M74 | S38-T70 VanDerWaalsContact O-CG2 3.23Å; S38-T70 WeakPolarHBondContact O-CG2 3.36Å; L41-T70 HydrophobicContact CB-CG2 4.23Å; L41-T70 HydrophobicContact CD2-CG2 4.24Å; L41-T70 HydrophobicContact CG-CG2 4.34Å; A42-T70 WeakPolarHBondContact CA-OG1 3.5Å; A42-T70 HydrophobicContact CB-CG2 4.15Å; A42-T70 PolarHBondContact N-OG1 2.89Å; S66-T70 WeakPolarHBondContact O-CB 3.29Å; S66-T70 PolarHBondContact O-N 3.22Å; S66-T70 PolarHBondContact O-OG1 2.86Å; L67-T70 PolarHBondContact O-N 3.02Å; L68-T70 VanDerWaalsContact C-N 3.28Å; L68-T70 PolarHBondContact O-N 3.43Å; T70-L72 VanDerWaalsContact C-N 3.27Å; T70-L72 PolarHBondContact O-N 3.46Å; T70-I73 PolarHBondContact O-N 3.06Å; T70-M74 HydrophobicContact CG2-CG 4.21Å; T70-M74 WeakPolarHBondContact O-CB 3.39Å; T70-M74 VanDerWaalsContact O-CG 3.24Å; T70-M74 WeakPolarHBondContact O-CG 3.33Å; T70-M74 PolarHBondContact O-N 3.44Å |
| 71 | V | 91.7 | Very high | 91.1 | Very high | 64 Ų | 64 | 65.1 Ų | 65.1 | 39% | 0.388 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -59.4 | -40.7 | 179.9 | 169.8 | 0 | 0 | 0 | 0 | 110.7 | L67 L68 T75 | L67-V71 HydrophobicContact CD1-CG2 4.34Å; L67-V71 VanDerWaalsContact O-CG2 3.31Å; L67-V71 WeakPolarHBondContact O-CG2 3.45Å; L67-V71 PolarHBondContact O-N 3.45Å; L68-V71 PolarHBondContact O-N 2.95Å; V71-T75 WeakPolarHBondContact O-CB 3.5Å; V71-T75 PolarHBondContact O-N 3.23Å; V71-T75 PolarHBondContact O-OG1 3.36Å |
| 72 | L | 90.6 | Very high | 91 | Very high | 44 Ų | 44 | 65.1 Ų | 65.1 | 23% | 0.23 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -66.5 | -46.7 | 178.2 | -64.5 | -170.1 | 0 | 0 | 0 | 113.2 | L68 I69 T70 T75 A76 F281 L284 | L68-L72 HydrophobicContact CD2-CD1 3.62Å; L68-L72 HydrophobicContact CD2-CG 4.03Å; L68-L72 WeakPolarHBondContact O-CG 3.29Å; L68-L72 PolarHBondContact O-N 3.37Å; I69-L72 PolarHBondContact O-N 2.94Å; T70-L72 VanDerWaalsContact C-N 3.27Å; T70-L72 PolarHBondContact O-N 3.46Å; L72-T75 PolarHBondContact O-N 3.24Å; L72-A76 WeakPolarHBondContact O-CB 3.27Å; L72-A76 PolarHBondContact O-N 3.02Å; L72-F281 HydrophobicContact CD1-CD1 3.93Å; L72-F281 HydrophobicContact CD1-CE1 3.55Å; L72-F281 HydrophobicContact CD2-CD1 3.92Å; L72-F281 HydrophobicContact CD2-CE1 3.06Å; L72-F281 HydrophobicContact CD2-CE2 4.2Å; L72-F281 HydrophobicContact CD2-CZ 3.22Å; L72-F281 HydrophobicContact CG-CE1 3.92Å; L72-F281 HydrophobicContact CG-CZ 4.48Å; L72-L284 HydrophobicContact CD1-CD1 3.43Å; L72-L284 VanDerWaalsContact CD1-CD1 3.43Å |
| 73 | I | 93.7 | Very high | 90.5 | Very high | 76 Ų | 76 | 65.1 Ų | 65.1 | 39% | 0.39 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -63.1 | -45.3 | 179.3 | -69.4 | 170.9 | 0 | 0 | 0 | 110 | L41 I69 T70 A76 V77 | L41-I73 HydrophobicContact CD2-CB 3.96Å; L41-I73 HydrophobicContact CD2-CD1 4.08Å; L41-I73 HydrophobicContact CD2-CG2 3.79Å; I69-I73 HydrophobicContact CG2-CD1 3.59Å; I69-I73 HydrophobicContact CG2-CG1 4.32Å; I69-I73 VanDerWaalsContact O-CG1 3.3Å; I69-I73 WeakPolarHBondContact O-CG1 3.48Å; I69-I73 PolarHBondContact O-N 2.72Å; T70-I73 PolarHBondContact O-N 3.06Å; I73-A76 WeakPolarHBondContact O-CB 3.49Å; I73-A76 PolarHBondContact O-N 3.38Å; I73-V77 WeakPolarHBondContact O-CG2 3.37Å; I73-V77 PolarHBondContact O-N 3.45Å |
| 74 | M | 93.4 | Very high | 89.9 | Confident | 20 Ų | 20 | 68.8 Ų | 68.8 | 10% | 0.099 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -72 | -33.5 | -177.2 | -65.2 | -57.5 | -62.1 | 0 | 0 | 112.4 | L34 S38 L41 T70 V77 N78 | L34-M74 HydrophobicContact CB-CE 4.21Å; L34-M74 HydrophobicContact CD2-CE 3.53Å; L34-M74 HydrophobicContact CG-CE 4.45Å; L34-M74 WeakPolarHBondContact O-CE 3.49Å; S38-M74 VanDerWaalsContact OG-CG 3.29Å; S38-M74 WeakPolarHBondContact OG-CG 3.45Å; L41-M74 HydrophobicContact CD2-CG 4.36Å; L41-M74 HydrophobicContact CD2-SD 4.39Å; T70-M74 HydrophobicContact CG2-CG 4.21Å; T70-M74 WeakPolarHBondContact O-CB 3.39Å; T70-M74 VanDerWaalsContact O-CG 3.24Å; T70-M74 WeakPolarHBondContact O-CG 3.33Å; T70-M74 PolarHBondContact O-N 3.44Å; M74-V77 PolarHBondContact O-N 3.36Å; M74-N78 WeakPolarHBondContact O-CB 3.07Å; M74-N78 PolarHBondContact O-N 3.4Å |
| 75 | T | 91 | Very high | 89.5 | Confident | 84 Ų | 84 | 65 Ų | 65 | 52% | 0.515 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -66.8 | -39.9 | 171 | -58.4 | 0 | 0 | 0 | 0 | 111.2 | V71 L72 N78 Y79 | V71-T75 WeakPolarHBondContact O-CB 3.5Å; V71-T75 PolarHBondContact O-N 3.23Å; V71-T75 PolarHBondContact O-OG1 3.36Å; L72-T75 PolarHBondContact O-N 3.24Å; T75-N78 WeakPolarHBondContact O-CB 3.35Å; T75-N78 PolarHBondContact O-N 3.16Å; T75-Y79 WeakPolarHBondContact O-CB 3.26Å; T75-Y79 PolarHBondContact O-N 3.48Å |
| 76 | A | 92.2 | Very high | 89 | Confident | 42 Ų | 42 | 68.3 Ų | 68.3 | 35% | 0.347 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -62.5 | -48.8 | 173.3 | 0 | 0 | 0 | 0 | 0 | 110.7 | L72 I73 N78 Y79 W80 | L72-A76 WeakPolarHBondContact O-CB 3.27Å; L72-A76 PolarHBondContact O-N 3.02Å; I73-A76 WeakPolarHBondContact O-CB 3.49Å; I73-A76 PolarHBondContact O-N 3.38Å; A76-N78 VanDerWaalsContact C-N 3.29Å; A76-N78 PolarHBondContact O-N 3.3Å; A76-Y79 WeakPolarHBondContact O-CA 3.33Å; A76-Y79 WeakPolarHBondContact O-CB 3.37Å; A76-Y79 PolarHBondContact O-N 3.22Å; A76-W80 PolarHBondContact O-N 3.22Å |
| 77 | V | 92.7 | Very high | 88.2 | Confident | 50 Ų | 50 | 71.7 Ų | 71.7 | 30% | 0.303 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -56.6 | -43.6 | 176.5 | 170.2 | 0 | 0 | 0 | 0 | 111.3 | F30 L34 I73 M74 Y79 W80 V81 | F30-V77 HydrophobicContact CE2-CG1 4.39Å; F30-V77 HydrophobicContact CZ-CG1 4.26Å; L34-V77 HydrophobicContact CD2-CG1 4.26Å; I73-V77 WeakPolarHBondContact O-CG2 3.37Å; I73-V77 PolarHBondContact O-N 3.45Å; M74-V77 PolarHBondContact O-N 3.36Å; V77-Y79 VanDerWaalsContact C-N 3.34Å; V77-Y79 PolarHBondContact O-N 3.21Å; V77-W80 PolarHBondContact O-N 3.13Å; V77-V81 HydrophobicContact CG1-CG2 4.38Å; V77-V81 WeakPolarHBondContact O-CB 3.49Å; V77-V81 WeakPolarHBondContact O-CG2 3.46Å; V77-V81 PolarHBondContact O-N 3.03Å |
| 78 | N | 92.1 | Very high | 87.7 | Confident | 37 Ų | 37 | 73.6 Ų | 73.6 | 20% | 0.198 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -58.4 | -45.9 | 174.4 | -176 | 37.3 | 0 | 0 | 0 | 111.9 | L34 M74 T75 A76 A82 I85 | L34-N78 HydrophobicContact CD1-CB 4.09Å; L34-N78 HydrophobicContact CD2-CB 4.4Å; M74-N78 WeakPolarHBondContact O-CB 3.07Å; M74-N78 PolarHBondContact O-N 3.4Å; T75-N78 WeakPolarHBondContact O-CB 3.35Å; T75-N78 PolarHBondContact O-N 3.16Å; A76-N78 VanDerWaalsContact C-N 3.29Å; A76-N78 PolarHBondContact O-N 3.3Å; N78-A82 PolarHBondContact O-N 3.49Å; N78-I85 WeakPolarHBondContact OD1-CD1 3.47Å |
| 79 | Y | 90.3 | Very high | 86.8 | Confident | 188 Ų | 188 | 81.9 Ų | 81.9 | 74% | 0.737 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -62.7 | -43.1 | 177.2 | -180 | -97.2 | 0 | 0 | 0 | 112.8 | T75 A76 V77 A82 | T75-Y79 WeakPolarHBondContact O-CB 3.26Å; T75-Y79 PolarHBondContact O-N 3.48Å; A76-Y79 WeakPolarHBondContact O-CA 3.33Å; A76-Y79 WeakPolarHBondContact O-CB 3.37Å; A76-Y79 PolarHBondContact O-N 3.22Å; V77-Y79 VanDerWaalsContact C-N 3.34Å; V77-Y79 PolarHBondContact O-N 3.21Å; Y79-A82 PolarHBondContact O-N 2.95Å |
| 80 | W | 92.6 | Very high | 86.1 | Confident | 213 Ų | 213 | 86.3 Ų | 86.3 | 81% | 0.807 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -67.8 | -38.2 | -179.8 | -77.4 | 106 | 0 | 0 | 0 | 113.4 | A76 V77 A82 | A76-W80 PolarHBondContact O-N 3.22Å; V77-W80 PolarHBondContact O-N 3.13Å; W80-A82 VanDerWaalsContact C-N 3.31Å |
| 81 | V | 89.2 | Confident | 85.3 | Confident | 70 Ų | 70 | 91.3 Ų | 91.3 | 42% | 0.424 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -77.7 | -21.8 | 178.9 | 175.5 | 0 | 0 | 0 | 0 | 111.2 | F30 V77 L83 | F30-V81 HydrophobicContact CD1-CG1 4.31Å; F30-V81 HydrophobicContact CD2-CG1 4.26Å; F30-V81 HydrophobicContact CE1-CB 4.01Å; F30-V81 HydrophobicContact CE1-CG1 3.87Å; F30-V81 HydrophobicContact CE2-CB 4.02Å; F30-V81 HydrophobicContact CE2-CG1 3.82Å; F30-V81 HydrophobicContact CE2-CG2 3.9Å; F30-V81 HydrophobicContact CZ-CB 3.52Å; F30-V81 HydrophobicContact CZ-CG1 3.62Å; F30-V81 HydrophobicContact CZ-CG2 3.77Å; V77-V81 HydrophobicContact CG1-CG2 4.38Å; V77-V81 WeakPolarHBondContact O-CB 3.49Å; V77-V81 WeakPolarHBondContact O-CG2 3.46Å; V77-V81 PolarHBondContact O-N 3.03Å; V81-L83 HydrophobicContact CG1-CD1 3.65Å; V81-L83 HydrophobicContact CG1-CG 3.78Å; V81-L83 PolarHBondContact O-N 2.82Å |
| 82 | A | 82.4 | Confident | 84.6 | Confident | 81 Ų | 81 | 95.1 Ų | 95.1 | 67% | 0.669 | 52% | 0.518 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 50.9 | 33.4 | 171 | 0 | 0 | 0 | 0 | 0 | 114.6 | N78 Y79 W80 | N78-A82 PolarHBondContact O-N 3.49Å; Y79-A82 PolarHBondContact O-N 2.95Å; W80-A82 VanDerWaalsContact C-N 3.31Å |
| 83 | L | 79.6 | Confident | 83.9 | Confident | 42 Ų | 42 | 96.2 Ų | 96.2 | 22% | 0.22 | 53% | 0.53 | C | S | . | . | trans | -78.8 | 140.8 | 172.7 | -75.1 | 170.5 | 0 | 0 | 0 | 109.8 | F30 V81 I85 | F30-L83 HydrophobicContact CB-CD1 3.64Å; F30-L83 HydrophobicContact CD1-CB 4.04Å; F30-L83 HydrophobicContact CD1-CD1 3.54Å; F30-L83 HydrophobicContact CD1-CG 4.34Å; F30-L83 HydrophobicContact CD2-CD1 4.35Å; F30-L83 HydrophobicContact CE1-CB 4.43Å; F30-L83 HydrophobicContact CE1-CD1 4.28Å; F30-L83 HydrophobicContact CG-CD1 3.6Å; V81-L83 HydrophobicContact CG1-CD1 3.65Å; V81-L83 HydrophobicContact CG1-CG 3.78Å; V81-L83 PolarHBondContact O-N 2.82Å; L83-I85 HydrophobicContact CB-CG1 4.3Å; L83-I85 PolarHBondContact O-N 2.78Å | ||
| 84 | P | 76.6 | Confident | 83.1 | Confident | 79 Ų | 79 | 102.1 Ų | 102.1 | 51% | 0.513 | 55% | 0.553 | S | S | . | * | trans | -76.6 | 73.5 | 178 | 33.2 | -35.3 | 0 | 0 | 0 | 110 | K24 | K24-P84 HydrophobicContact CD-CG 3.71Å; K24-P84 VanDerWaalsContact NZ-CD 3.3Å | ||
| 85 | I | 80.6 | Confident | 82.5 | Confident | 25 Ų | 25 | 108.9 Ų | 108.9 | 13% | 0.128 | 58% | 0.582 | C | S | . | * | trans | -76.1 | 146.4 | 172.1 | -60.4 | 166.8 | 0 | 0 | 0 | 108.1 | V27 F30 L34 N78 L83 C87 | V27-I85 HydrophobicContact CG1-CG1 4.29Å; F30-I85 HydrophobicContact CD1-CD1 3.18Å; F30-I85 HydrophobicContact CD1-CG1 3.99Å; F30-I85 HydrophobicContact CE1-CD1 3.39Å; F30-I85 HydrophobicContact CE1-CG1 4.49Å; F30-I85 HydrophobicContact CG-CD1 4.38Å; L34-I85 HydrophobicContact CD1-CD1 3.46Å; L34-I85 VanDerWaalsContact CD1-CD1 3.46Å; N78-I85 WeakPolarHBondContact OD1-CD1 3.47Å; L83-I85 HydrophobicContact CB-CG1 4.3Å; L83-I85 PolarHBondContact O-N 2.78Å; I85-C87 PolarHBondContact O-N 2.85Å | ||
| 86 | P | 79.3 | Confident | 82.1 | Confident | 114 Ų | 114 | 106.1 Ų | 106.1 | 74% | 0.74 | 57% | 0.565 | S | S | * | * | trans | -59.7 | 98 | 167.9 | 26.2 | -36.4 | 0 | 0 | 0 | 110.8 | ||||
| 87 | C | 76.9 | Confident | 81.3 | Confident | 87 Ų | 87 | 111.4 Ų | 111.4 | 59% | 0.588 | 59% | 0.593 | S | S | * | * | trans | -79.1 | 144.8 | 170.4 | -64.6 | 0 | 0 | 0 | 0 | 110.2 | I85 K89 | I85-C87 PolarHBondContact O-N 2.85Å; C87-K89 PolarHBondContact O-N 2.98Å | ||
| 88 | L | 79.2 | Confident | 80.7 | Confident | 160 Ų | 160 | 115 Ų | 115 | 84% | 0.838 | 61% | 0.61 | S | S | * | * | trans | -64.8 | 117 | 174.4 | -173.6 | 64.9 | 0 | 0 | 0 | 109.5 | I90 | L88-I90 PolarHBondContact O-N 3.47Š| ||
| 89 | K | 73.6 | Confident | 80.1 | Confident | 198 Ų | 198 | 123.3 Ų | 123.3 | 86% | 0.861 | 65% | 0.647 | S | S | * | * | trans | -76.2 | 104.9 | 176.2 | -65 | -179.7 | -177.8 | 178.4 | 0 | 108.9 | C87 | C87-K89 PolarHBondContact O-N 2.98Š| ||
| 90 | I | 76.6 | Confident | 79.8 | Confident | 136 Ų | 136 | 118.2 Ų | 118.2 | 70% | 0.697 | 63% | 0.627 | S | S | * | * | trans | -82 | 125 | 176.2 | -58.2 | 167.8 | 0 | 0 | 0 | 108.3 | L88 | L88-I90 PolarHBondContact O-N 3.47Š| ||
| 91 | P | 76.6 | Confident | 79.5 | Confident | 107 Ų | 107 | 114.3 Ų | 114.3 | 70% | 0.695 | 62% | 0.621 | S | S | * | * | trans | -72.1 | 136 | 174.5 | 29.8 | -33.2 | 0 | 0 | 0 | 110.6 | S93 | P91-S93 VanDerWaalsContact C-N 3.31Š| ||
| 92 | T | 76.6 | Confident | 79.3 | Confident | 144 Ų | 144 | 116.5 Ų | 116.5 | 88% | 0.883 | 62% | 0.622 | S | S | * | * | S | Bend | trans | -84.4 | -2.5 | 176.8 | 52.9 | 0 | 0 | 0 | 0 | 113.6 | ||
| 93 | S | 77.2 | Confident | 79.6 | Confident | 67 Ų | 67 | 116.5 Ų | 116.5 | 47% | 0.469 | 61% | 0.614 | S | S | . | * | S | Bend | trans | -139.1 | 136.7 | -179 | -59.3 | 0 | 0 | 0 | 0 | 110.4 | P91 K95 | P91-S93 VanDerWaalsContact C-N 3.31Å; S93-K95 PolarHBondContact O-N 2.87Å |
| 94 | F | 76.8 | Confident | 79.8 | Confident | 200 Ų | 200 | 117.5 Ų | 117.5 | 88% | 0.877 | 62% | 0.621 | S | S | * | * | trans | -65.2 | 100.7 | 172.5 | -71.5 | -76.9 | 0 | 0 | 0 | 109.8 | W102 | F94-W102 HydrophobicContact CB-CZ2 4.49Š| ||
| 95 | K | 81.2 | Confident | 80.2 | Confident | 163 Ų | 163 | 118.8 Ų | 118.8 | 71% | 0.709 | 62% | 0.624 | S | S | * | * | trans | -131.5 | 149.3 | 175.1 | -67.7 | -175.1 | 179.2 | -176.8 | 0 | 109.4 | S93 | S93-K95 PolarHBondContact O-N 2.87Š| ||
| 96 | P | 81 | Confident | 80.2 | Confident | 26 Ų | 26 | 122.4 Ų | 122.4 | 17% | 0.169 | 65% | 0.649 | C | S | . | * | trans | -60 | 154.9 | 168.8 | 21.3 | -26.3 | 0 | 0 | 0 | 110.8 | I98 R100 | P96-I98 CarbonylContact C-O 3.57Å; P96-I98 WeakPolarHBondContact CG-O 3.21Å; P96-I98 PolarHBondContact O-N 3.39Å; P96-I98 VanDerWaalsContact O-N 3.15Å; P96-R100 HydrophobicContact CB-CG 3.68Å; P96-R100 HydrophobicContact CG-CG 3.76Å; P96-R100 WeakPolarHBondContact CG-O 3.44Å | ||
| 97 | T | 76.1 | Confident | 80.3 | Confident | 152 Ų | 152 | 124.8 Ų | 124.8 | 93% | 0.933 | 66% | 0.655 | S | S | * | * | S | Bend | trans | -60 | -25.5 | -176.3 | -47 | 0 | 0 | 0 | 0 | 113.4 | ||
| 98 | I | 79.7 | Confident | 80.5 | Confident | 126 Ų | 126 | 127.2 Ų | 127.2 | 65% | 0.646 | 66% | 0.662 | S | S | * | * | S | Bend | trans | -115.2 | 152.2 | 173.1 | -58.9 | 170 | 0 | 0 | 0 | 106.7 | P96 R100 | P96-I98 CarbonylContact C-O 3.57Å; P96-I98 WeakPolarHBondContact CG-O 3.21Å; P96-I98 PolarHBondContact O-N 3.39Å; P96-I98 VanDerWaalsContact O-N 3.15Å; I98-R100 PolarHBondContact O-N 3.26Å |
| 99 | E | 80.9 | Confident | 80.6 | Confident | 211 Ų | 211 | 123.3 Ų | 123.3 | 99% | 0.986 | 64% | 0.642 | S | S | * | * | S | Bend | trans | -64.1 | 73.4 | 171.5 | -64.5 | -171.3 | 166.4 | 0 | 0 | 111.3 | ||
| 100 | R | 83.4 | Confident | 81 | Confident | 82 Ų | 82 | 122.7 Ų | 122.7 | 31% | 0.309 | 64% | 0.641 | S | S | . | * | trans | -126.5 | 162.5 | -178.8 | 69.5 | 167.3 | -174.7 | 90 | -4.4 | 111.7 | P96 I98 W102 L170 A171 | P96-R100 HydrophobicContact CB-CG 3.68Å; P96-R100 HydrophobicContact CG-CG 3.76Å; P96-R100 WeakPolarHBondContact CG-O 3.44Å; I98-R100 PolarHBondContact O-N 3.26Å; R100-W102 PolarHBondContact NH1-O 3.26Å; R100-L170 PolarHBondContact NH1-O 3.05Å; R100-L170 PolarHBondContact NH2-O 3.12Å; R100-A171 PolarHBondContact NH2-O 3.48Å | ||
| 101 | N | 85.3 | Confident | 81.7 | Confident | 130 Ų | 130 | 122.4 Ų | 122.4 | 70% | 0.695 | 63% | 0.632 | S | S | * | * | trans | -70.1 | 153.3 | 168.9 | -65.7 | -29.7 | 0 | 0 | 0 | 111 | ||||
| 102 | W | 86.1 | Confident | 82.2 | Confident | 117 Ų | 117 | 127.1 Ų | 127.1 | 44% | 0.443 | 64% | 0.636 | S | S | . | * | S | Bend | trans | -65.6 | -45.3 | 179.7 | -78.6 | 97.4 | 0 | 0 | 0 | 112.6 | F94 R100 L170 I172 | F94-W102 HydrophobicContact CB-CZ2 4.49Å; R100-W102 PolarHBondContact NH1-O 3.26Å; W102-L170 HydrophobicContact CB-CD2 4.45Å; W102-L170 CarbonylContact O-C 3.55Å; W102-L170 VanDerWaalsContact O-CA 3.3Å; W102-L170 WeakPolarHBondContact O-CA 3.37Å; W102-I172 HydrophobicContact CE3-CD1 4.27Å; W102-I172 HydrophobicContact CE3-CG1 4.49Å; W102-I172 HydrophobicContact CZ3-CD1 3.9Å; W102-I172 HydrophobicContact CZ3-CG1 4.14Å |
| 103 | V | 87.8 | Confident | 82.8 | Confident | 81 Ų | 81 | 125.8 Ų | 125.8 | 49% | 0.491 | 62% | 0.615 | S | S | . | * | S | Bend | trans | -79.5 | 126.4 | 176.1 | -179 | 0 | 0 | 0 | 0 | 108.7 | I169 | V103-I169 HydrophobicContact CG1-CG2 4.1Š|
| 104 | V | 84.6 | Confident | 83.5 | Confident | 62 Ų | 62 | 125.2 Ų | 125.2 | 38% | 0.376 | 61% | 0.606 | S | S | . | * | trans | -90.8 | 120.4 | 173 | 178.5 | 0 | 0 | 0 | 0 | 108.8 | P106 I169 A171 | V104-P106 VanDerWaalsContact O-CD 3.25Å; V104-P106 WeakPolarHBondContact O-CD 3.48Å; V104-I169 PolarHBondContact N-O 3.33Å; V104-A171 HydrophobicContact CB-CB 4.41Å; V104-A171 HydrophobicContact CG2-CB 3.35Å | ||
| 105 | D | 85.5 | Confident | 84 | Confident | 107 Ų | 107 | 118.9 Ų | 118.9 | 57% | 0.572 | 59% | 0.585 | S | S | * | * | trans | -71.6 | 113.2 | 174 | -67.4 | -45.4 | 0 | 0 | 0 | 109.3 | L107 D108 | D105-L107 PolarHBondContact O-N 2.81Å; D105-L107 VanDerWaalsContact O-N 3.15Å; D105-D108 HydrophobicContact CB-CB 4.22Å | ||
| 106 | P | 80.3 | Confident | 84.5 | Confident | 101 Ų | 101 | 116.7 Ų | 116.7 | 66% | 0.656 | 58% | 0.58 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.1 | -10.3 | -177.1 | 29.8 | -35.7 | 0 | 0 | 0 | 113.1 | V104 L109 | V104-P106 VanDerWaalsContact O-CD 3.25Å; V104-P106 WeakPolarHBondContact O-CD 3.48Å; P106-L109 VanDerWaalsContact O-CD1 3.25Å; P106-L109 WeakPolarHBondContact O-CD1 3.18Å |
| 107 | L | 81.8 | Confident | 85 | Confident | 163 Ų | 163 | 118.3 Ų | 118.3 | 85% | 0.853 | 60% | 0.596 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -102.1 | -7.4 | -173.3 | -71.3 | 152.7 | 0 | 0 | 0 | 113.3 | D105 L109 | D105-L107 PolarHBondContact O-N 2.81Å; D105-L107 VanDerWaalsContact O-N 3.15Å; L107-L109 PolarHBondContact O-N 3.43Å |
| 108 | D | 80.4 | Confident | 85.8 | Confident | 138 Ų | 138 | 114.3 Ų | 114.3 | 74% | 0.738 | 57% | 0.574 | S | S | * | * | trans | -80.9 | 42.1 | -178.5 | -166 | 33.6 | 0 | 0 | 0 | 112.9 | D105 | D105-D108 HydrophobicContact CB-CB 4.22Š| ||
| 109 | L | 80.2 | Confident | 86.4 | Confident | 79 Ų | 79 | 112.9 Ų | 112.9 | 41% | 0.414 | 57% | 0.566 | S | S | . | * | trans | -98.7 | 121.1 | -172.3 | -71.1 | 162.1 | 0 | 0 | 0 | 111.3 | P106 L107 R111 I114 P115 | P106-L109 VanDerWaalsContact O-CD1 3.25Å; P106-L109 WeakPolarHBondContact O-CD1 3.18Å; L107-L109 PolarHBondContact O-N 3.43Å; L109-R111 PolarHBondContact O-N 2.88Å; L109-I114 HydrophobicContact CD2-CB 4.2Å; L109-I114 HydrophobicContact CD2-CD1 4.21Å; L109-I114 HydrophobicContact CD2-CG2 3.78Å; L109-P115 HydrophobicContact CD1-CG 3.65Å | ||
| 110 | E | 82.8 | Confident | 87 | Confident | 184 Ų | 184 | 108.6 Ų | 108.6 | 86% | 0.86 | 55% | 0.549 | S | S | * | . | S | Bend | trans | -60.4 | -27.4 | 178.3 | -63 | -175 | 171.3 | 0 | 0 | 113.9 | ||
| 111 | R | 90.5 | Very high | 87.6 | Confident | 130 Ų | 130 | 107.3 Ų | 107.3 | 49% | 0.491 | 55% | 0.552 | S | S | . | * | trans | -133.8 | 130.3 | -171.7 | -65.4 | 161.5 | -175.6 | -111.4 | 10.9 | 112 | L109 W113 I114 | L109-R111 PolarHBondContact O-N 2.88Å; R111-W113 VanDerWaalsContact C-N 3.29Å; R111-W113 HydrophobicContact CB-CD2 3.99Å; R111-W113 HydrophobicContact CB-CE3 4.21Å; R111-W113 HydrophobicContact CB-CH2 4.24Å; R111-W113 HydrophobicContact CB-CZ2 4.04Å; R111-W113 HydrophobicContact CB-CZ3 4.3Å; R111-W113 HydrophobicContact CG-CH2 3.94Å; R111-W113 HydrophobicContact CG-CZ2 3.86Å; R111-W113 HydrophobicContact CG-CZ3 4.38Å; R111-W113 PolarHBondContact O-N 2.9Å; R111-I114 HydrophobicContact CB-CD1 3.83Å; R111-I114 HydrophobicContact CB-CG1 4.03Å; R111-I114 PolarHBondContact O-N 3.28Å | ||
| 112 | W | 87.3 | Confident | 87.9 | Confident | 207 Ų | 207 | 103.5 Ų | 103.5 | 78% | 0.784 | 54% | 0.538 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.1 | -22.2 | -175.5 | 65.4 | -95.9 | 0 | 0 | 0 | 115.4 | P115 | W112-P115 WeakPolarHBondContact O-CD 3.4Š|
| 113 | W | 90.7 | Very high | 88.3 | Confident | 115 Ų | 115 | 102 Ų | 102 | 44% | 0.436 | 54% | 0.542 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -83.5 | -12.7 | -179.3 | 60.1 | 79.3 | 0 | 0 | 0 | 113.7 | R111 L116 A117 | R111-W113 VanDerWaalsContact C-N 3.29Å; R111-W113 HydrophobicContact CB-CD2 3.99Å; R111-W113 HydrophobicContact CB-CE3 4.21Å; R111-W113 HydrophobicContact CB-CH2 4.24Å; R111-W113 HydrophobicContact CB-CZ2 4.04Å; R111-W113 HydrophobicContact CB-CZ3 4.3Å; R111-W113 HydrophobicContact CG-CH2 3.94Å; R111-W113 HydrophobicContact CG-CZ2 3.86Å; R111-W113 HydrophobicContact CG-CZ3 4.38Å; R111-W113 PolarHBondContact O-N 2.9Å; W113-L116 PolarHBondContact O-N 2.88Å; W113-A117 PolarHBondContact O-N 3.33Å |
| 114 | I | 90.8 | Very high | 88.6 | Confident | 55 Ų | 55 | 103 Ų | 103 | 28% | 0.282 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -60.5 | -49.4 | -179.5 | -62.5 | 168.7 | 0 | 0 | 0 | 111.2 | L109 R111 L116 A117 C118 | L109-I114 HydrophobicContact CD2-CB 4.2Å; L109-I114 HydrophobicContact CD2-CD1 4.21Å; L109-I114 HydrophobicContact CD2-CG2 3.78Å; R111-I114 HydrophobicContact CB-CD1 3.83Å; R111-I114 HydrophobicContact CB-CG1 4.03Å; R111-I114 PolarHBondContact O-N 3.28Å; I114-L116 PolarHBondContact O-N 3.16Å; I114-A117 PolarHBondContact O-N 3.44Å; I114-A117 VanDerWaalsContact O-N 3.13Å; I114-C118 PolarHBondContact O-N 2.87Å; I114-C118 PolarHBondContact O-SG 3.08Å |
| 115 | P | 88.2 | Confident | 89 | Confident | 68 Ų | 68 | 104.9 Ų | 104.9 | 44% | 0.442 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -53.9 | -39.1 | 174.6 | -26.4 | 33.4 | 0 | 0 | 0 | 113.9 | L109 W112 C118 | L109-P115 HydrophobicContact CD1-CG 3.65Å; W112-P115 WeakPolarHBondContact O-CD 3.4Å; P115-C118 PolarHBondContact O-N 3.11Å |
| 116 | L | 90.6 | Very high | 89.3 | Confident | 116 Ų | 116 | 104 Ų | 104 | 61% | 0.607 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -70.3 | -40.3 | -179.9 | -168.3 | 69.6 | 0 | 0 | 0 | 111.4 | W113 I114 C118 I119 | W113-L116 PolarHBondContact O-N 2.88Å; I114-L116 PolarHBondContact O-N 3.16Å; L116-C118 VanDerWaalsContact C-N 3.31Å; L116-C118 PolarHBondContact O-N 2.94Å; L116-I119 HydrophobicContact CD1-CD1 3.82Å; L116-I119 WeakPolarHBondContact O-CB 3.42Å; L116-I119 WeakPolarHBondContact O-CG1 3.32Å; L116-I119 PolarHBondContact O-N 3.24Å |
| 117 | A | 92.5 | Very high | 89.9 | Confident | 61 Ų | 61 | 103.6 Ų | 103.6 | 50% | 0.504 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -64.7 | -34.6 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | W113 I114 I119 L120 P121 | W113-A117 PolarHBondContact O-N 3.33Å; I114-A117 PolarHBondContact O-N 3.44Å; I114-A117 VanDerWaalsContact O-N 3.13Å; A117-I119 PolarHBondContact O-N 3.28Å; A117-L120 PolarHBondContact O-N 3.49Å; A117-P121 WeakPolarHBondContact O-CD 3.27Å |
| 118 | C | 91.4 | Very high | 90.4 | Very high | 68 Ų | 68 | 100 Ų | 100 | 46% | 0.459 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -64.6 | -18.1 | 178 | -69.6 | 0 | 0 | 0 | 0 | 114.2 | I114 P115 L116 L120 P121 A122 | I114-C118 PolarHBondContact O-N 2.87Å; I114-C118 PolarHBondContact O-SG 3.08Å; P115-C118 PolarHBondContact O-N 3.11Å; L116-C118 VanDerWaalsContact C-N 3.31Å; L116-C118 PolarHBondContact O-N 2.94Å; C118-L120 VanDerWaalsContact C-N 3.28Å; C118-L120 PolarHBondContact O-N 2.87Å; C118-P121 WeakPolarHBondContact O-CD 3.33Å; C118-A122 VanDerWaalsContact O-CB 3.26Å; C118-A122 WeakPolarHBondContact O-CB 3.3Å; C118-A122 PolarHBondContact O-N 3.33Å |
| 119 | I | 93.3 | Very high | 90.8 | Very high | 96 Ų | 96 | 94.7 Ų | 94.7 | 49% | 0.492 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -59.2 | -40.4 | 175.9 | -63.2 | 178.4 | 0 | 0 | 0 | 111.1 | L116 A117 A122 V123 | L116-I119 HydrophobicContact CD1-CD1 3.82Å; L116-I119 WeakPolarHBondContact O-CB 3.42Å; L116-I119 WeakPolarHBondContact O-CG1 3.32Å; L116-I119 PolarHBondContact O-N 3.24Å; A117-I119 PolarHBondContact O-N 3.28Å; I119-A122 PolarHBondContact O-N 3.11Å; I119-V123 HydrophobicContact CG2-CG2 4.41Å; I119-V123 WeakPolarHBondContact O-CG2 3.46Å; I119-V123 PolarHBondContact O-N 3.46Å |
| 120 | L | 94.5 | Very high | 91.4 | Very high | 121 Ų | 121 | 94.7 Ų | 94.7 | 63% | 0.634 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -66 | -52.9 | -177.3 | -179.2 | 159.1 | 0 | 0 | 0 | 111.8 | A117 C118 A122 V123 L124 | A117-L120 PolarHBondContact O-N 3.49Å; C118-L120 VanDerWaalsContact C-N 3.28Å; C118-L120 PolarHBondContact O-N 2.87Å; L120-A122 VanDerWaalsContact C-N 3.29Å; L120-A122 PolarHBondContact O-N 2.78Å; L120-V123 PolarHBondContact O-N 3.19Å; L120-L124 HydrophobicContact CD2-CD1 3.95Å; L120-L124 PolarHBondContact O-N 3.32Å |
| 121 | P | 94 | Very high | 91.8 | Very high | 55 Ų | 55 | 90.9 Ų | 90.9 | 36% | 0.357 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -57.2 | -39.3 | 171 | -26.3 | 34.3 | 0 | 0 | 0 | 113.3 | A117 C118 V123 L124 F125 | A117-P121 WeakPolarHBondContact O-CD 3.27Å; C118-P121 WeakPolarHBondContact O-CD 3.33Å; P121-V123 PolarHBondContact O-N 2.81Å; P121-L124 WeakPolarHBondContact O-CB 3.39Å; P121-L124 PolarHBondContact O-N 3.24Å; P121-F125 HydrophobicContact CB-CD2 4.49Å; P121-F125 HydrophobicContact CB-CE2 4.39Å; P121-F125 WeakPolarHBondContact O-CD2 3.37Å; P121-F125 PolarHBondContact O-N 3.44Å |
| 122 | A | 92.2 | Very high | 91.8 | Very high | 49 Ų | 49 | 86.2 Ų | 86.2 | 41% | 0.405 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -60.9 | -44 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | C118 I119 L120 L124 F125 V126 | C118-A122 VanDerWaalsContact O-CB 3.26Å; C118-A122 WeakPolarHBondContact O-CB 3.3Å; C118-A122 PolarHBondContact O-N 3.33Å; I119-A122 PolarHBondContact O-N 3.11Å; L120-A122 VanDerWaalsContact C-N 3.29Å; L120-A122 PolarHBondContact O-N 2.78Å; A122-L124 VanDerWaalsContact C-N 3.33Å; A122-L124 PolarHBondContact O-N 3.34Å; A122-F125 PolarHBondContact O-N 2.86Å; A122-V126 WeakPolarHBondContact O-CG2 3.16Å; A122-V126 PolarHBondContact O-N 2.84Å |
| 123 | V | 94.6 | Very high | 92 | Very high | 87 Ų | 87 | 76.9 Ų | 76.9 | 53% | 0.527 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -61.4 | -42.4 | 175.2 | 171.4 | 0 | 0 | 0 | 0 | 111.2 | I119 L120 P121 F125 V126 V127 | I119-V123 HydrophobicContact CG2-CG2 4.41Å; I119-V123 WeakPolarHBondContact O-CG2 3.46Å; I119-V123 PolarHBondContact O-N 3.46Å; L120-V123 PolarHBondContact O-N 3.19Å; P121-V123 PolarHBondContact O-N 2.81Å; V123-F125 PolarHBondContact O-N 3.36Å; V123-V126 PolarHBondContact O-N 3.17Å; V123-V127 WeakPolarHBondContact O-CG2 3.49Å; V123-V127 PolarHBondContact O-N 3.32Å |
| 124 | L | 94.7 | Very high | 92.1 | Very high | 101 Ų | 101 | 77.3 Ų | 77.3 | 53% | 0.529 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -62.1 | -42.5 | 176.3 | -65.7 | 176.1 | 0 | 0 | 0 | 111.9 | L120 P121 A122 V127 L128 | L120-L124 HydrophobicContact CD2-CD1 3.95Å; L120-L124 PolarHBondContact O-N 3.32Å; P121-L124 WeakPolarHBondContact O-CB 3.39Å; P121-L124 PolarHBondContact O-N 3.24Å; A122-L124 VanDerWaalsContact C-N 3.33Å; A122-L124 PolarHBondContact O-N 3.34Å; L124-V127 PolarHBondContact O-N 2.85Å; L124-L128 WeakPolarHBondContact O-CG 3.43Å; L124-L128 PolarHBondContact O-N 3.44Å |
| 125 | F | 92.2 | Very high | 92.1 | Very high | 102 Ų | 102 | 78 Ų | 78 | 45% | 0.447 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -64.7 | -40.6 | 175.6 | -78.5 | -60.7 | 0 | 0 | 0 | 112.7 | P121 A122 V123 V127 L128 I129 L174 | P121-F125 HydrophobicContact CB-CD2 4.49Å; P121-F125 HydrophobicContact CB-CE2 4.39Å; P121-F125 WeakPolarHBondContact O-CD2 3.37Å; P121-F125 PolarHBondContact O-N 3.44Å; A122-F125 PolarHBondContact O-N 2.86Å; V123-F125 PolarHBondContact O-N 3.36Å; F125-V127 VanDerWaalsContact C-N 3.32Å; F125-V127 PolarHBondContact O-N 2.96Å; F125-L128 HydrophobicContact CD1-CD1 4.37Å; F125-L128 PolarHBondContact O-N 3.27Å; F125-I129 WeakPolarHBondContact O-CG1 3.39Å; F125-I129 PolarHBondContact O-N 3.42Å; F125-L174 HydrophobicContact CB-CD1 4.37Å; F125-L174 HydrophobicContact CD1-CD1 3.42Å; F125-L174 VanDerWaalsContact CD1-CD1 3.42Å; F125-L174 HydrophobicContact CD2-CD1 4.26Å; F125-L174 HydrophobicContact CE1-CD1 3.63Å; F125-L174 HydrophobicContact CE2-CD1 4.43Å; F125-L174 HydrophobicContact CG-CD1 3.78Å; F125-L174 HydrophobicContact CZ-CD1 4.14Å |
| 126 | V | 92 | Very high | 92.3 | Very high | 89 Ų | 89 | 75.2 Ų | 75.2 | 54% | 0.539 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -60.4 | -44.2 | 175.3 | 169.8 | 0 | 0 | 0 | 0 | 110.7 | A122 V123 L128 I129 V130 | A122-V126 WeakPolarHBondContact O-CG2 3.16Å; A122-V126 PolarHBondContact O-N 2.84Å; V123-V126 PolarHBondContact O-N 3.17Å; V126-L128 VanDerWaalsContact C-N 3.34Å; V126-L128 PolarHBondContact O-N 3.45Å; V126-I129 PolarHBondContact O-N 2.81Å; V126-V130 HydrophobicContact CG1-CG2 4.45Å; V126-V130 WeakPolarHBondContact O-CB 3.26Å; V126-V130 WeakPolarHBondContact O-CG2 3.48Å; V126-V130 PolarHBondContact O-N 3.4Å |
| 127 | V | 93.2 | Very high | 92.2 | Very high | 91 Ų | 91 | 70.8 Ų | 70.8 | 55% | 0.552 | 40% | 0.402 | S | S | * | . | H | α-helix | trans | -61.3 | -43.4 | 176.2 | 172.3 | 0 | 0 | 0 | 0 | 111.1 | V123 L124 F125 M131 | V123-V127 WeakPolarHBondContact O-CG2 3.49Å; V123-V127 PolarHBondContact O-N 3.32Å; L124-V127 PolarHBondContact O-N 2.85Å; F125-V127 VanDerWaalsContact C-N 3.32Å; F125-V127 PolarHBondContact O-N 2.96Å; V127-M131 WeakPolarHBondContact O-CB 3.44Å; V127-M131 PolarHBondContact O-N 3.3Å |
| 128 | L | 91.8 | Very high | 92.2 | Very high | 89 Ų | 89 | 71.2 Ų | 71.2 | 47% | 0.466 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -62.2 | -47.3 | 177.6 | -73.2 | 171.3 | 0 | 0 | 0 | 112.2 | L124 F125 V126 M131 D132 | L124-L128 WeakPolarHBondContact O-CG 3.43Å; L124-L128 PolarHBondContact O-N 3.44Å; F125-L128 HydrophobicContact CD1-CD1 4.37Å; F125-L128 PolarHBondContact O-N 3.27Å; V126-L128 VanDerWaalsContact C-N 3.34Å; V126-L128 PolarHBondContact O-N 3.45Å; L128-M131 PolarHBondContact O-N 3.05Å; L128-D132 VanDerWaalsContact O-CB 3.3Å; L128-D132 WeakPolarHBondContact O-CB 3.49Å; L128-D132 PolarHBondContact O-N 3.42Å |
| 129 | I | 90.2 | Very high | 92.1 | Very high | 26 Ų | 26 | 71 Ų | 71 | 13% | 0.133 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -62.5 | -46.2 | 179.7 | -68.4 | 167.1 | 0 | 0 | 0 | 110.4 | F125 V126 M131 Q133 T164 | F125-I129 WeakPolarHBondContact O-CG1 3.39Å; F125-I129 PolarHBondContact O-N 3.42Å; V126-I129 PolarHBondContact O-N 2.81Å; I129-M131 PolarHBondContact O-N 2.97Å; I129-Q133 WeakPolarHBondContact O-CB 3.32Å; I129-Q133 PolarHBondContact O-N 3.13Å; I129-T164 HydrophobicContact CD1-CG2 3.82Å |
| 130 | V | 91 | Very high | 91.7 | Very high | 79 Ų | 79 | 68 Ų | 68 | 48% | 0.479 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -65.3 | -40.2 | 178.7 | 171.8 | 0 | 0 | 0 | 0 | 111.3 | V126 H134 | V126-V130 HydrophobicContact CG1-CG2 4.45Å; V126-V130 WeakPolarHBondContact O-CB 3.26Å; V126-V130 WeakPolarHBondContact O-CG2 3.48Å; V126-V130 PolarHBondContact O-N 3.4Å; V130-H134 VanDerWaalsContact O-CB 3.24Å; V130-H134 WeakPolarHBondContact O-CB 3.21Å; V130-H134 PolarHBondContact O-N 3.24Å |
| 131 | M | 92.2 | Very high | 91.3 | Very high | 104 Ų | 104 | 64.3 Ų | 64.3 | 51% | 0.512 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -64.9 | -49.6 | 178.3 | -173.4 | -145.3 | 73.7 | 0 | 0 | 111.4 | V127 L128 I129 Q133 H134 V135 | V127-M131 WeakPolarHBondContact O-CB 3.44Å; V127-M131 PolarHBondContact O-N 3.3Å; L128-M131 PolarHBondContact O-N 3.05Å; I129-M131 PolarHBondContact O-N 2.97Å; M131-Q133 VanDerWaalsContact C-N 3.34Å; M131-Q133 PolarHBondContact O-N 3.01Å; M131-H134 PolarHBondContact O-N 3.25Å; M131-V135 WeakPolarHBondContact O-CG2 3.32Å; M131-V135 PolarHBondContact O-N 2.86Å |
| 132 | D | 91.2 | Very high | 91 | Very high | 32 Ų | 32 | 67.9 Ų | 67.9 | 17% | 0.171 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -63.2 | -42 | -179.7 | -172.4 | 57.1 | 0 | 0 | 0 | 111.5 | L128 H134 V135 T136 S177 | L128-D132 VanDerWaalsContact O-CB 3.3Å; L128-D132 WeakPolarHBondContact O-CB 3.49Å; L128-D132 PolarHBondContact O-N 3.42Å; D132-H134 PolarHBondContact O-N 2.88Å; D132-V135 PolarHBondContact O-N 3.07Å; D132-T136 WeakPolarHBondContact O-CB 3.41Å; D132-T136 PolarHBondContact O-N 3.49Å; D132-T136 PolarHBondContact O-OG1 2.86Å; D132-S177 WeakPolarHBondContact OD2-CA 3.3Å; D132-S177 VanDerWaalsContact OD2-CB 3.3Å; D132-S177 WeakPolarHBondContact OD2-CB 3.47Å; D132-S177 PolarHBondContact OD2-N 3.1Å; D132-S177 VanDerWaalsContact OD2-O 3.13Å |
| 133 | Q | 91.2 | Very high | 90.6 | Very high | 11 Ų | 11 | 75.1 Ų | 75.1 | 5% | 0.051 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -61.4 | -43.9 | 172.8 | -177.9 | 55.3 | 19.1 | 0 | 0 | 111.9 | I129 M131 T136 T137 D156 S177 | I129-Q133 WeakPolarHBondContact O-CB 3.32Å; I129-Q133 PolarHBondContact O-N 3.13Å; M131-Q133 VanDerWaalsContact C-N 3.34Å; M131-Q133 PolarHBondContact O-N 3.01Å; Q133-T136 PolarHBondContact O-N 2.88Å; Q133-T137 VanDerWaalsContact O-CG2 3.28Å; Q133-T137 WeakPolarHBondContact O-CG2 3.33Å; Q133-T137 PolarHBondContact O-N 2.87Å; Q133-T137 PolarHBondContact O-OG1 3.41Å; Q133-D156 PolarHBondContact NE2-OD2 3.39Å; Q133-S177 PolarHBondContact OE1-OG 3.42Å |
| 134 | H | 91.6 | Very high | 90 | Very high | 123 Ų | 123 | 76.3 Ų | 76.3 | 57% | 0.569 | 39% | 0.386 | S | S | * | . | H | α-helix | trans | -63.3 | -44.9 | 177.3 | -174.3 | -166 | 0 | 0 | 0 | 111.7 | V130 M131 D132 T136 T137 V138 | V130-H134 VanDerWaalsContact O-CB 3.24Å; V130-H134 WeakPolarHBondContact O-CB 3.21Å; V130-H134 PolarHBondContact O-N 3.24Å; M131-H134 PolarHBondContact O-N 3.25Å; D132-H134 PolarHBondContact O-N 2.88Å; H134-T136 VanDerWaalsContact C-N 3.33Å; H134-T136 PolarHBondContact O-N 3.5Å; H134-T137 PolarHBondContact O-N 3.06Å; H134-T137 PolarHBondContact O-OG1 3.37Å; H134-V138 WeakPolarHBondContact O-CB 3.42Å; H134-V138 VanDerWaalsContact O-CG2 3.29Å; H134-V138 WeakPolarHBondContact O-CG2 3.32Å; H134-V138 PolarHBondContact O-N 3.07Å |
| 135 | V | 92.5 | Very high | 89.3 | Confident | 70 Ų | 70 | 71.9 Ų | 71.9 | 42% | 0.424 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -60.8 | -44.4 | 175.9 | 174.1 | 0 | 0 | 0 | 0 | 110.7 | M131 D132 T137 V138 M139 | M131-V135 WeakPolarHBondContact O-CG2 3.32Å; M131-V135 PolarHBondContact O-N 2.86Å; D132-V135 PolarHBondContact O-N 3.07Å; V135-T137 PolarHBondContact O-N 3.08Å; V135-V138 PolarHBondContact O-N 3.49Å; V135-M139 HydrophobicContact CG1-CG 4.32Å; V135-M139 WeakPolarHBondContact O-CB 3.42Å; V135-M139 VanDerWaalsContact O-CG 3.26Å; V135-M139 WeakPolarHBondContact O-CG 3.41Å; V135-M139 PolarHBondContact O-N 2.89Å |
| 136 | T | 91.1 | Very high | 88.6 | Confident | 9 Ų | 9 | 73.3 Ų | 73.3 | 6% | 0.055 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -59 | -49.8 | 177.8 | -56.7 | 0 | 0 | 0 | 0 | 111.3 | D132 Q133 H134 V138 M139 M140 T179 | D132-T136 WeakPolarHBondContact O-CB 3.41Å; D132-T136 PolarHBondContact O-N 3.49Å; D132-T136 PolarHBondContact O-OG1 2.86Å; Q133-T136 PolarHBondContact O-N 2.88Å; H134-T136 VanDerWaalsContact C-N 3.33Å; H134-T136 PolarHBondContact O-N 3.5Å; T136-V138 PolarHBondContact O-N 3.47Å; T136-M139 PolarHBondContact O-N 2.78Å; T136-M140 WeakPolarHBondContact O-CG 3.43Å; T136-M140 PolarHBondContact O-N 3.33Å; T136-T179 WeakPolarHBondContact OG1-CG2 3.12Å |
| 137 | T | 89.7 | Confident | 87.9 | Confident | 23 Ų | 23 | 71.9 Ų | 71.9 | 14% | 0.141 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -63.6 | -38.6 | 179.9 | 58.6 | 0 | 0 | 0 | 0 | 113.2 | Q133 H134 V135 M140 N141 Y153 | Q133-T137 VanDerWaalsContact O-CG2 3.28Å; Q133-T137 WeakPolarHBondContact O-CG2 3.33Å; Q133-T137 PolarHBondContact O-N 2.87Å; Q133-T137 PolarHBondContact O-OG1 3.41Å; H134-T137 PolarHBondContact O-N 3.06Å; H134-T137 PolarHBondContact O-OG1 3.37Å; V135-T137 PolarHBondContact O-N 3.08Å; T137-M140 PolarHBondContact O-N 2.83Å; T137-N141 WeakPolarHBondContact O-CB 3.47Å; T137-N141 PolarHBondContact O-N 3.02Å; T137-Y153 HydrophobicContact CG2-CD1 3.53Å; T137-Y153 HydrophobicContact CG2-CE1 3.89Å |
| 138 | V | 91 | Very high | 87.1 | Confident | 71 Ų | 71 | 79 Ų | 79 | 43% | 0.43 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -66.4 | -40.4 | 176.2 | 169.4 | 0 | 0 | 0 | 0 | 111 | H134 V135 T136 N141 | H134-V138 WeakPolarHBondContact O-CB 3.42Å; H134-V138 VanDerWaalsContact O-CG2 3.29Å; H134-V138 WeakPolarHBondContact O-CG2 3.32Å; H134-V138 PolarHBondContact O-N 3.07Å; V135-V138 PolarHBondContact O-N 3.49Å; T136-V138 PolarHBondContact O-N 3.47Å; V138-N141 PolarHBondContact O-N 3.3Å |
| 139 | M | 89.3 | Confident | 86.3 | Confident | 64 Ų | 64 | 83.2 Ų | 83.2 | 32% | 0.315 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -68.2 | -36.9 | 176.6 | -71.7 | -59.5 | -67.9 | 0 | 0 | 112.4 | V135 T136 R142 L183 | V135-M139 HydrophobicContact CG1-CG 4.32Å; V135-M139 WeakPolarHBondContact O-CB 3.42Å; V135-M139 VanDerWaalsContact O-CG 3.26Å; V135-M139 WeakPolarHBondContact O-CG 3.41Å; V135-M139 PolarHBondContact O-N 2.89Å; T136-M139 PolarHBondContact O-N 2.78Å; M139-R142 WeakPolarHBondContact O-CG 3.31Å; M139-R142 PolarHBondContact SD-NH2 3.25Å; M139-L183 HydrophobicContact CE-CD1 4.49Å |
| 140 | M | 86.1 | Confident | 85.8 | Confident | 31 Ų | 31 | 84.1 Ų | 84.1 | 15% | 0.153 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -66.5 | -40.6 | 173.2 | -69.6 | -55.5 | 122.8 | 0 | 0 | 112 | T136 T137 R142 N145 L147 S182 L183 M186 | T136-M140 WeakPolarHBondContact O-CG 3.43Å; T136-M140 PolarHBondContact O-N 3.33Å; T137-M140 PolarHBondContact O-N 2.83Å; M140-R142 PolarHBondContact O-N 2.91Å; M140-N145 PolarHBondContact O-ND2 3.45Å; M140-L147 WeakPolarHBondContact O-CD1 3.46Å; M140-S182 VanDerWaalsContact CE-OG 3.32Å; M140-S182 WeakPolarHBondContact CE-OG 3.48Å; M140-L183 HydrophobicContact CE-CB 4.23Å; M140-L183 HydrophobicContact CE-CD2 3.38Å; M140-L183 HydrophobicContact CE-CG 3.51Å; M140-L183 HydrophobicContact SD-CD2 4.46Å; M140-M186 HydrophobicContact SD-CB 4.15Å; M140-M186 HydrophobicContact SD-CG 4.41Å |
| 141 | N | 86.7 | Confident | 85.5 | Confident | 45 Ų | 45 | 89 Ų | 89 | 24% | 0.241 | 42% | 0.42 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -87.1 | 27.8 | -175.4 | -156.4 | 18 | 0 | 0 | 0 | 114.3 | T137 V138 K143 Y153 | T137-N141 WeakPolarHBondContact O-CB 3.47Å; T137-N141 PolarHBondContact O-N 3.02Å; V138-N141 PolarHBondContact O-N 3.3Å; N141-K143 PolarHBondContact O-N 3.34Å; N141-Y153 VanDerWaalsContact CB-OH 3.31Å; N141-Y153 WeakPolarHBondContact CB-OH 3.48Å; N141-Y153 PolarHBondContact ND2-OH 3.49Å |
| 142 | R | 86.6 | Confident | 85.1 | Confident | 130 Ų | 130 | 86.4 Ų | 86.4 | 49% | 0.491 | 42% | 0.419 | S | S | . | . | trans | -58 | 140.9 | 171.7 | -70.8 | -73.8 | -178.2 | 175.5 | 0.7 | 109.2 | M139 M140 E144 N145 | M139-R142 WeakPolarHBondContact O-CG 3.31Å; M139-R142 PolarHBondContact SD-NH2 3.25Å; M140-R142 PolarHBondContact O-N 2.91Å; R142-E144 PolarHBondContact O-N 2.77Å; R142-N145 PolarHBondContact O-N 2.8Å | ||
| 143 | K | 83.9 | Confident | 84.8 | Confident | 201 Ų | 201 | 88.2 Ų | 88.2 | 87% | 0.874 | 42% | 0.424 | S | S | * | . | G | 310 helix | trans | -52.9 | -28.4 | -179.6 | -66.1 | -176.7 | -179.8 | 180 | 0 | 112.7 | N141 N145 K146 | N141-K143 PolarHBondContact O-N 3.34Å; K143-N145 VanDerWaalsContact C-N 3.29Å; K143-N145 PolarHBondContact O-N 2.9Å; K143-K146 PolarHBondContact O-N 3.14Å |
| 144 | E | 82.2 | Confident | 84.8 | Confident | 112 Ų | 112 | 94.2 Ų | 94.2 | 52% | 0.523 | 45% | 0.452 | S | S | . | . | G | 310 helix | trans | -62.3 | -32 | 176.7 | -57.8 | -177.8 | 165 | 0 | 0 | 113.5 | R142 K146 R201 F204 | R142-E144 PolarHBondContact O-N 2.77Å; E144-K146 VanDerWaalsContact C-N 3.34Å; E144-R201 IonicContact OE1-NH1 3.85Å; E144-F204 WeakPolarHBondContact O-CB 3.34Å; E144-F204 WeakPolarHBondContact O-CG 3.35Å |
| 145 | N | 79.3 | Confident | 84.8 | Confident | 7 Ų | 7 | 93.6 Ų | 93.6 | 4% | 0.037 | 45% | 0.452 | C | S | . | . | G | 310 helix | trans | -86.7 | -4.8 | -178.6 | -61.5 | -22.4 | 0 | 0 | 0 | 112.8 | M140 R142 K143 L147 R190 F204 | M140-N145 PolarHBondContact O-ND2 3.45Å; R142-N145 PolarHBondContact O-N 2.8Å; K143-N145 VanDerWaalsContact C-N 3.29Å; K143-N145 PolarHBondContact O-N 2.9Å; N145-L147 HydrophobicContact CB-CD1 4.33Å; N145-L147 HydrophobicContact CB-CG 3.98Å; N145-L147 WeakPolarHBondContact O-CD2 3.43Å; N145-L147 WeakPolarHBondContact O-CG 3.29Å; N145-L147 PolarHBondContact O-N 2.94Å; N145-R190 PolarHBondContact OD1-NH1 3.23Å; N145-F204 VanDerWaalsContact C-CE1 3.43Å; N145-F204 WeakPolarHBondContact O-CE1 3.31Å; N145-F204 WeakPolarHBondContact O-CZ 3.18Å |
| 146 | K | 78.4 | Confident | 84.6 | Confident | 133 Ų | 133 | 93.2 Ų | 93.2 | 58% | 0.578 | 45% | 0.447 | S | S | * | . | trans | 43.1 | 35.1 | 176.2 | -57.9 | -179.8 | -173.7 | 163.2 | 0 | 114.6 | K143 E144 F204 | K143-K146 PolarHBondContact O-N 3.14Å; E144-K146 VanDerWaalsContact C-N 3.34Å; K146-F204 HydrophobicContact CB-CD1 4.14Å; K146-F204 HydrophobicContact CB-CE1 4.19Å; K146-F204 HydrophobicContact CD-CD1 4.19Å; K146-F204 HydrophobicContact CG-CD1 4.17Å; K146-F204 PolarHBondContact NZ-O 3.33Å; K146-F204 VanDerWaalsContact NZ-O 3.09Å | ||
| 147 | L | 77.8 | Confident | 84.5 | Confident | 58 Ų | 58 | 96.9 Ų | 96.9 | 30% | 0.304 | 47% | 0.466 | S | S | . | . | trans | -74.4 | 137.6 | -178.1 | -60.4 | 179.6 | 0 | 0 | 0 | 110.4 | M140 N145 L207 | M140-L147 WeakPolarHBondContact O-CD1 3.46Å; N145-L147 HydrophobicContact CB-CD1 4.33Å; N145-L147 HydrophobicContact CB-CG 3.98Å; N145-L147 WeakPolarHBondContact O-CD2 3.43Å; N145-L147 WeakPolarHBondContact O-CG 3.29Å; N145-L147 PolarHBondContact O-N 2.94Å; L147-L207 HydrophobicContact CD2-CD1 3.56Å; L147-L207 HydrophobicContact CD2-CG 4.2Å | ||
| 148 | R | 75.6 | Confident | 84.7 | Confident | 240 Ų | 240 | 100.9 Ų | 100.9 | 91% | 0.906 | 49% | 0.486 | S | S | * | . | trans | -78.7 | 130.9 | 172.4 | -66 | -172.9 | -179.8 | -156.7 | 0.8 | 108.8 | G150 | R148-G150 PolarHBondContact O-N 3.3Š| ||
| 149 | K | 74.2 | Confident | 84.7 | Confident | 179 Ų | 179 | 100.8 Ų | 100.8 | 78% | 0.778 | 49% | 0.486 | S | S | * | . | trans | -66.1 | 103.6 | 172.9 | -65.1 | -176.9 | -179.9 | -176.4 | 0 | 108.6 | Y153 | K149-Y153 HydrophobicContact CB-CE2 4.5Å; K149-Y153 HydrophobicContact CG-CE2 4.48Å | ||
| 150 | G | 79.6 | Confident | 84.8 | Confident | 44 Ų | 44 | 97.9 Ų | 97.9 | 45% | 0.454 | 47% | 0.471 | S | S | . | . | trans | -114.2 | -169.8 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | R148 G152 | R148-G150 PolarHBondContact O-N 3.3Å; G150-G152 PolarHBondContact O-N 3.26Å; G150-G152 VanDerWaalsContact O-N 3.13Å | ||
| 151 | F | 85.6 | Confident | 85 | Confident | 183 Ų | 183 | 98.7 Ų | 98.7 | 80% | 0.803 | 48% | 0.483 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.1 | -4.3 | 176.4 | -61.2 | -79.2 | 0 | 0 | 0 | 114.4 | Y153 H154 L155 | F151-Y153 VanDerWaalsContact C-N 3.26Å; F151-Y153 PolarHBondContact O-N 3.35Å; F151-H154 PolarHBondContact O-N 3.11Å; F151-H154 VanDerWaalsContact O-N 3.12Å; F151-L155 PolarHBondContact O-N 3.06Å; F151-L155 VanDerWaalsContact O-N 3.16Å |
| 152 | G | 84.6 | Confident | 85.4 | Confident | 48 Ų | 48 | 100 Ų | 100 | 50% | 0.495 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -55.9 | -36.4 | -177.3 | 0 | 0 | 0 | 0 | 0 | 113.6 | G150 H154 L155 D156 | G150-G152 PolarHBondContact O-N 3.26Å; G150-G152 VanDerWaalsContact O-N 3.13Å; G152-H154 PolarHBondContact O-N 3.06Å; G152-L155 PolarHBondContact O-N 3.28Å; G152-D156 VanDerWaalsContact O-CB 3.29Å; G152-D156 WeakPolarHBondContact O-CB 3.4Å; G152-D156 PolarHBondContact O-N 3.3Å |
| 153 | Y | 84.9 | Confident | 85.7 | Confident | 71 Ų | 71 | 97 Ų | 97 | 28% | 0.278 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -66.3 | -36.3 | 178.9 | -59.6 | -66.2 | 0 | 0 | 0 | 113.5 | T137 N141 K149 F151 L157 | T137-Y153 HydrophobicContact CG2-CD1 3.53Å; T137-Y153 HydrophobicContact CG2-CE1 3.89Å; N141-Y153 VanDerWaalsContact CB-OH 3.31Å; N141-Y153 WeakPolarHBondContact CB-OH 3.48Å; N141-Y153 PolarHBondContact ND2-OH 3.49Å; K149-Y153 HydrophobicContact CB-CE2 4.5Å; K149-Y153 HydrophobicContact CG-CE2 4.48Å; F151-Y153 VanDerWaalsContact C-N 3.26Å; F151-Y153 PolarHBondContact O-N 3.35Å; Y153-L157 PolarHBondContact O-N 3.45Å; Y153-L157 VanDerWaalsContact O-N 3.09Å |
| 154 | H | 90.1 | Very high | 86 | Confident | 137 Ų | 137 | 88.9 Ų | 88.9 | 63% | 0.634 | 45% | 0.453 | S | S | * | . | H | α-helix | trans | -72.4 | -40.8 | 177.4 | -62.1 | -64.1 | 0 | 0 | 0 | 110.9 | F151 G152 D156 L157 L158 | F151-H154 PolarHBondContact O-N 3.11Å; F151-H154 VanDerWaalsContact O-N 3.12Å; G152-H154 PolarHBondContact O-N 3.06Å; H154-D156 VanDerWaalsContact C-N 3.31Å; H154-L157 PolarHBondContact O-N 3.14Å; H154-L158 WeakPolarHBondContact O-CB 3.49Å; H154-L158 PolarHBondContact O-N 2.84Å |
| 155 | L | 90.9 | Very high | 86.4 | Confident | 110 Ų | 110 | 88.8 Ų | 88.8 | 58% | 0.576 | 46% | 0.455 | S | S | * | . | H | α-helix | trans | -61.2 | -42.5 | 174 | -177.3 | 67.3 | 0 | 0 | 0 | 111 | F151 G152 L158 V159 | F151-L155 PolarHBondContact O-N 3.06Å; F151-L155 VanDerWaalsContact O-N 3.16Å; G152-L155 PolarHBondContact O-N 3.28Å; L155-L158 WeakPolarHBondContact O-CB 3.49Å; L155-L158 PolarHBondContact O-N 3.44Å; L155-V159 HydrophobicContact CD1-CG2 4.45Å; L155-V159 HydrophobicContact CG-CG2 4.43Å; L155-V159 VanDerWaalsContact O-CG2 3.27Å; L155-V159 WeakPolarHBondContact O-CG2 3.27Å; L155-V159 PolarHBondContact O-N 3.48Å |
| 156 | D | 89.9 | Confident | 87.1 | Confident | 61 Ų | 61 | 92.4 Ų | 92.4 | 33% | 0.326 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -62.9 | -46.2 | 178.9 | -164.9 | 16 | 0 | 0 | 0 | 111.8 | Q133 G152 H154 L158 V159 C160 | Q133-D156 PolarHBondContact NE2-OD2 3.39Å; G152-D156 VanDerWaalsContact O-CB 3.29Å; G152-D156 WeakPolarHBondContact O-CB 3.4Å; G152-D156 PolarHBondContact O-N 3.3Å; H154-D156 VanDerWaalsContact C-N 3.31Å; D156-L158 VanDerWaalsContact C-N 3.32Å; D156-L158 PolarHBondContact O-N 3.03Å; D156-V159 PolarHBondContact O-N 3.48Å; D156-C160 WeakPolarHBondContact O-CB 3.39Å; D156-C160 PolarHBondContact O-N 3.21Å; D156-C160 PolarHBondContact O-SG 2.9Å |
| 157 | L | 89.2 | Confident | 87.7 | Confident | 87 Ų | 87 | 86.6 Ų | 86.6 | 46% | 0.455 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -61 | -40.1 | 174.4 | -174.7 | 66.3 | 0 | 0 | 0 | 112.2 | Y153 H154 A161 | Y153-L157 PolarHBondContact O-N 3.45Å; Y153-L157 VanDerWaalsContact O-N 3.09Å; H154-L157 PolarHBondContact O-N 3.14Å; L157-A161 WeakPolarHBondContact O-CB 3.39Å; L157-A161 PolarHBondContact O-N 3.16Å |
| 158 | L | 92 | Very high | 88.2 | Confident | 107 Ų | 107 | 86 Ų | 86 | 56% | 0.56 | 46% | 0.458 | S | S | * | . | H | α-helix | trans | -64.6 | -45.3 | 176.4 | -179.9 | 66.3 | 0 | 0 | 0 | 111.5 | H154 L155 D156 A161 V162 | H154-L158 WeakPolarHBondContact O-CB 3.49Å; H154-L158 PolarHBondContact O-N 2.84Å; L155-L158 WeakPolarHBondContact O-CB 3.49Å; L155-L158 PolarHBondContact O-N 3.44Å; D156-L158 VanDerWaalsContact C-N 3.32Å; D156-L158 PolarHBondContact O-N 3.03Å; L158-A161 PolarHBondContact O-N 2.85Å; L158-V162 WeakPolarHBondContact O-CG2 3.45Å; L158-V162 PolarHBondContact O-N 2.85Å |
| 159 | V | 92 | Very high | 88.9 | Confident | 69 Ų | 69 | 78.9 Ų | 78.9 | 42% | 0.418 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -63.4 | -45.4 | 177.8 | 171 | 0 | 0 | 0 | 0 | 110.6 | L155 D156 A161 V162 L163 | L155-V159 HydrophobicContact CD1-CG2 4.45Å; L155-V159 HydrophobicContact CG-CG2 4.43Å; L155-V159 VanDerWaalsContact O-CG2 3.27Å; L155-V159 WeakPolarHBondContact O-CG2 3.27Å; L155-V159 PolarHBondContact O-N 3.48Å; D156-V159 PolarHBondContact O-N 3.48Å; V159-A161 VanDerWaalsContact C-N 3.33Å; V159-A161 PolarHBondContact O-N 3.42Å; V159-V162 PolarHBondContact O-N 3.38Å; V159-L163 HydrophobicContact CG1-CD1 3.88Å; V159-L163 HydrophobicContact CG1-CG 4.31Å; V159-L163 WeakPolarHBondContact O-CB 3.4Å; V159-L163 WeakPolarHBondContact O-CG 3.09Å; V159-L163 PolarHBondContact O-N 3.09Å |
| 160 | C | 90.8 | Very high | 89.7 | Confident | 2 Ų | 2 | 72.7 Ų | 72.7 | 1% | 0.014 | 41% | 0.412 | C | S | . | . | H | α-helix | trans | -56 | -48 | 174.1 | -69.3 | 0 | 0 | 0 | 0 | 110.9 | D156 V162 L163 T164 | D156-C160 WeakPolarHBondContact O-CB 3.39Å; D156-C160 PolarHBondContact O-N 3.21Å; D156-C160 PolarHBondContact O-SG 2.9Å; C160-V162 PolarHBondContact O-N 3.14Å; C160-L163 PolarHBondContact O-N 3.12Å; C160-T164 WeakPolarHBondContact O-CB 3.46Å; C160-T164 PolarHBondContact O-N 3.14Å; C160-T164 PolarHBondContact O-OG1 3.47Å |
| 161 | A | 91.3 | Very high | 90 | Very high | 48 Ų | 48 | 72.9 Ų | 72.9 | 40% | 0.397 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -60.4 | -44.3 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | L157 L158 V159 T164 I165 | L157-A161 WeakPolarHBondContact O-CB 3.39Å; L157-A161 PolarHBondContact O-N 3.16Å; L158-A161 PolarHBondContact O-N 2.85Å; V159-A161 VanDerWaalsContact C-N 3.33Å; V159-A161 PolarHBondContact O-N 3.42Å; A161-T164 PolarHBondContact O-N 3.4Å; A161-I165 WeakPolarHBondContact O-CG1 3.46Å; A161-I165 PolarHBondContact O-N 3.07Å |
| 162 | V | 94 | Very high | 90.1 | Very high | 73 Ų | 73 | 67.5 Ų | 67.5 | 44% | 0.442 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -63 | -44.8 | 176.5 | 171.6 | 0 | 0 | 0 | 0 | 111.2 | L158 V159 C160 T164 I165 I166 | L158-V162 WeakPolarHBondContact O-CG2 3.45Å; L158-V162 PolarHBondContact O-N 2.85Å; V159-V162 PolarHBondContact O-N 3.38Å; C160-V162 PolarHBondContact O-N 3.14Å; V162-T164 PolarHBondContact O-N 3.42Å; V162-I165 PolarHBondContact O-N 2.86Å; V162-I166 HydrophobicContact CG1-CD1 3.91Å; V162-I166 WeakPolarHBondContact O-CG1 3.34Å; V162-I166 PolarHBondContact O-N 3.28Å |
| 163 | L | 92.5 | Very high | 90.2 | Very high | 66 Ų | 66 | 70.8 Ų | 70.8 | 35% | 0.346 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -64.8 | -38.3 | 177.3 | -70.6 | 175.1 | 0 | 0 | 0 | 112.1 | V159 C160 I166 S167 F175 | V159-L163 HydrophobicContact CG1-CD1 3.88Å; V159-L163 HydrophobicContact CG1-CG 4.31Å; V159-L163 WeakPolarHBondContact O-CB 3.4Å; V159-L163 WeakPolarHBondContact O-CG 3.09Å; V159-L163 PolarHBondContact O-N 3.09Å; C160-L163 PolarHBondContact O-N 3.12Å; L163-I166 PolarHBondContact O-N 3.06Å; L163-S167 WeakPolarHBondContact O-CB 3.21Å; L163-S167 PolarHBondContact O-N 2.87Å; L163-S167 PolarHBondContact O-OG 3.12Å; L163-F175 HydrophobicContact CB-CB 4.28Å; L163-F175 HydrophobicContact CB-CG 4.27Å; L163-F175 HydrophobicContact CD1-CD1 4.49Å; L163-F175 HydrophobicContact CD1-CD2 3.98Å; L163-F175 HydrophobicContact CD1-CE1 4.46Å; L163-F175 HydrophobicContact CD1-CE2 3.93Å; L163-F175 HydrophobicContact CD1-CG 4.26Å; L163-F175 HydrophobicContact CD1-CZ 4.18Å |
| 164 | T | 91.1 | Very high | 90.3 | Very high | 32 Ų | 32 | 70.1 Ų | 70.1 | 20% | 0.196 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -60.6 | -44.9 | 174.1 | -55.9 | 0 | 0 | 0 | 0 | 110.9 | I129 C160 A161 V162 S167 G168 L174 | I129-T164 HydrophobicContact CD1-CG2 3.82Å; C160-T164 WeakPolarHBondContact O-CB 3.46Å; C160-T164 PolarHBondContact O-N 3.14Å; C160-T164 PolarHBondContact O-OG1 3.47Å; A161-T164 PolarHBondContact O-N 3.4Å; V162-T164 PolarHBondContact O-N 3.42Å; T164-S167 WeakPolarHBondContact CA-OG 3.48Å; T164-S167 PolarHBondContact O-N 3.13Å; T164-S167 PolarHBondContact O-OG 3.22Å; T164-G168 PolarHBondContact O-N 3.09Å; T164-L174 HydrophobicContact CG2-CD2 4.36Å |
| 165 | I | 91.8 | Very high | 90.1 | Very high | 110 Ų | 110 | 67.4 Ų | 67.4 | 56% | 0.564 | 39% | 0.388 | S | S | * | . | H | α-helix | trans | -60.4 | -48.1 | 176.7 | -67.5 | 165.1 | 0 | 0 | 0 | 110.9 | A161 V162 S167 G168 I169 | A161-I165 WeakPolarHBondContact O-CG1 3.46Å; A161-I165 PolarHBondContact O-N 3.07Å; V162-I165 PolarHBondContact O-N 2.86Å; I165-S167 PolarHBondContact O-N 3.16Å; I165-G168 PolarHBondContact O-N 2.86Å; I165-I169 HydrophobicContact CG2-CD1 4.06Å; I165-I169 WeakPolarHBondContact O-CG1 3.47Å; I165-I169 PolarHBondContact O-N 3.11Å |
| 166 | I | 92.8 | Very high | 89.8 | Confident | 82 Ų | 82 | 67.6 Ų | 67.6 | 42% | 0.421 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -61.7 | -45.8 | 179 | -66 | 166.9 | 0 | 0 | 0 | 110.9 | V162 L163 G168 I169 L170 | V162-I166 HydrophobicContact CG1-CD1 3.91Å; V162-I166 WeakPolarHBondContact O-CG1 3.34Å; V162-I166 PolarHBondContact O-N 3.28Å; L163-I166 PolarHBondContact O-N 3.06Å; I166-G168 VanDerWaalsContact C-N 3.26Å; I166-G168 PolarHBondContact O-N 3.27Å; I166-I169 PolarHBondContact O-N 3.45Å; I166-L170 HydrophobicContact CG2-CD1 3.88Å; I166-L170 WeakPolarHBondContact O-CG 3.29Å; I166-L170 PolarHBondContact O-N 2.82Å |
| 167 | S | 90.5 | Very high | 89.5 | Confident | 12 Ų | 12 | 65.4 Ų | 65.4 | 8% | 0.084 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -62.8 | -33.8 | 177.6 | 68.5 | 0 | 0 | 0 | 0 | 112.4 | L163 T164 I165 A171 I172 | L163-S167 WeakPolarHBondContact O-CB 3.21Å; L163-S167 PolarHBondContact O-N 2.87Å; L163-S167 PolarHBondContact O-OG 3.12Å; T164-S167 WeakPolarHBondContact CA-OG 3.48Å; T164-S167 PolarHBondContact O-N 3.13Å; T164-S167 PolarHBondContact O-OG 3.22Å; I165-S167 PolarHBondContact O-N 3.16Å; S167-A171 VanDerWaalsContact O-CA 3.3Å; S167-A171 WeakPolarHBondContact O-CA 3.21Å; S167-A171 PolarHBondContact O-N 3.23Å; S167-I172 PolarHBondContact O-N 3.46Å; S167-I172 VanDerWaalsContact O-N 3.07Å |
| 168 | G | 89.7 | Confident | 89.5 | Confident | 45 Ų | 45 | 63.9 Ų | 63.9 | 46% | 0.464 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -66.2 | -45.7 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | T164 I165 I166 L170 A171 | T164-G168 PolarHBondContact O-N 3.09Å; I165-G168 PolarHBondContact O-N 2.86Å; I166-G168 VanDerWaalsContact C-N 3.26Å; I166-G168 PolarHBondContact O-N 3.27Å; G168-L170 VanDerWaalsContact C-N 3.34Å; G168-L170 PolarHBondContact O-N 2.99Å; G168-A171 PolarHBondContact O-N 3.2Å |
| 169 | I | 90.4 | Very high | 89.4 | Confident | 91 Ų | 91 | 60.9 Ų | 60.9 | 47% | 0.467 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -64.7 | -39 | 178 | -64.9 | 167.7 | 0 | 0 | 0 | 111.4 | V103 V104 I165 I166 A171 | V103-I169 HydrophobicContact CG1-CG2 4.1Å; V104-I169 PolarHBondContact N-O 3.33Å; I165-I169 HydrophobicContact CG2-CD1 4.06Å; I165-I169 WeakPolarHBondContact O-CG1 3.47Å; I165-I169 PolarHBondContact O-N 3.11Å; I166-I169 PolarHBondContact O-N 3.45Å; I169-A171 VanDerWaalsContact C-N 3.31Å |
| 170 | L | 89.7 | Confident | 89.3 | Confident | 49 Ų | 49 | 63.9 Ų | 63.9 | 26% | 0.257 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -83.3 | -8.1 | 179 | -62 | 173.1 | 0 | 0 | 0 | 113.4 | R100 W102 I166 G168 I172 | R100-L170 PolarHBondContact NH1-O 3.05Å; R100-L170 PolarHBondContact NH2-O 3.12Å; W102-L170 HydrophobicContact CB-CD2 4.45Å; W102-L170 CarbonylContact O-C 3.55Å; W102-L170 VanDerWaalsContact O-CA 3.3Å; W102-L170 WeakPolarHBondContact O-CA 3.37Å; I166-L170 HydrophobicContact CG2-CD1 3.88Å; I166-L170 WeakPolarHBondContact O-CG 3.29Å; I166-L170 PolarHBondContact O-N 2.82Å; G168-L170 VanDerWaalsContact C-N 3.34Å; G168-L170 PolarHBondContact O-N 2.99Å; L170-I172 HydrophobicContact CB-CB 4.5Å; L170-I172 HydrophobicContact CB-CD1 3.6Å; L170-I172 HydrophobicContact CB-CG1 3.71Å; L170-I172 HydrophobicContact CD1-CD1 3.74Å; L170-I172 HydrophobicContact CG-CD1 4.3Å; L170-I172 PolarHBondContact O-N 3.16Å; L170-I172 VanDerWaalsContact O-N 3.17Å |
| 171 | A | 86.7 | Confident | 89.3 | Confident | 47 Ų | 47 | 68.3 Ų | 68.3 | 39% | 0.388 | 40% | 0.4 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 43 | 43.2 | -168.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | R100 V104 S167 G168 I169 | R100-A171 PolarHBondContact NH2-O 3.48Å; V104-A171 HydrophobicContact CB-CB 4.41Å; V104-A171 HydrophobicContact CG2-CB 3.35Å; S167-A171 VanDerWaalsContact O-CA 3.3Å; S167-A171 WeakPolarHBondContact O-CA 3.21Å; S167-A171 PolarHBondContact O-N 3.23Å; G168-A171 PolarHBondContact O-N 3.2Å; I169-A171 VanDerWaalsContact C-N 3.31Å |
| 172 | I | 87.5 | Confident | 89.2 | Confident | 70 Ų | 70 | 67.6 Ų | 67.6 | 36% | 0.359 | 39% | 0.392 | S | S | . | . | trans | -86.8 | 153.8 | 169.6 | -63.3 | 172.1 | 0 | 0 | 0 | 106.7 | W102 S167 L170 L174 | W102-I172 HydrophobicContact CE3-CD1 4.27Å; W102-I172 HydrophobicContact CE3-CG1 4.49Å; W102-I172 HydrophobicContact CZ3-CD1 3.9Å; W102-I172 HydrophobicContact CZ3-CG1 4.14Å; S167-I172 PolarHBondContact O-N 3.46Å; S167-I172 VanDerWaalsContact O-N 3.07Å; L170-I172 HydrophobicContact CB-CB 4.5Å; L170-I172 HydrophobicContact CB-CD1 3.6Å; L170-I172 HydrophobicContact CB-CG1 3.71Å; L170-I172 HydrophobicContact CD1-CD1 3.74Å; L170-I172 HydrophobicContact CG-CD1 4.3Å; L170-I172 PolarHBondContact O-N 3.16Å; L170-I172 VanDerWaalsContact O-N 3.17Å; I172-L174 PolarHBondContact O-N 3.35Å | ||
| 173 | P | 87.3 | Confident | 89 | Confident | 117 Ų | 117 | 66.9 Ų | 66.9 | 76% | 0.76 | 39% | 0.385 | S | S | * | . | trans | -43 | 133.1 | 173.5 | -32.8 | 36.4 | 0 | 0 | 0 | 112.7 | F175 | P173-F175 PolarHBondContact O-N 3.47Š| ||
| 174 | L | 86.7 | Confident | 88.9 | Confident | 58 Ų | 58 | 67 Ų | 67 | 30% | 0.304 | 39% | 0.389 | S | S | . | . | trans | -58.2 | 139.2 | -178 | -65.6 | 174.2 | 0 | 0 | 0 | 110.2 | F125 T164 I172 L176 | F125-L174 HydrophobicContact CB-CD1 4.37Å; F125-L174 HydrophobicContact CD1-CD1 3.42Å; F125-L174 VanDerWaalsContact CD1-CD1 3.42Å; F125-L174 HydrophobicContact CD2-CD1 4.26Å; F125-L174 HydrophobicContact CE1-CD1 3.63Å; F125-L174 HydrophobicContact CE2-CD1 4.43Å; F125-L174 HydrophobicContact CG-CD1 3.78Å; F125-L174 HydrophobicContact CZ-CD1 4.14Å; T164-L174 HydrophobicContact CG2-CD2 4.36Å; I172-L174 PolarHBondContact O-N 3.35Å; L174-L176 PolarHBondContact O-N 2.98Å; L174-L176 VanDerWaalsContact O-N 3.17Å | ||
| 175 | F | 84.9 | Confident | 88.8 | Confident | 80 Ų | 80 | 70.3 Ų | 70.3 | 35% | 0.351 | 40% | 0.402 | S | S | . | . | trans | -62 | 117.6 | 173.3 | -178.5 | -94.1 | 0 | 0 | 0 | 110.1 | L163 P173 | L163-F175 HydrophobicContact CB-CB 4.28Å; L163-F175 HydrophobicContact CB-CG 4.27Å; L163-F175 HydrophobicContact CD1-CD1 4.49Å; L163-F175 HydrophobicContact CD1-CD2 3.98Å; L163-F175 HydrophobicContact CD1-CE1 4.46Å; L163-F175 HydrophobicContact CD1-CE2 3.93Å; L163-F175 HydrophobicContact CD1-CG 4.26Å; L163-F175 HydrophobicContact CD1-CZ 4.18Å; P173-F175 PolarHBondContact O-N 3.47Å | ||
| 176 | L | 85.9 | Confident | 88.5 | Confident | 113 Ų | 113 | 66.2 Ų | 66.2 | 59% | 0.592 | 38% | 0.381 | S | S | * | . | trans | -112.2 | 140 | 171.4 | -70.5 | 155.2 | 0 | 0 | 0 | 107.7 | L174 A178 | L174-L176 PolarHBondContact O-N 2.98Å; L174-L176 VanDerWaalsContact O-N 3.17Å; L176-A178 PolarHBondContact O-N 3.35Å | ||
| 177 | S | 83.5 | Confident | 88.3 | Confident | 16 Ų | 16 | 68 Ų | 68 | 11% | 0.112 | 39% | 0.387 | C | S | . | . | trans | -71.1 | 116.7 | -177.7 | -71.4 | 0 | 0 | 0 | 0 | 109.5 | D132 Q133 T179 | D132-S177 WeakPolarHBondContact OD2-CA 3.3Å; D132-S177 VanDerWaalsContact OD2-CB 3.3Å; D132-S177 WeakPolarHBondContact OD2-CB 3.47Å; D132-S177 PolarHBondContact OD2-N 3.1Å; D132-S177 VanDerWaalsContact OD2-O 3.13Å; Q133-S177 PolarHBondContact OE1-OG 3.42Å; S177-T179 PolarHBondContact O-N 3.12Å | ||
| 178 | A | 87.9 | Confident | 88.1 | Confident | 55 Ų | 55 | 73.2 Ų | 73.2 | 46% | 0.455 | 41% | 0.413 | S | S | . | . | trans | -73.9 | 86.2 | -179 | 0 | 0 | 0 | 0 | 0 | 111 | L176 I180 L181 S182 | L176-A178 PolarHBondContact O-N 3.35Å; A178-I180 PolarHBondContact O-N 2.96Å; A178-L181 HydrophobicContact CB-CB 3.71Å; A178-L181 HydrophobicContact CB-CD2 4.28Å; A178-L181 PolarHBondContact O-N 3.32Å; A178-S182 WeakPolarHBondContact O-CB 3.38Å; A178-S182 PolarHBondContact O-N 2.85Å; A178-S182 PolarHBondContact O-OG 2.91Å | ||
| 179 | T | 90.1 | Very high | 87.9 | Confident | 44 Ų | 44 | 72.2 Ų | 72.2 | 27% | 0.27 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -54.8 | -46.8 | -179.5 | 50.8 | 0 | 0 | 0 | 0 | 113.1 | T136 S177 S182 L183 | T136-T179 WeakPolarHBondContact OG1-CG2 3.12Å; S177-T179 PolarHBondContact O-N 3.12Å; T179-S182 WeakPolarHBondContact CA-OG 3.43Å; T179-S182 PolarHBondContact O-OG 3.17Å; T179-L183 VanDerWaalsContact O-CG 3.29Å; T179-L183 WeakPolarHBondContact O-CG 3.45Å; T179-L183 PolarHBondContact O-N 2.86Å; T179-L183 VanDerWaalsContact O-N 3.09Å |
| 180 | I | 90.4 | Very high | 87.7 | Confident | 131 Ų | 131 | 70.7 Ų | 70.7 | 67% | 0.672 | 39% | 0.386 | S | S | * | . | H | α-helix | trans | -69.1 | -42.1 | -178.3 | -59.8 | 168 | 0 | 0 | 0 | 110.6 | A178 L183 T184 | A178-I180 PolarHBondContact O-N 2.96Å; I180-L183 PolarHBondContact O-N 2.63Å; I180-T184 PolarHBondContact O-N 3.14Å; I180-T184 PolarHBondContact O-OG1 3.5Å |
| 181 | L | 89.9 | Confident | 87.4 | Confident | 95 Ų | 95 | 73 Ų | 73 | 50% | 0.497 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -67.5 | -43.6 | -179.7 | -176.1 | 59.6 | 0 | 0 | 0 | 111.4 | A178 L183 T184 H185 | A178-L181 HydrophobicContact CB-CB 3.71Å; A178-L181 HydrophobicContact CB-CD2 4.28Å; A178-L181 PolarHBondContact O-N 3.32Å; L181-L183 VanDerWaalsContact C-N 3.29Å; L181-L183 PolarHBondContact O-N 2.97Å; L181-T184 PolarHBondContact O-N 3.45Å; L181-H185 VanDerWaalsContact CD1-NE2 3.3Å; L181-H185 WeakPolarHBondContact CD1-NE2 3.49Å; L181-H185 WeakPolarHBondContact CG-NE2 3.27Å; L181-H185 PolarHBondContact O-CD2 3.47Å; L181-H185 PolarHBondContact O-N 3.3Å |
| 182 | S | 89.1 | Confident | 87.3 | Confident | 33 Ų | 33 | 74.8 Ų | 74.8 | 23% | 0.231 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -61.3 | -37.6 | 175.4 | 53 | 0 | 0 | 0 | 0 | 112 | M140 A178 T179 M186 | M140-S182 VanDerWaalsContact CE-OG 3.32Å; M140-S182 WeakPolarHBondContact CE-OG 3.48Å; A178-S182 WeakPolarHBondContact O-CB 3.38Å; A178-S182 PolarHBondContact O-N 2.85Å; A178-S182 PolarHBondContact O-OG 2.91Å; T179-S182 WeakPolarHBondContact CA-OG 3.43Å; T179-S182 PolarHBondContact O-OG 3.17Å; S182-M186 WeakPolarHBondContact O-CB 3.49Å; S182-M186 PolarHBondContact O-N 3.47Å |
| 183 | L | 90.3 | Very high | 87.1 | Confident | 58 Ų | 58 | 72.5 Ų | 72.5 | 30% | 0.304 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -66.5 | -43.2 | 174 | -75 | 171.3 | 0 | 0 | 0 | 111.7 | M139 M140 T179 I180 L181 M186 H187 | M139-L183 HydrophobicContact CE-CD1 4.49Å; M140-L183 HydrophobicContact CE-CB 4.23Å; M140-L183 HydrophobicContact CE-CD2 3.38Å; M140-L183 HydrophobicContact CE-CG 3.51Å; M140-L183 HydrophobicContact SD-CD2 4.46Å; T179-L183 VanDerWaalsContact O-CG 3.29Å; T179-L183 WeakPolarHBondContact O-CG 3.45Å; T179-L183 PolarHBondContact O-N 2.86Å; T179-L183 VanDerWaalsContact O-N 3.09Å; I180-L183 PolarHBondContact O-N 2.63Å; L181-L183 VanDerWaalsContact C-N 3.29Å; L181-L183 PolarHBondContact O-N 2.97Å; L183-M186 PolarHBondContact O-N 2.99Å; L183-H187 WeakPolarHBondContact O-CB 3.33Å; L183-H187 PolarHBondContact O-N 3.39Å |
| 184 | T | 89.7 | Confident | 86.8 | Confident | 69 Ų | 69 | 77.1 Ų | 77.1 | 42% | 0.423 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -61.9 | -47.1 | 176.3 | -59.7 | 0 | 0 | 0 | 0 | 111 | I180 L181 M186 H187 L188 | I180-T184 PolarHBondContact O-N 3.14Å; I180-T184 PolarHBondContact O-OG1 3.5Å; L181-T184 PolarHBondContact O-N 3.45Å; T184-M186 VanDerWaalsContact C-N 3.34Å; T184-M186 PolarHBondContact O-N 3.34Å; T184-H187 WeakPolarHBondContact O-CB 3.45Å; T184-H187 PolarHBondContact O-N 3.28Å; T184-L188 HydrophobicContact CG2-CD1 4.27Å; T184-L188 VanDerWaalsContact O-CG 3.28Å; T184-L188 WeakPolarHBondContact O-CG 3.37Å; T184-L188 PolarHBondContact O-N 2.89Å |
| 185 | H | 89.2 | Confident | 86.5 | Confident | 102 Ų | 102 | 82 Ų | 82 | 47% | 0.472 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -61.8 | -40.8 | 176.2 | -74.6 | -60.8 | 0 | 0 | 0 | 112.7 | L181 H187 L188 L189 | L181-H185 VanDerWaalsContact CD1-NE2 3.3Å; L181-H185 WeakPolarHBondContact CD1-NE2 3.49Å; L181-H185 WeakPolarHBondContact CG-NE2 3.27Å; L181-H185 PolarHBondContact O-CD2 3.47Å; L181-H185 PolarHBondContact O-N 3.3Å; H185-H187 VanDerWaalsContact C-N 3.33Å; H185-H187 PolarHBondContact O-N 3.21Å; H185-L188 PolarHBondContact O-N 3.23Å; H185-L189 WeakPolarHBondContact O-CG 2.91Å; H185-L189 PolarHBondContact O-N 3.13Å; H185-L189 VanDerWaalsContact O-N 3.14Å |
| 186 | M | 87.1 | Confident | 86.1 | Confident | 23 Ų | 23 | 80.6 Ų | 80.6 | 11% | 0.113 | 42% | 0.418 | C | S | . | . | H | α-helix | trans | -62.7 | -42.3 | 174.8 | -174.8 | -77.3 | -59.9 | 0 | 0 | 111.1 | M140 S182 L183 T184 L188 L189 R190 L207 | M140-M186 HydrophobicContact SD-CB 4.15Å; M140-M186 HydrophobicContact SD-CG 4.41Å; S182-M186 WeakPolarHBondContact O-CB 3.49Å; S182-M186 PolarHBondContact O-N 3.47Å; L183-M186 PolarHBondContact O-N 2.99Å; T184-M186 VanDerWaalsContact C-N 3.34Å; T184-M186 PolarHBondContact O-N 3.34Å; M186-L188 VanDerWaalsContact C-N 3.34Å; M186-L188 PolarHBondContact O-N 3.1Å; M186-L189 CarbonylContact O-C 3.48Å; M186-L189 PolarHBondContact O-N 2.91Å; M186-L189 VanDerWaalsContact O-N 3.16Å; M186-R190 PolarHBondContact O-N 2.99Å; M186-R190 VanDerWaalsContact O-N 3.12Å; M186-L207 HydrophobicContact CG-CD1 4.45Å; M186-L207 HydrophobicContact CG-CD2 4.1Å; M186-L207 HydrophobicContact SD-CD2 4.08Å |
| 187 | H | 87.2 | Confident | 86 | Confident | 121 Ų | 121 | 77.5 Ų | 77.5 | 56% | 0.56 | 41% | 0.409 | S | S | * | . | H | α-helix | trans | -63.1 | -38.2 | 176.5 | -174.3 | 65.8 | 0 | 0 | 0 | 112.4 | L183 T184 H185 L189 R190 | L183-H187 WeakPolarHBondContact O-CB 3.33Å; L183-H187 PolarHBondContact O-N 3.39Å; T184-H187 WeakPolarHBondContact O-CB 3.45Å; T184-H187 PolarHBondContact O-N 3.28Å; H185-H187 VanDerWaalsContact C-N 3.33Å; H185-H187 PolarHBondContact O-N 3.21Å; H187-L189 VanDerWaalsContact C-N 3.26Å; H187-L189 PolarHBondContact O-N 3.33Å; H187-R190 VanDerWaalsContact O-CB 3.31Å; H187-R190 WeakPolarHBondContact O-CB 3.44Å; H187-R190 PolarHBondContact O-N 3.34Å |
| 188 | L | 86.6 | Confident | 86 | Confident | 121 Ų | 121 | 83.3 Ų | 83.3 | 63% | 0.634 | 45% | 0.446 | S | S | * | . | H | α-helix | trans | -67.2 | -26.8 | 175.4 | -67.2 | 171.7 | 0 | 0 | 0 | 113 | T184 H185 M186 | T184-L188 HydrophobicContact CG2-CD1 4.27Å; T184-L188 VanDerWaalsContact O-CG 3.28Å; T184-L188 WeakPolarHBondContact O-CG 3.37Å; T184-L188 PolarHBondContact O-N 2.89Å; H185-L188 PolarHBondContact O-N 3.23Å; M186-L188 VanDerWaalsContact C-N 3.34Å; M186-L188 PolarHBondContact O-N 3.1Å |
| 189 | L | 86.1 | Confident | 85.9 | Confident | 24 Ų | 24 | 84.9 Ų | 84.9 | 13% | 0.126 | 47% | 0.467 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -91.4 | -1.8 | 177.1 | -64.6 | 174.7 | 0 | 0 | 0 | 113.1 | H185 M186 H187 M191 L207 I208 I210 L213 | H185-L189 WeakPolarHBondContact O-CG 2.91Å; H185-L189 PolarHBondContact O-N 3.13Å; H185-L189 VanDerWaalsContact O-N 3.14Å; M186-L189 CarbonylContact O-C 3.48Å; M186-L189 PolarHBondContact O-N 2.91Å; M186-L189 VanDerWaalsContact O-N 3.16Å; H187-L189 VanDerWaalsContact C-N 3.26Å; H187-L189 PolarHBondContact O-N 3.33Å; L189-M191 PolarHBondContact O-N 3.06Å; L189-L207 HydrophobicContact CB-CD2 4.12Å; L189-L207 CarbonylContact O-C 3.33Å; L189-L207 VanDerWaalsContact O-CA 3.27Å; L189-L207 WeakPolarHBondContact O-CA 3.28Å; L189-I208 HydrophobicContact CD2-CB 4.36Å; L189-I208 WeakPolarHBondContact O-CG1 3.48Å; L189-I208 PolarHBondContact O-N 2.89Å; L189-I210 HydrophobicContact CD1-CD1 4.2Å; L189-I210 HydrophobicContact CD1-CG1 3.77Å; L189-I210 HydrophobicContact CD2-CG1 4.49Å; L189-L213 HydrophobicContact CD2-CD2 3.48Å; L189-L213 VanDerWaalsContact CD2-CD2 3.48Å |
| 190 | R | 86.6 | Confident | 85.7 | Confident | 58 Ų | 58 | 88.8 Ų | 88.8 | 22% | 0.219 | 48% | 0.482 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -76.3 | 123.7 | -175.8 | 174.7 | 157.3 | 173.9 | 147 | 1.7 | 111.1 | N145 M186 H187 E192 F204 | N145-R190 PolarHBondContact OD1-NH1 3.23Å; M186-R190 PolarHBondContact O-N 2.99Å; M186-R190 VanDerWaalsContact O-N 3.12Å; H187-R190 VanDerWaalsContact O-CB 3.31Å; H187-R190 WeakPolarHBondContact O-CB 3.44Å; H187-R190 PolarHBondContact O-N 3.34Å; R190-E192 HydrophobicContact CG-CG 4.06Å; R190-E192 IonicContact NE-OE1 3.35Å; R190-E192 PolarHBondContact NE-OE1 3Å; R190-F204 HydrophobicContact CB-CE2 4.24Å; R190-F204 HydrophobicContact CG-CD2 3.55Å; R190-F204 HydrophobicContact CG-CE2 3.66Å |
| 191 | M | 82.9 | Confident | 85.2 | Confident | 97 Ų | 97 | 91.8 Ų | 91.8 | 48% | 0.478 | 49% | 0.485 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.1 | 123.4 | 169.2 | -69.7 | -167.9 | 162.8 | 0 | 0 | 110.7 | L189 L205 G206 I208 | L189-M191 PolarHBondContact O-N 3.06Å; M191-L205 HydrophobicContact CB-CB 4.42Å; M191-L205 PolarHBondContact O-N 3.46Å; M191-G206 PolarHBondContact N-O 3.22Å; M191-I208 HydrophobicContact CE-CB 4.36Å; M191-I208 HydrophobicContact CE-CD1 3.54Å; M191-I208 HydrophobicContact CE-CG1 3.41Å; M191-I208 VanDerWaalsContact CE-CG1 3.41Å; M191-I208 HydrophobicContact CE-CG2 4.39Å; M191-I208 HydrophobicContact CG-CD1 4.01Å; M191-I208 HydrophobicContact CG-CG1 3.52Å; M191-I208 HydrophobicContact SD-CG1 4.05Å |
| 192 | E | 83.7 | Confident | 84.8 | Confident | 86 Ų | 86 | 89.6 Ų | 89.6 | 40% | 0.402 | 48% | 0.477 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.9 | 146.1 | 177.7 | -65.2 | -162.5 | 156.2 | 0 | 0 | 111.2 | R190 K194 P202 | R190-E192 HydrophobicContact CG-CG 4.06Å; R190-E192 IonicContact NE-OE1 3.35Å; R190-E192 PolarHBondContact NE-OE1 3Å; E192-K194 PolarHBondContact O-N 3.34Å; E192-P202 HydrophobicContact CB-CB 3.93Å; E192-P202 HydrophobicContact CG-CB 4.29Å; E192-P202 WeakPolarHBondContact OE2-CG 3.23Å |
| 193 | S | 83.2 | Confident | 84.5 | Confident | 21 Ų | 21 | 91.4 Ų | 91.4 | 15% | 0.147 | 49% | 0.486 | C | S | . | . | trans | -66.4 | 129 | 177.4 | 58 | 0 | 0 | 0 | 0 | 111.8 | I195 T196 V203 | S193-I195 VanDerWaalsContact C-N 3.29Å; S193-I195 PolarHBondContact O-N 3.35Å; S193-T196 VanDerWaalsContact OG-CG2 3.23Å; S193-T196 WeakPolarHBondContact OG-CG2 3.43Å; S193-V203 PolarHBondContact N-O 3.46Å; S193-V203 VanDerWaalsContact N-O 3.11Å; S193-V203 PolarHBondContact OG-N 3.01Å; S193-V203 PolarHBondContact OG-O 3.37Å | ||
| 194 | K | 82.2 | Confident | 84.2 | Confident | 214 Ų | 214 | 89.2 Ų | 89.2 | 93% | 0.93 | 47% | 0.474 | S | S | * | . | S | Bend | trans | -70.2 | -22.2 | 176.4 | -65.6 | -175.7 | -179.7 | -179.4 | 0 | 114.1 | E192 | E192-K194 PolarHBondContact O-N 3.34Š|
| 195 | I | 80.5 | Confident | 83.8 | Confident | 160 Ų | 160 | 91.6 Ų | 91.6 | 82% | 0.821 | 48% | 0.484 | S | S | * | . | trans | -117.7 | 102.3 | -174.4 | -53.3 | 169.9 | 0 | 0 | 0 | 107.4 | S193 | S193-I195 VanDerWaalsContact C-N 3.29Å; S193-I195 PolarHBondContact O-N 3.35Å | ||
| 196 | T | 77 | Confident | 83.6 | Confident | 52 Ų | 52 | 87.7 Ų | 87.7 | 32% | 0.319 | 47% | 0.472 | S | S | . | . | trans | -128.9 | 154.5 | 166.4 | 54.3 | 0 | 0 | 0 | 0 | 109.7 | S193 E200 | S193-T196 VanDerWaalsContact OG-CG2 3.23Å; S193-T196 WeakPolarHBondContact OG-CG2 3.43Å; T196-E200 PolarHBondContact OG1-O 3.18Å | ||
| 197 | A | 83.5 | Confident | 83.5 | Confident | 48 Ų | 48 | 89.5 Ų | 89.5 | 40% | 0.397 | 48% | 0.481 | S | S | . | . | trans | -62 | 144.6 | 172.1 | 0 | 0 | 0 | 0 | 0 | 109.7 | G199 E200 | A197-G199 PolarHBondContact O-N 2.9Å; A197-G199 VanDerWaalsContact O-N 3.1Å; A197-E200 HydrophobicContact CB-CG 4.21Å; A197-E200 PolarHBondContact O-N 3.48Å | ||
| 198 | P | 83.7 | Confident | 83.4 | Confident | 137 Ų | 137 | 85.6 Ų | 85.6 | 89% | 0.89 | 46% | 0.464 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.2 | 118.6 | 176.3 | 23.5 | -32.2 | 0 | 0 | 0 | 109.9 | ||
| 199 | G | 84.8 | Confident | 83.4 | Confident | 88 Ų | 88 | 83.5 Ų | 83.5 | 91% | 0.907 | 46% | 0.458 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 103.7 | -14.4 | -176.7 | 0 | 0 | 0 | 0 | 0 | 115 | A197 | A197-G199 PolarHBondContact O-N 2.9Å; A197-G199 VanDerWaalsContact O-N 3.1Å |
| 200 | E | 85.1 | Confident | 83.5 | Confident | 126 Ų | 126 | 87.6 Ų | 87.6 | 59% | 0.589 | 48% | 0.479 | S | S | * | . | S | Bend | trans | -86.5 | 131 | 171.7 | -72.5 | -178.5 | 163.3 | 0 | 0 | 110.9 | T196 A197 | T196-E200 PolarHBondContact OG1-O 3.18Å; A197-E200 HydrophobicContact CB-CG 4.21Å; A197-E200 PolarHBondContact O-N 3.48Å |
| 201 | R | 81.3 | Confident | 83.6 | Confident | 194 Ų | 194 | 89.7 Ų | 89.7 | 73% | 0.732 | 50% | 0.5 | S | S | * | . | P | Polyproline II helix | trans | -59.4 | 139.9 | 172.5 | 59 | -178.1 | 173.5 | 170 | -1.5 | 110.1 | E144 V203 | E144-R201 IonicContact OE1-NH1 3.85Å; R201-V203 PolarHBondContact O-N 3Å |
| 202 | P | 81.8 | Confident | 84 | Confident | 49 Ų | 49 | 89 Ų | 89 | 32% | 0.318 | 50% | 0.501 | S | S | . | . | P | Polyproline II helix | trans | -53 | 132.7 | 178.6 | 18.5 | -29.6 | 0 | 0 | 0 | 111 | E192 | E192-P202 HydrophobicContact CB-CB 3.93Å; E192-P202 HydrophobicContact CG-CB 4.29Å; E192-P202 WeakPolarHBondContact OE2-CG 3.23Å |
| 203 | V | 82.6 | Confident | 84.2 | Confident | 71 Ų | 71 | 87.5 Ų | 87.5 | 43% | 0.43 | 50% | 0.495 | S | S | . | . | P | Polyproline II helix | trans | -78.7 | 129.2 | 179.3 | -178.1 | 0 | 0 | 0 | 0 | 108.4 | S193 R201 L205 | S193-V203 PolarHBondContact N-O 3.46Å; S193-V203 VanDerWaalsContact N-O 3.11Å; S193-V203 PolarHBondContact OG-N 3.01Å; S193-V203 PolarHBondContact OG-O 3.37Å; R201-V203 PolarHBondContact O-N 3Å; V203-L205 PolarHBondContact O-N 3.09Å |
| 204 | F | 82.3 | Confident | 84.5 | Confident | 12 Ų | 12 | 92.1 Ų | 92.1 | 5% | 0.053 | 52% | 0.518 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -62.5 | 116.8 | 170.4 | -179.7 | -98 | 0 | 0 | 0 | 110.2 | E144 N145 K146 R190 G206 L207 | E144-F204 WeakPolarHBondContact O-CB 3.34Å; E144-F204 WeakPolarHBondContact O-CG 3.35Å; N145-F204 VanDerWaalsContact C-CE1 3.43Å; N145-F204 WeakPolarHBondContact O-CE1 3.31Å; N145-F204 WeakPolarHBondContact O-CZ 3.18Å; K146-F204 HydrophobicContact CB-CD1 4.14Å; K146-F204 HydrophobicContact CB-CE1 4.19Å; K146-F204 HydrophobicContact CD-CD1 4.19Å; K146-F204 HydrophobicContact CG-CD1 4.17Å; K146-F204 PolarHBondContact NZ-O 3.33Å; K146-F204 VanDerWaalsContact NZ-O 3.09Å; R190-F204 HydrophobicContact CB-CE2 4.24Å; R190-F204 HydrophobicContact CG-CD2 3.55Å; R190-F204 HydrophobicContact CG-CE2 3.66Å; F204-G206 WeakPolarHBondContact CE2-O 3.46Å; F204-G206 WeakPolarHBondContact CZ-O 3.3Å; F204-L207 HydrophobicContact CE2-CD2 4.04Å; F204-L207 HydrophobicContact CZ-CD2 4.04Å; F204-L207 HydrophobicContact CZ-CG 4.02Å |
| 205 | L | 82.7 | Confident | 85 | Confident | 119 Ų | 119 | 83.6 Ų | 83.6 | 62% | 0.623 | 49% | 0.491 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -89.5 | -42.4 | 177.7 | -66.9 | 178.3 | 0 | 0 | 0 | 111.6 | M191 V203 | M191-L205 HydrophobicContact CB-CB 4.42Å; M191-L205 PolarHBondContact O-N 3.46Å; V203-L205 PolarHBondContact O-N 3.09Å |
| 206 | G | 84.2 | Confident | 85.4 | Confident | 21 Ų | 21 | 79.3 Ų | 79.3 | 22% | 0.216 | 47% | 0.472 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | 169.7 | -177.6 | -177.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | M191 F204 | M191-G206 PolarHBondContact N-O 3.22Å; F204-G206 WeakPolarHBondContact CE2-O 3.46Å; F204-G206 WeakPolarHBondContact CZ-O 3.3Å |
| 207 | L | 84.5 | Confident | 86 | Confident | 60 Ų | 60 | 82.4 Ų | 82.4 | 31% | 0.314 | 48% | 0.481 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.7 | 140.2 | 169.9 | -66.2 | 179.6 | 0 | 0 | 0 | 110.4 | L147 M186 L189 F204 P209 | L147-L207 HydrophobicContact CD2-CD1 3.56Å; L147-L207 HydrophobicContact CD2-CG 4.2Å; M186-L207 HydrophobicContact CG-CD1 4.45Å; M186-L207 HydrophobicContact CG-CD2 4.1Å; M186-L207 HydrophobicContact SD-CD2 4.08Å; L189-L207 HydrophobicContact CB-CD2 4.12Å; L189-L207 CarbonylContact O-C 3.33Å; L189-L207 VanDerWaalsContact O-CA 3.27Å; L189-L207 WeakPolarHBondContact O-CA 3.28Å; F204-L207 HydrophobicContact CE2-CD2 4.04Å; F204-L207 HydrophobicContact CZ-CD2 4.04Å; F204-L207 HydrophobicContact CZ-CG 4.02Å; L207-P209 WeakPolarHBondContact O-CD 3.37Å |
| 208 | I | 86.2 | Confident | 86.3 | Confident | 40 Ų | 40 | 86.2 Ų | 86.2 | 21% | 0.205 | 49% | 0.494 | C | S | . | . | P | Polyproline II helix | trans | -67.2 | 125.6 | 168.2 | -46.5 | -170 | 0 | 0 | 0 | 108 | L189 M191 I210 L213 | L189-I208 HydrophobicContact CD2-CB 4.36Å; L189-I208 WeakPolarHBondContact O-CG1 3.48Å; L189-I208 PolarHBondContact O-N 2.89Å; M191-I208 HydrophobicContact CE-CB 4.36Å; M191-I208 HydrophobicContact CE-CD1 3.54Å; M191-I208 HydrophobicContact CE-CG1 3.41Å; M191-I208 VanDerWaalsContact CE-CG1 3.41Å; M191-I208 HydrophobicContact CE-CG2 4.39Å; M191-I208 HydrophobicContact CG-CD1 4.01Å; M191-I208 HydrophobicContact CG-CG1 3.52Å; M191-I208 HydrophobicContact SD-CG1 4.05Å; I208-I210 PolarHBondContact O-N 3.29Å; I208-L213 HydrophobicContact CG2-CB 4.29Å |
| 209 | P | 86 | Confident | 86.5 | Confident | 77 Ų | 77 | 87.3 Ų | 87.3 | 50% | 0.5 | 48% | 0.482 | S | S | . | . | P | Polyproline II helix | trans | -62.7 | 128.7 | 173.2 | -18.1 | 30.1 | 0 | 0 | 0 | 110.1 | L207 P211 V212 L213 | L207-P209 WeakPolarHBondContact O-CD 3.37Å; P209-P211 VanDerWaalsContact C-N 3.26Å; P209-V212 HydrophobicContact CB-CG2 4.16Å; P209-V212 HydrophobicContact CG-CG2 4.25Å; P209-V212 WeakPolarHBondContact O-CB 3.39Å; P209-V212 PolarHBondContact O-N 3.41Å; P209-L213 PolarHBondContact O-N 3.27Å; P209-L213 VanDerWaalsContact O-N 3.14Å |
| 210 | I | 88 | Confident | 86.6 | Confident | 110 Ų | 110 | 87.3 Ų | 87.3 | 56% | 0.564 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -50.8 | -39.7 | 177.7 | -62.5 | 168.8 | 0 | 0 | 0 | 112.4 | L189 I208 V212 L213 L214 | L189-I210 HydrophobicContact CD1-CD1 4.2Å; L189-I210 HydrophobicContact CD1-CG1 3.77Å; L189-I210 HydrophobicContact CD2-CG1 4.49Å; I208-I210 PolarHBondContact O-N 3.29Å; I210-V212 VanDerWaalsContact C-N 3.3Å; I210-V212 PolarHBondContact O-N 2.98Å; I210-L213 PolarHBondContact O-N 3.39Å; I210-L214 VanDerWaalsContact O-CB 3.31Å; I210-L214 WeakPolarHBondContact O-CB 3.49Å; I210-L214 PolarHBondContact O-N 2.96Å |
| 211 | P | 90.2 | Very high | 86.5 | Confident | 101 Ų | 101 | 83.1 Ų | 83.1 | 66% | 0.656 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -61.2 | -35.1 | 176.7 | -25.4 | 35.5 | 0 | 0 | 0 | 113.9 | P209 G215 | P209-P211 VanDerWaalsContact C-N 3.26Å; P211-G215 PolarHBondContact O-N 2.63Å |
| 212 | V | 89.5 | Confident | 86.7 | Confident | 84 Ų | 84 | 76 Ų | 76 | 51% | 0.509 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -70.6 | -45.4 | 176.4 | 178.9 | 0 | 0 | 0 | 0 | 109.8 | P209 I210 L214 G215 V216 | P209-V212 HydrophobicContact CB-CG2 4.16Å; P209-V212 HydrophobicContact CG-CG2 4.25Å; P209-V212 WeakPolarHBondContact O-CB 3.39Å; P209-V212 PolarHBondContact O-N 3.41Å; I210-V212 VanDerWaalsContact C-N 3.3Å; I210-V212 PolarHBondContact O-N 2.98Å; V212-L214 PolarHBondContact O-N 3.3Å; V212-G215 PolarHBondContact O-N 2.88Å; V212-V216 WeakPolarHBondContact O-CG2 3.48Å; V212-V216 PolarHBondContact O-N 3.28Å |
| 213 | L | 88.4 | Confident | 86.5 | Confident | 54 Ų | 54 | 75.7 Ų | 75.7 | 28% | 0.283 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -61.1 | -45.7 | 177.4 | -177.4 | 62.6 | 0 | 0 | 0 | 111.5 | L189 I208 P209 I210 G215 V216 F217 | L189-L213 HydrophobicContact CD2-CD2 3.48Å; L189-L213 VanDerWaalsContact CD2-CD2 3.48Å; I208-L213 HydrophobicContact CG2-CB 4.29Å; P209-L213 PolarHBondContact O-N 3.27Å; P209-L213 VanDerWaalsContact O-N 3.14Å; I210-L213 PolarHBondContact O-N 3.39Å; L213-G215 VanDerWaalsContact C-N 3.34Å; L213-G215 PolarHBondContact O-N 3.18Å; L213-V216 PolarHBondContact O-N 3.05Å; L213-F217 HydrophobicContact CD1-CD2 3.9Å; L213-F217 HydrophobicContact CD1-CE2 3.41Å; L213-F217 VanDerWaalsContact CD1-CE2 3.41Å; L213-F217 HydrophobicContact CD1-CZ 4.08Å; L213-F217 HydrophobicContact CD2-CE2 3.91Å; L213-F217 HydrophobicContact CG-CD2 3.72Å; L213-F217 HydrophobicContact CG-CE2 3.44Å; L213-F217 VanDerWaalsContact CG-CE2 3.44Å; L213-F217 WeakPolarHBondContact O-CD2 2.97Å; L213-F217 PolarHBondContact O-N 3.49Å |
| 214 | L | 90.4 | Very high | 86.1 | Confident | 117 Ų | 117 | 76.2 Ų | 76.2 | 61% | 0.613 | 44% | 0.438 | S | S | * | . | H | α-helix | trans | -63.6 | -39.5 | 175.8 | -175.2 | 65.4 | 0 | 0 | 0 | 111.5 | I210 V212 V216 F217 L218 | I210-L214 VanDerWaalsContact O-CB 3.31Å; I210-L214 WeakPolarHBondContact O-CB 3.49Å; I210-L214 PolarHBondContact O-N 2.96Å; V212-L214 PolarHBondContact O-N 3.3Å; L214-V216 VanDerWaalsContact C-N 3.35Å; L214-F217 PolarHBondContact O-N 3.17Å; L214-L218 VanDerWaalsContact O-CB 3.27Å; L214-L218 WeakPolarHBondContact O-CB 3.33Å; L214-L218 PolarHBondContact O-N 2.85Å |
| 215 | G | 91.5 | Very high | 85.7 | Confident | 36 Ų | 36 | 80.8 Ų | 80.8 | 37% | 0.371 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -62.2 | -40.4 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | P211 V212 L213 L218 Y219 | P211-G215 PolarHBondContact O-N 2.63Å; V212-G215 PolarHBondContact O-N 2.88Å; L213-G215 VanDerWaalsContact C-N 3.34Å; L213-G215 PolarHBondContact O-N 3.18Å; G215-L218 PolarHBondContact O-N 2.88Å; G215-Y219 WeakPolarHBondContact O-CB 3.39Å; G215-Y219 PolarHBondContact O-N 2.88Å |
| 216 | V | 90 | Very high | 85.2 | Confident | 70 Ų | 70 | 80.1 Ų | 80.1 | 42% | 0.424 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -66.9 | -43.3 | 174.2 | 172.6 | 0 | 0 | 0 | 0 | 110.9 | V212 L213 L214 Y219 M220 | V212-V216 WeakPolarHBondContact O-CG2 3.48Å; V212-V216 PolarHBondContact O-N 3.28Å; L213-V216 PolarHBondContact O-N 3.05Å; L214-V216 VanDerWaalsContact C-N 3.35Å; V216-Y219 PolarHBondContact O-N 2.9Å; V216-M220 HydrophobicContact CG1-CE 3.94Å; V216-M220 HydrophobicContact CG1-SD 4.37Å; V216-M220 VanDerWaalsContact O-CG 3.32Å; V216-M220 WeakPolarHBondContact O-CG 3.41Å; V216-M220 PolarHBondContact O-N 2.88Å |
| 217 | F | 89.7 | Confident | 84.6 | Confident | 117 Ų | 117 | 80.6 Ų | 80.6 | 51% | 0.513 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -64 | -41.4 | 174.7 | -78.8 | -58.5 | 0 | 0 | 0 | 112.7 | L213 L214 Y219 M220 G221 | L213-F217 HydrophobicContact CD1-CD2 3.9Å; L213-F217 HydrophobicContact CD1-CE2 3.41Å; L213-F217 VanDerWaalsContact CD1-CE2 3.41Å; L213-F217 HydrophobicContact CD1-CZ 4.08Å; L213-F217 HydrophobicContact CD2-CE2 3.91Å; L213-F217 HydrophobicContact CG-CD2 3.72Å; L213-F217 HydrophobicContact CG-CE2 3.44Å; L213-F217 VanDerWaalsContact CG-CE2 3.44Å; L213-F217 WeakPolarHBondContact O-CD2 2.97Å; L213-F217 PolarHBondContact O-N 3.49Å; L214-F217 PolarHBondContact O-N 3.17Å; F217-Y219 VanDerWaalsContact C-N 3.35Å; F217-M220 HydrophobicContact CB-CE 4.5Å; F217-M220 HydrophobicContact CD1-CE 3.23Å; F217-M220 HydrophobicContact CE1-CE 3.56Å; F217-M220 HydrophobicContact CG-CE 4.04Å; F217-M220 PolarHBondContact O-N 3.25Å; F217-G221 PolarHBondContact O-N 3.37Å |
| 218 | L | 88.7 | Confident | 84.1 | Confident | 127 Ų | 127 | 81.5 Ų | 81.5 | 67% | 0.665 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -63.4 | -41.9 | 174.7 | -177.2 | 67.1 | 0 | 0 | 0 | 110.9 | L214 G215 G221 A222 | L214-L218 VanDerWaalsContact O-CB 3.27Å; L214-L218 WeakPolarHBondContact O-CB 3.33Å; L214-L218 PolarHBondContact O-N 2.85Å; G215-L218 PolarHBondContact O-N 2.88Å; L218-G221 PolarHBondContact O-N 2.83Å; L218-A222 VanDerWaalsContact O-CB 3.26Å; L218-A222 WeakPolarHBondContact O-CB 3.46Å; L218-A222 PolarHBondContact O-N 3.27Å |
| 219 | Y | 88.8 | Confident | 83.6 | Confident | 161 Ų | 161 | 83.5 Ų | 83.5 | 63% | 0.631 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -63.9 | -43.6 | 174.8 | 175.5 | -101.7 | 0 | 0 | 0 | 112 | G215 V216 F217 G221 A222 S223 | G215-Y219 WeakPolarHBondContact O-CB 3.39Å; G215-Y219 PolarHBondContact O-N 2.88Å; V216-Y219 PolarHBondContact O-N 2.9Å; F217-Y219 VanDerWaalsContact C-N 3.35Å; Y219-G221 VanDerWaalsContact C-N 3.31Å; Y219-G221 PolarHBondContact O-N 3.04Å; Y219-A222 PolarHBondContact O-N 3.43Å; Y219-S223 WeakPolarHBondContact O-CB 3.34Å; Y219-S223 PolarHBondContact O-N 3.28Å; Y219-S223 PolarHBondContact O-OG 3.42Å |
| 220 | M | 86.6 | Confident | 83.3 | Confident | 87 Ų | 87 | 81.4 Ų | 81.4 | 43% | 0.429 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -62.9 | -37 | 174.4 | -71.1 | -173.5 | -60.6 | 0 | 0 | 112 | V216 F217 S223 C224 | V216-M220 HydrophobicContact CG1-CE 3.94Å; V216-M220 HydrophobicContact CG1-SD 4.37Å; V216-M220 VanDerWaalsContact O-CG 3.32Å; V216-M220 WeakPolarHBondContact O-CG 3.41Å; V216-M220 PolarHBondContact O-N 2.88Å; F217-M220 HydrophobicContact CB-CE 4.5Å; F217-M220 HydrophobicContact CD1-CE 3.23Å; F217-M220 HydrophobicContact CE1-CE 3.56Å; F217-M220 HydrophobicContact CG-CE 4.04Å; F217-M220 PolarHBondContact O-N 3.25Å; M220-S223 WeakPolarHBondContact CA-OG 3.4Å; M220-S223 PolarHBondContact O-OG 3.05Å; M220-C224 PolarHBondContact O-N 3.37Å; M220-C224 PolarHBondContact O-SG 3.3Å |
| 221 | G | 84.1 | Confident | 82.9 | Confident | 38 Ų | 38 | 79.3 Ų | 79.3 | 39% | 0.392 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -69.3 | -44.7 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | F217 L218 Y219 C224 L225 | F217-G221 PolarHBondContact O-N 3.37Å; L218-G221 PolarHBondContact O-N 2.83Å; Y219-G221 VanDerWaalsContact C-N 3.31Å; Y219-G221 PolarHBondContact O-N 3.04Å; G221-C224 VanDerWaalsContact O-CB 3.3Å; G221-C224 WeakPolarHBondContact O-CB 3.34Å; G221-C224 PolarHBondContact O-N 3.22Å; G221-L225 PolarHBondContact O-N 3.49Å |
| 222 | A | 83.6 | Confident | 82.4 | Confident | 46 Ų | 46 | 79.3 Ų | 79.3 | 38% | 0.38 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -66.7 | -35.8 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | L218 Y219 C224 L225 I226 | L218-A222 VanDerWaalsContact O-CB 3.26Å; L218-A222 WeakPolarHBondContact O-CB 3.46Å; L218-A222 PolarHBondContact O-N 3.27Å; Y219-A222 PolarHBondContact O-N 3.43Å; A222-C224 VanDerWaalsContact C-N 3.3Å; A222-C224 PolarHBondContact O-N 2.9Å; A222-L225 WeakPolarHBondContact O-CA 3.43Å; A222-L225 VanDerWaalsContact O-CB 3.27Å; A222-L225 WeakPolarHBondContact O-CB 3.31Å; A222-L225 PolarHBondContact O-N 3.37Å; A222-I226 PolarHBondContact O-N 3.18Å |
| 223 | S | 79.2 | Confident | 82 | Confident | 41 Ų | 41 | 75.5 Ų | 75.5 | 29% | 0.287 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -67.9 | -31.2 | 174 | 68.9 | 0 | 0 | 0 | 0 | 111.9 | Y219 M220 L225 I226 | Y219-S223 WeakPolarHBondContact O-CB 3.34Å; Y219-S223 PolarHBondContact O-N 3.28Å; Y219-S223 PolarHBondContact O-OG 3.42Å; M220-S223 WeakPolarHBondContact CA-OG 3.4Å; M220-S223 PolarHBondContact O-OG 3.05Å; S223-L225 PolarHBondContact O-N 2.84Å; S223-I226 WeakPolarHBondContact O-CB 3.41Å; S223-I226 PolarHBondContact O-N 2.8Å; S223-I226 VanDerWaalsContact O-N 3.16Å |
| 224 | C | 73.7 | Confident | 81.7 | Confident | 83 Ų | 83 | 78.7 Ų | 78.7 | 56% | 0.561 | 42% | 0.424 | S | S | * | . | H | α-helix | trans | -60.9 | -33.1 | 167.6 | -70.3 | 0 | 0 | 0 | 0 | 112.1 | M220 G221 A222 I226 S227 | M220-C224 PolarHBondContact O-N 3.37Å; M220-C224 PolarHBondContact O-SG 3.3Å; G221-C224 VanDerWaalsContact O-CB 3.3Å; G221-C224 WeakPolarHBondContact O-CB 3.34Å; G221-C224 PolarHBondContact O-N 3.22Å; A222-C224 VanDerWaalsContact C-N 3.3Å; A222-C224 PolarHBondContact O-N 2.9Å; C224-I226 VanDerWaalsContact C-N 3.27Å; C224-I226 PolarHBondContact O-N 2.84Å; C224-S227 WeakPolarHBondContact O-CA 3.29Å; C224-S227 WeakPolarHBondContact O-CB 3.43Å; C224-S227 PolarHBondContact O-N 2.87Å; C224-S227 PolarHBondContact O-OG 3.39Å; C224-S227 VanDerWaalsContact O-OG 3.13Å |
| 225 | L | 74.5 | Confident | 81.3 | Confident | 108 Ų | 108 | 80.6 Ų | 80.6 | 57% | 0.565 | 43% | 0.428 | S | S | * | . | H | α-helix | trans | -66.7 | -24.6 | 175.9 | -56.9 | 176.5 | 0 | 0 | 0 | 113 | G221 A222 S223 S227 I228 | G221-L225 PolarHBondContact O-N 3.49Å; A222-L225 WeakPolarHBondContact O-CA 3.43Å; A222-L225 VanDerWaalsContact O-CB 3.27Å; A222-L225 WeakPolarHBondContact O-CB 3.31Å; A222-L225 PolarHBondContact O-N 3.37Å; S223-L225 PolarHBondContact O-N 2.84Å; L225-S227 PolarHBondContact O-N 3.07Å; L225-I228 HydrophobicContact CB-CD1 4.03Å; L225-I228 HydrophobicContact CD2-CD1 3.49Å; L225-I228 VanDerWaalsContact CD2-CD1 3.49Å; L225-I228 HydrophobicContact CG-CD1 4.35Å; L225-I228 WeakPolarHBondContact O-CA 3.34Å; L225-I228 WeakPolarHBondContact O-CB 3.37Å; L225-I228 WeakPolarHBondContact O-CG1 3.4Å; L225-I228 PolarHBondContact O-N 3.35Å |
| 226 | I | 71.3 | Confident | 80.8 | Confident | 104 Ų | 104 | 80.8 Ų | 80.8 | 53% | 0.533 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -59.4 | -27.8 | 170.4 | -57.8 | 170.1 | 0 | 0 | 0 | 109.9 | A222 S223 C224 I228 E229 | A222-I226 PolarHBondContact O-N 3.18Å; S223-I226 WeakPolarHBondContact O-CB 3.41Å; S223-I226 PolarHBondContact O-N 2.8Å; S223-I226 VanDerWaalsContact O-N 3.16Å; C224-I226 VanDerWaalsContact C-N 3.27Å; C224-I226 PolarHBondContact O-N 2.84Å; I226-I228 PolarHBondContact O-N 3.2Å; I226-E229 VanDerWaalsContact O-CB 3.3Å; I226-E229 WeakPolarHBondContact O-CB 3.32Å; I226-E229 PolarHBondContact O-N 3.09Å; I226-E229 VanDerWaalsContact O-N 3.09Å |
| 227 | S | 71.8 | Confident | 80.3 | Confident | 31 Ų | 31 | 81.5 Ų | 81.5 | 22% | 0.217 | 43% | 0.428 | C | S | . | . | H | α-helix | trans | -65.6 | -18.8 | 172.8 | -50 | 0 | 0 | 0 | 0 | 113.5 | C224 L225 E229 R230 I231 | C224-S227 WeakPolarHBondContact O-CA 3.29Å; C224-S227 WeakPolarHBondContact O-CB 3.43Å; C224-S227 PolarHBondContact O-N 2.87Å; C224-S227 PolarHBondContact O-OG 3.39Å; C224-S227 VanDerWaalsContact O-OG 3.13Å; L225-S227 PolarHBondContact O-N 3.07Å; S227-E229 VanDerWaalsContact C-N 3.25Å; S227-E229 PolarHBondContact O-N 2.99Å; S227-R230 VanDerWaalsContact O-CB 3.29Å; S227-R230 WeakPolarHBondContact O-CB 3.49Å; S227-R230 PolarHBondContact O-N 3.17Å; S227-R230 VanDerWaalsContact O-N 3.07Å; S227-R230 PolarHBondContact OG-NH2 3.31Å; S227-I231 PolarHBondContact O-N 2.88Å |
| 228 | I | 74.3 | Confident | 79.7 | Confident | 80 Ų | 80 | 81.2 Ų | 81.2 | 41% | 0.41 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -66.6 | -31.3 | 173.4 | -58.6 | 171.9 | 0 | 0 | 0 | 110.2 | L225 I226 R230 I231 L232 | L225-I228 HydrophobicContact CB-CD1 4.03Å; L225-I228 HydrophobicContact CD2-CD1 3.49Å; L225-I228 VanDerWaalsContact CD2-CD1 3.49Å; L225-I228 HydrophobicContact CG-CD1 4.35Å; L225-I228 WeakPolarHBondContact O-CA 3.34Å; L225-I228 WeakPolarHBondContact O-CB 3.37Å; L225-I228 WeakPolarHBondContact O-CG1 3.4Å; L225-I228 PolarHBondContact O-N 3.35Å; I226-I228 PolarHBondContact O-N 3.2Å; I228-R230 PolarHBondContact O-N 2.96Å; I228-I231 CarbonylContact O-C 3.56Å; I228-I231 WeakPolarHBondContact O-CA 3.48Å; I228-I231 VanDerWaalsContact O-CB 3.32Å; I228-I231 WeakPolarHBondContact O-CB 3.47Å; I228-I231 PolarHBondContact O-N 3.4Å; I228-L232 PolarHBondContact O-N 3.36Å |
| 229 | E | 76.1 | Confident | 79.3 | Confident | 81 Ų | 81 | 84.6 Ų | 84.6 | 38% | 0.379 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -58.7 | -32.6 | 172.2 | -58.1 | -175.1 | 155.5 | 0 | 0 | 111.2 | I226 S227 I231 L232 L233 F244 | I226-E229 VanDerWaalsContact O-CB 3.3Å; I226-E229 WeakPolarHBondContact O-CB 3.32Å; I226-E229 PolarHBondContact O-N 3.09Å; I226-E229 VanDerWaalsContact O-N 3.09Å; S227-E229 VanDerWaalsContact C-N 3.25Å; S227-E229 PolarHBondContact O-N 2.99Å; E229-I231 VanDerWaalsContact C-N 3.34Å; E229-L232 WeakPolarHBondContact O-CB 3.47Å; E229-L232 PolarHBondContact O-N 3Å; E229-L233 WeakPolarHBondContact O-CG 3.37Å; E229-L233 PolarHBondContact O-N 3.2Å; E229-F244 HydrophobicContact CB-CE2 4.5Å; E229-F244 HydrophobicContact CB-CZ 4.2Å; E229-F244 WeakPolarHBondContact OE2-CE1 3.3Å; E229-F244 WeakPolarHBondContact OE2-CZ 3.08Å |
| 230 | R | 78.5 | Confident | 78.7 | Confident | 34 Ų | 34 | 85.7 Ų | 85.7 | 13% | 0.128 | 45% | 0.449 | C | S | . | . | H | α-helix | trans | -71.2 | -29.3 | 174.3 | -55.1 | -170.1 | -87.6 | -138.5 | -7.3 | 113.2 | S227 I228 L233 T259 L308 | S227-R230 VanDerWaalsContact O-CB 3.29Å; S227-R230 WeakPolarHBondContact O-CB 3.49Å; S227-R230 PolarHBondContact O-N 3.17Å; S227-R230 VanDerWaalsContact O-N 3.07Å; S227-R230 PolarHBondContact OG-NH2 3.31Å; I228-R230 PolarHBondContact O-N 2.96Å; R230-L233 WeakPolarHBondContact O-CB 3.35Å; R230-L233 PolarHBondContact O-N 2.7Å; R230-T259 HydrophobicContact CB-CG2 3.48Å; R230-T259 VanDerWaalsContact CB-CG2 3.48Å; R230-T259 HydrophobicContact CG-CG2 4.26Å; R230-L308 PolarHBondContact NH1-O 3.07Å |
| 231 | I | 80.7 | Confident | 78.3 | Confident | 66 Ų | 66 | 83.3 Ų | 83.3 | 34% | 0.338 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -69.7 | -41.2 | 170.1 | -55.3 | 177.1 | 0 | 0 | 0 | 109.5 | S227 I228 E229 L233 F234 F235 I263 | S227-I231 PolarHBondContact O-N 2.88Å; I228-I231 CarbonylContact O-C 3.56Å; I228-I231 WeakPolarHBondContact O-CA 3.48Å; I228-I231 VanDerWaalsContact O-CB 3.32Å; I228-I231 WeakPolarHBondContact O-CB 3.47Å; I228-I231 PolarHBondContact O-N 3.4Å; E229-I231 VanDerWaalsContact C-N 3.34Å; I231-L233 VanDerWaalsContact C-N 3.3Å; I231-L233 PolarHBondContact O-N 2.93Å; I231-F234 WeakPolarHBondContact O-CB 3.45Å; I231-F234 PolarHBondContact O-N 3.01Å; I231-F235 HydrophobicContact CG2-CE2 4.44Å; I231-I263 HydrophobicContact CD1-CD1 4.42Å; I231-I263 HydrophobicContact CD1-CG1 4.3Å; I231-I263 HydrophobicContact CG1-CD1 4.06Å; I231-I263 HydrophobicContact CG1-CG1 4.33Å |
| 232 | L | 79.4 | Confident | 77.8 | Confident | 100 Ų | 100 | 84.4 Ų | 84.4 | 52% | 0.524 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -61.7 | -38 | 174.4 | -66.8 | 171.4 | 0 | 0 | 0 | 111.6 | I228 E229 F234 F235 T236 | I228-L232 PolarHBondContact O-N 3.36Å; E229-L232 WeakPolarHBondContact O-CB 3.47Å; E229-L232 PolarHBondContact O-N 3Å; L232-F234 PolarHBondContact O-N 3.41Å; L232-F234 VanDerWaalsContact O-N 3.12Å; L232-F235 CarbonylContact O-C 3.53Å; L232-F235 WeakPolarHBondContact O-CA 3.39Å; L232-F235 PolarHBondContact O-N 2.86Å; L232-T236 PolarHBondContact O-N 3.15Å; L232-T236 PolarHBondContact O-OG1 2.75Å |
| 233 | L | 80.4 | Confident | 77.2 | Confident | 4 Ų | 4 | 90.3 Ų | 90.3 | 2% | 0.021 | 46% | 0.463 | C | S | . | . | H | α-helix | trans | -58.1 | -23.4 | 173.2 | -75.9 | 172.4 | 0 | 0 | 0 | 113.8 | E229 R230 I231 Q241 P242 F244 Y246 L247 | E229-L233 WeakPolarHBondContact O-CG 3.37Å; E229-L233 PolarHBondContact O-N 3.2Å; R230-L233 WeakPolarHBondContact O-CB 3.35Å; R230-L233 PolarHBondContact O-N 2.7Å; I231-L233 VanDerWaalsContact C-N 3.3Å; I231-L233 PolarHBondContact O-N 2.93Å; L233-Q241 HydrophobicContact CD2-CB 4.33Å; L233-Q241 HydrophobicContact CD2-CG 4.05Å; L233-P242 HydrophobicContact CD2-CG 4.38Å; L233-F244 HydrophobicContact CD1-CD2 4.2Å; L233-F244 HydrophobicContact CD1-CE2 4.31Å; L233-Y246 HydrophobicContact CD1-CE2 3.99Å; L233-Y246 WeakPolarHBondContact CD1-OH 3.43Å; L233-L247 HydrophobicContact CD1-CD2 4.11Å; L233-L247 HydrophobicContact CD2-CD1 4.09Å; L233-L247 HydrophobicContact CD2-CD2 4.43Å |
| 234 | F | 81.5 | Confident | 77.1 | Confident | 121 Ų | 121 | 90.9 Ų | 90.9 | 53% | 0.531 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -70.9 | -35.9 | 172 | -173 | -95.1 | 0 | 0 | 0 | 111.9 | I231 L232 | I231-F234 WeakPolarHBondContact O-CB 3.45Å; I231-F234 PolarHBondContact O-N 3.01Å; L232-F234 PolarHBondContact O-N 3.41Å; L232-F234 VanDerWaalsContact O-N 3.12Å |
| 235 | F | 82.6 | Confident | 77.2 | Confident | 157 Ų | 157 | 87.6 Ų | 87.6 | 69% | 0.689 | 44% | 0.438 | S | S | * | . | H | α-helix | trans | -87.5 | -21.7 | 178.8 | -70 | -72.4 | 0 | 0 | 0 | 113.7 | I231 L232 P237 | I231-F235 HydrophobicContact CG2-CE2 4.44Å; L232-F235 CarbonylContact O-C 3.53Å; L232-F235 WeakPolarHBondContact O-CA 3.39Å; L232-F235 PolarHBondContact O-N 2.86Å; F235-P237 WeakPolarHBondContact O-CD 3.4Å |
| 236 | T | 80.7 | Confident | 77.3 | Confident | 41 Ų | 41 | 83.9 Ų | 83.9 | 25% | 0.252 | 42% | 0.417 | S | S | . | . | S | Bend | trans | -80.7 | 119.2 | 179.8 | -48 | 0 | 0 | 0 | 0 | 110.8 | L232 Y240 Q241 | L232-T236 PolarHBondContact O-N 3.15Å; L232-T236 PolarHBondContact O-OG1 2.75Å; T236-Y240 WeakPolarHBondContact CG2-O 3.39Å; T236-Q241 HydrophobicContact CG2-CG 4.37Å |
| 237 | P | 80.2 | Confident | 77.7 | Confident | 84 Ų | 84 | 80.4 Ų | 80.4 | 55% | 0.545 | 40% | 0.399 | S | S | . | . | trans | -64.3 | 148 | 174.4 | 22.6 | -26.8 | 0 | 0 | 0 | 110.5 | F235 K239 Y240 | F235-P237 WeakPolarHBondContact O-CD 3.4Å; P237-K239 PolarHBondContact O-N 3.23Å; P237-Y240 HydrophobicContact CG-CD2 3.99Å; P237-Y240 PolarHBondContact O-N 3.16Å | ||
| 238 | V | 77.5 | Confident | 78 | Confident | 111 Ų | 111 | 87.7 Ų | 87.7 | 67% | 0.673 | 42% | 0.421 | S | S | * | . | G | 310 helix | trans | -47.9 | -29 | -169.9 | -177.9 | 0 | 0 | 0 | 0 | 114.4 | ||
| 239 | K | 80.3 | Confident | 78.4 | Confident | 198 Ų | 198 | 88 Ų | 88 | 86% | 0.861 | 42% | 0.423 | S | S | * | . | G | 310 helix | trans | -73.8 | -24.6 | -178.5 | -62.8 | -174.9 | -178.9 | -178.6 | 0 | 115 | P237 | P237-K239 PolarHBondContact O-N 3.23Š|
| 240 | Y | 76 | Confident | 78.7 | Confident | 185 Ų | 185 | 84.8 Ų | 84.8 | 73% | 0.725 | 41% | 0.409 | S | S | * | . | G | 310 helix | trans | -109 | 16.9 | -176.6 | -62.2 | -87.4 | 0 | 0 | 0 | 112.4 | T236 P237 | T236-Y240 WeakPolarHBondContact CG2-O 3.39Å; P237-Y240 HydrophobicContact CG-CD2 3.99Å; P237-Y240 PolarHBondContact O-N 3.16Å |
| 241 | Q | 76.9 | Confident | 79 | Confident | 37 Ų | 37 | 86.8 Ų | 86.8 | 17% | 0.173 | 43% | 0.426 | C | S | . | . | trans | -69.2 | 133.1 | -178 | -72.2 | -179.2 | -18.9 | 0 | 0 | 110.5 | L233 T236 L247 | L233-Q241 HydrophobicContact CD2-CB 4.33Å; L233-Q241 HydrophobicContact CD2-CG 4.05Å; T236-Q241 HydrophobicContact CG2-CG 4.37Å; Q241-L247 HydrophobicContact CB-CD1 4.45Å | ||
| 242 | P | 75.2 | Confident | 79.1 | Confident | 60 Ų | 60 | 85.8 Ų | 85.8 | 39% | 0.39 | 42% | 0.421 | S | S | . | . | trans | -65.1 | 150.2 | 173.5 | 27.7 | -35.9 | 0 | 0 | 0 | 111.4 | L233 F244 L247 | L233-P242 HydrophobicContact CD2-CG 4.38Å; P242-F244 VanDerWaalsContact C-N 3.33Å; P242-F244 HydrophobicContact CB-CD2 4.44Å; P242-F244 HydrophobicContact CB-CE2 4.12Å; P242-F244 HydrophobicContact CB-CZ 4.33Å; P242-F244 HydrophobicContact CG-CD2 3.79Å; P242-F244 HydrophobicContact CG-CE2 3.3Å; P242-F244 HydrophobicContact CG-CZ 3.86Å; P242-F244 PolarHBondContact O-N 3.07Å; P242-L247 WeakPolarHBondContact O-CD1 3.22Å | ||
| 243 | D | 70.1 | Confident | 79.4 | Confident | 171 Ų | 171 | 89.9 Ų | 89.9 | 91% | 0.914 | 43% | 0.434 | S | S | * | . | trans | -75 | 75 | -178 | -70.7 | -33.8 | 0 | 0 | 0 | 112.6 | ||||
| 244 | F | 76.5 | Confident | 79.7 | Confident | 52 Ų | 52 | 94.6 Ų | 94.6 | 23% | 0.228 | 45% | 0.452 | C | S | . | . | trans | -85.1 | 142.5 | 171.4 | -63.9 | -59.5 | 0 | 0 | 0 | 112.7 | E229 L233 P242 Y246 L247 | E229-F244 HydrophobicContact CB-CE2 4.5Å; E229-F244 HydrophobicContact CB-CZ 4.2Å; E229-F244 WeakPolarHBondContact OE2-CE1 3.3Å; E229-F244 WeakPolarHBondContact OE2-CZ 3.08Å; L233-F244 HydrophobicContact CD1-CD2 4.2Å; L233-F244 HydrophobicContact CD1-CE2 4.31Å; P242-F244 VanDerWaalsContact C-N 3.33Å; P242-F244 HydrophobicContact CB-CD2 4.44Å; P242-F244 HydrophobicContact CB-CE2 4.12Å; P242-F244 HydrophobicContact CB-CZ 4.33Å; P242-F244 HydrophobicContact CG-CD2 3.79Å; P242-F244 HydrophobicContact CG-CE2 3.3Å; P242-F244 HydrophobicContact CG-CZ 3.86Å; P242-F244 PolarHBondContact O-N 3.07Å; F244-Y246 VanDerWaalsContact C-N 3.26Å; F244-Y246 HydrophobicContact CB-CD1 3.86Å; F244-Y246 HydrophobicContact CB-CE1 3.42Å; F244-Y246 VanDerWaalsContact CB-CE1 3.42Å; F244-Y246 HydrophobicContact CB-CE2 4.2Å; F244-Y246 HydrophobicContact CB-CG 4.42Å; F244-Y246 HydrophobicContact CD1-CE1 4.21Å; F244-Y246 HydrophobicContact CD2-CE1 4.15Å; F244-Y246 HydrophobicContact CD2-CE2 4.47Å; F244-Y246 AromaticContact CD2-CZ 3.68Å; F244-Y246 WeakPolarHBondContact CD2-OH 3.3Å; F244-Y246 AromaticContact CG-CE1 3.71Å; F244-Y246 HydrophobicContact CG-CE1 3.71Å; F244-Y246 AromaticContact CG-CZ 3.73Å; F244-Y246 PolarHBondContact O-N 3.29Å; F244-L247 HydrophobicContact CB-CD1 3.94Å; F244-L247 HydrophobicContact CB-CG 4.12Å; F244-L247 HydrophobicContact CD2-CD1 3.87Å; F244-L247 HydrophobicContact CG-CD1 4.38Å; F244-L247 PolarHBondContact O-N 2.81Å | ||
| 245 | S | 76.7 | Confident | 79.9 | Confident | 14 Ų | 14 | 88.9 Ų | 88.9 | 10% | 0.098 | 43% | 0.427 | C | S | . | . | G | 310 helix | trans | -56.6 | -36 | -179.3 | -59.5 | 0 | 0 | 0 | 0 | 113.4 | P313 W315 | S245-P313 PolarHBondContact OG-O 3.38Å; S245-P313 VanDerWaalsContact OG-O 3.06Å; S245-W315 PolarHBondContact OG-N 2.99Å |
| 246 | Y | 76.1 | Confident | 80.2 | Confident | 31 Ų | 31 | 83.5 Ų | 83.5 | 12% | 0.122 | 40% | 0.404 | C | S | . | . | G | 310 helix | trans | -78.1 | -26.2 | -177.1 | 59 | -97.2 | 0 | 0 | 0 | 113.9 | L233 F244 R248 L249 L250 I255 | L233-Y246 HydrophobicContact CD1-CE2 3.99Å; L233-Y246 WeakPolarHBondContact CD1-OH 3.43Å; F244-Y246 VanDerWaalsContact C-N 3.26Å; F244-Y246 HydrophobicContact CB-CD1 3.86Å; F244-Y246 HydrophobicContact CB-CE1 3.42Å; F244-Y246 VanDerWaalsContact CB-CE1 3.42Å; F244-Y246 HydrophobicContact CB-CE2 4.2Å; F244-Y246 HydrophobicContact CB-CG 4.42Å; F244-Y246 HydrophobicContact CD1-CE1 4.21Å; F244-Y246 HydrophobicContact CD2-CE1 4.15Å; F244-Y246 HydrophobicContact CD2-CE2 4.47Å; F244-Y246 AromaticContact CD2-CZ 3.68Å; F244-Y246 WeakPolarHBondContact CD2-OH 3.3Å; F244-Y246 AromaticContact CG-CE1 3.71Å; F244-Y246 HydrophobicContact CG-CE1 3.71Å; F244-Y246 AromaticContact CG-CZ 3.73Å; F244-Y246 PolarHBondContact O-N 3.29Å; Y246-R248 PolarHBondContact O-N 3.02Å; Y246-L249 PolarHBondContact O-N 2.98Å; Y246-L249 VanDerWaalsContact O-N 3.13Å; Y246-L250 PolarHBondContact O-N 2.95Å; Y246-L250 VanDerWaalsContact O-N 3.17Å; Y246-I255 HydrophobicContact CD2-CD1 4.1Å |
| 247 | L | 79.4 | Confident | 80.6 | Confident | 30 Ų | 30 | 85.8 Ų | 85.8 | 16% | 0.157 | 41% | 0.414 | C | S | . | . | G | 310 helix | trans | -63.7 | -25 | 177.5 | -72.6 | 171 | 0 | 0 | 0 | 112.4 | L233 Q241 P242 F244 M252 I255 | L233-L247 HydrophobicContact CD1-CD2 4.11Å; L233-L247 HydrophobicContact CD2-CD1 4.09Å; L233-L247 HydrophobicContact CD2-CD2 4.43Å; Q241-L247 HydrophobicContact CB-CD1 4.45Å; P242-L247 WeakPolarHBondContact O-CD1 3.22Å; F244-L247 HydrophobicContact CB-CD1 3.94Å; F244-L247 HydrophobicContact CB-CG 4.12Å; F244-L247 HydrophobicContact CD2-CD1 3.87Å; F244-L247 HydrophobicContact CG-CD1 4.38Å; F244-L247 PolarHBondContact O-N 2.81Å; L247-M252 HydrophobicContact CD2-CE 3.88Å; L247-M252 HydrophobicContact CD2-SD 3.49Å; L247-M252 WeakPolarHBondContact CD2-SD 3.28Å; L247-I255 HydrophobicContact CD2-CD1 3.84Å |
| 248 | R | 80 | Confident | 81 | Confident | 184 Ų | 184 | 81.9 Ų | 81.9 | 69% | 0.694 | 39% | 0.388 | S | S | * | . | G | 310 helix | trans | -83.4 | -24.1 | 177.1 | -166.6 | 172.8 | -175.3 | 168 | 5.8 | 113.3 | Y246 | Y246-R248 PolarHBondContact O-N 3.02Š|
| 249 | L | 81.1 | Confident | 81.4 | Confident | 86 Ų | 86 | 76.8 Ų | 76.8 | 45% | 0.45 | 36% | 0.357 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -92.7 | -28.4 | -174 | -65 | 173.2 | 0 | 0 | 0 | 112.6 | Y246 I307 L312 | Y246-L249 PolarHBondContact O-N 2.98Å; Y246-L249 VanDerWaalsContact O-N 3.13Å; L249-I307 HydrophobicContact CB-CD1 4.4Å; L249-I307 HydrophobicContact CB-CG2 4.36Å; L249-I307 HydrophobicContact CD1-CD1 4.2Å; L249-I307 HydrophobicContact CD1-CG1 4.42Å; L249-I307 HydrophobicContact CD1-CG2 3.95Å; L249-L312 HydrophobicContact CD1-CD2 3.94Å |
| 250 | L | 83.2 | Confident | 81.9 | Confident | 15 Ų | 15 | 71.6 Ų | 71.6 | 8% | 0.079 | 34% | 0.339 | C | S | . | . | S | Bend | trans | -124.4 | 143.3 | -174.1 | -61.4 | 177.5 | 0 | 0 | 0 | 111.9 | Y246 I255 E304 I307 | Y246-L250 PolarHBondContact O-N 2.95Å; Y246-L250 VanDerWaalsContact O-N 3.17Å; L250-I255 HydrophobicContact CB-CD1 4.13Å; L250-I255 HydrophobicContact CB-CG1 4Å; L250-E304 HydrophobicContact CD1-CB 4.48Å; L250-E304 HydrophobicContact CD2-CB 3.95Å; L250-E304 HydrophobicContact CD2-CG 3.62Å; L250-I307 HydrophobicContact CD1-CB 4.45Å; L250-I307 HydrophobicContact CD1-CG2 4.07Å; L250-I307 HydrophobicContact CG-CG2 4.38Å |
| 251 | P | 85.5 | Confident | 82.5 | Confident | 75 Ų | 75 | 64.5 Ų | 64.5 | 49% | 0.487 | 31% | 0.314 | S | S | . | . | trans | -69.2 | 141.2 | 173.8 | 29 | -34.2 | 0 | 0 | 0 | 111.3 | K253 R254 I255 | P251-K253 VanDerWaalsContact C-N 3.26Å; P251-K253 PolarHBondContact O-N 3.3Å; P251-K253 VanDerWaalsContact O-N 3.07Å; P251-R254 HydrophobicContact CG-CB 4.33Å; P251-R254 HydrophobicContact CG-CG 3.98Å; P251-R254 PolarHBondContact O-N 3.4Å; P251-I255 PolarHBondContact O-N 2.9Å | ||
| 252 | M | 82.1 | Confident | 83 | Confident | 45 Ų | 45 | 65.5 Ų | 65.5 | 22% | 0.222 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -50.9 | -38.8 | -175 | -65.8 | -56 | -57.9 | 0 | 0 | 114.6 | L247 R254 I255 H256 | L247-M252 HydrophobicContact CD2-CE 3.88Å; L247-M252 HydrophobicContact CD2-SD 3.49Å; L247-M252 WeakPolarHBondContact CD2-SD 3.28Å; M252-R254 VanDerWaalsContact C-N 3.26Å; M252-R254 PolarHBondContact O-N 3.15Å; M252-I255 PolarHBondContact O-N 2.99Å; M252-I255 HydrophobicContact SD-CD1 4.37Å; M252-H256 WeakPolarHBondContact CE-NE2 3.27Å; M252-H256 PolarHBondContact O-CD2 2.9Å; M252-H256 PolarHBondContact O-N 3.49Å |
| 253 | K | 85.1 | Confident | 83.6 | Confident | 186 Ų | 186 | 65.3 Ų | 65.3 | 81% | 0.809 | 32% | 0.315 | S | S | * | . | H | α-helix | trans | -57.4 | -38.6 | 179.8 | -65.8 | -174.3 | 179.6 | -177.7 | 0 | 112.6 | P251 L257 | P251-K253 VanDerWaalsContact C-N 3.26Å; P251-K253 PolarHBondContact O-N 3.3Å; P251-K253 VanDerWaalsContact O-N 3.07Å; K253-L257 WeakPolarHBondContact O-CB 3.13Å; K253-L257 PolarHBondContact O-N 3.41Å; K253-L257 VanDerWaalsContact O-N 3.07Å |
| 254 | R | 87.6 | Confident | 84.6 | Confident | 103 Ų | 103 | 63.2 Ų | 63.2 | 39% | 0.389 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -72.1 | -41.5 | 179.4 | -72 | -174.1 | -179.9 | -101 | -5.3 | 111.3 | P251 M252 L257 F258 F300 E304 | P251-R254 HydrophobicContact CG-CB 4.33Å; P251-R254 HydrophobicContact CG-CG 3.98Å; P251-R254 PolarHBondContact O-N 3.4Å; M252-R254 VanDerWaalsContact C-N 3.26Å; M252-R254 PolarHBondContact O-N 3.15Å; R254-L257 PolarHBondContact O-N 3.46Å; R254-F258 PolarHBondContact O-N 3.22Å; R254-F300 HydrophobicContact CB-CE1 4.09Å; R254-F300 WeakPolarHBondContact O-CE1 3.4Å; R254-E304 WeakPolarHBondContact CD-OE1 3.13Å; R254-E304 IonicContact CZ-OE1 3.67Å; R254-E304 IonicContact CZ-OE2 3.38Å; R254-E304 IonicContact NE-OE1 4Å; R254-E304 PolarHBondContact NE-OE1 3.2Å; R254-E304 IonicContact NE-OE2 3.28Å; R254-E304 IonicContact NH1-OE1 2.77Å; R254-E304 PolarHBondContact NH1-OE1 2.87Å; R254-E304 IonicContact NH1-OE2 3.25Å; R254-E304 PolarHBondContact NH1-OE2 2.94Å |
| 255 | I | 86.1 | Confident | 85.2 | Confident | 1 Ų | 1 | 62.6 Ų | 62.6 | 1% | 0.005 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -61 | -48.1 | 176.2 | -58.8 | 172.3 | 0 | 0 | 0 | 110 | Y246 L247 L250 P251 M252 L257 F258 T259 | Y246-I255 HydrophobicContact CD2-CD1 4.1Å; L247-I255 HydrophobicContact CD2-CD1 3.84Å; L250-I255 HydrophobicContact CB-CD1 4.13Å; L250-I255 HydrophobicContact CB-CG1 4Å; P251-I255 PolarHBondContact O-N 2.9Å; M252-I255 PolarHBondContact O-N 2.99Å; M252-I255 HydrophobicContact SD-CD1 4.37Å; I255-L257 PolarHBondContact O-N 3.28Å; I255-F258 PolarHBondContact O-N 3.19Å; I255-T259 HydrophobicContact CG2-CG2 4.43Å; I255-T259 WeakPolarHBondContact O-CG2 3.47Å; I255-T259 PolarHBondContact O-N 2.92Å; I255-T259 PolarHBondContact O-OG1 3.26Å |
| 256 | H | 87.7 | Confident | 85.7 | Confident | 45 Ų | 45 | 68.3 Ų | 68.3 | 21% | 0.208 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -62.7 | -41 | 178.2 | -68.1 | -52.4 | 0 | 0 | 0 | 112.9 | M252 F258 T259 L260 | M252-H256 WeakPolarHBondContact CE-NE2 3.27Å; M252-H256 PolarHBondContact O-CD2 2.9Å; M252-H256 PolarHBondContact O-N 3.49Å; H256-F258 VanDerWaalsContact C-N 3.32Å; H256-F258 PolarHBondContact O-N 2.67Å; H256-T259 VanDerWaalsContact CA-OG1 3.29Å; H256-T259 WeakPolarHBondContact CA-OG1 3.21Å; H256-T259 PolarHBondContact O-N 3.32Å; H256-T259 PolarHBondContact O-OG1 3.39Å; H256-L260 WeakPolarHBondContact O-CB 3.31Å; H256-L260 VanDerWaalsContact O-CG 3.29Å; H256-L260 WeakPolarHBondContact O-CG 3.33Å; H256-L260 PolarHBondContact O-N 2.96Å |
| 257 | L | 89 | Confident | 86.3 | Confident | 88 Ų | 88 | 69.8 Ų | 69.8 | 46% | 0.461 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -60.7 | -42.8 | 176 | -179.6 | 64 | 0 | 0 | 0 | 111.4 | K253 R254 I255 T261 F300 | K253-L257 WeakPolarHBondContact O-CB 3.13Å; K253-L257 PolarHBondContact O-N 3.41Å; K253-L257 VanDerWaalsContact O-N 3.07Å; R254-L257 PolarHBondContact O-N 3.46Å; I255-L257 PolarHBondContact O-N 3.28Å; L257-T261 WeakPolarHBondContact O-CB 3.38Å; L257-T261 PolarHBondContact O-N 3.09Å; L257-T261 PolarHBondContact O-OG1 2.72Å; L257-F300 HydrophobicContact CB-CZ 4.15Å; L257-F300 HydrophobicContact CD2-CE2 4.46Å; L257-F300 HydrophobicContact CD2-CZ 3.99Å; L257-F300 HydrophobicContact CG-CZ 4.01Å |
| 258 | F | 88.2 | Confident | 86.8 | Confident | 2 Ų | 2 | 70.1 Ų | 70.1 | 1% | 0.009 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -65.6 | -45.9 | 177.1 | 178 | -96.6 | 0 | 0 | 0 | 111.8 | R254 I255 H256 L260 T261 Q262 L296 F300 L305 L308 D309 | R254-F258 PolarHBondContact O-N 3.22Å; I255-F258 PolarHBondContact O-N 3.19Å; H256-F258 VanDerWaalsContact C-N 3.32Å; H256-F258 PolarHBondContact O-N 2.67Å; F258-L260 VanDerWaalsContact C-N 3.35Å; F258-L260 PolarHBondContact O-N 2.93Å; F258-T261 WeakPolarHBondContact O-CB 3.36Å; F258-T261 PolarHBondContact O-N 3.45Å; F258-T261 VanDerWaalsContact O-N 3.11Å; F258-Q262 HydrophobicContact CD1-CG 4.05Å; F258-Q262 HydrophobicContact CE1-CG 3.75Å; F258-Q262 HydrophobicContact CZ-CG 4.05Å; F258-Q262 VanDerWaalsContact CZ-NE2 3.28Å; F258-Q262 WeakPolarHBondContact O-CG 3.3Å; F258-Q262 PolarHBondContact O-N 3.37Å; F258-L296 HydrophobicContact CD2-CD2 3.6Å; F258-L296 HydrophobicContact CE2-CD2 3.49Å; F258-L296 VanDerWaalsContact CE2-CD2 3.49Å; F258-F300 HydrophobicContact CB-CE1 4.13Å; F258-F300 HydrophobicContact CB-CE2 4.26Å; F258-F300 HydrophobicContact CB-CZ 3.69Å; F258-F300 HydrophobicContact CD2-CE2 4.33Å; F258-F300 HydrophobicContact CD2-CZ 4.49Å; F258-L305 HydrophobicContact CD2-CD1 4.43Å; F258-L305 HydrophobicContact CE2-CD1 3.73Å; F258-L308 HydrophobicContact CB-CD2 3.41Å; F258-L308 VanDerWaalsContact CB-CD2 3.41Å; F258-L308 HydrophobicContact CD1-CD1 4.15Å; F258-L308 HydrophobicContact CD1-CD2 3.13Å; F258-L308 HydrophobicContact CD1-CG 3.44Å; F258-L308 VanDerWaalsContact CD1-CG 3.44Å; F258-L308 HydrophobicContact CD2-CD2 3.67Å; F258-L308 HydrophobicContact CD2-CG 4.37Å; F258-L308 HydrophobicContact CE1-CB 4.41Å; F258-L308 HydrophobicContact CE1-CD1 4.24Å; F258-L308 HydrophobicContact CE1-CD2 3.62Å; F258-L308 HydrophobicContact CE1-CG 3.39Å; F258-L308 HydrophobicContact CE2-CD2 4.13Å; F258-L308 HydrophobicContact CE2-CG 4.36Å; F258-L308 HydrophobicContact CG-CD2 3.12Å; F258-L308 HydrophobicContact CG-CG 3.92Å; F258-L308 HydrophobicContact CZ-CB 4.48Å; F258-L308 HydrophobicContact CZ-CD2 4.1Å; F258-L308 HydrophobicContact CZ-CG 3.89Å; F258-D309 WeakPolarHBondContact CZ-OD1 3.27Å |
| 259 | T | 87.3 | Confident | 87.1 | Confident | 4 Ų | 4 | 63.5 Ų | 63.5 | 3% | 0.025 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -64.3 | -39.1 | 179.3 | 54.1 | 0 | 0 | 0 | 0 | 112.2 | R230 I255 H256 T261 Q262 I263 | R230-T259 HydrophobicContact CB-CG2 3.48Å; R230-T259 VanDerWaalsContact CB-CG2 3.48Å; R230-T259 HydrophobicContact CG-CG2 4.26Å; I255-T259 HydrophobicContact CG2-CG2 4.43Å; I255-T259 WeakPolarHBondContact O-CG2 3.47Å; I255-T259 PolarHBondContact O-N 2.92Å; I255-T259 PolarHBondContact O-OG1 3.26Å; H256-T259 VanDerWaalsContact CA-OG1 3.29Å; H256-T259 WeakPolarHBondContact CA-OG1 3.21Å; H256-T259 PolarHBondContact O-N 3.32Å; H256-T259 PolarHBondContact O-OG1 3.39Å; T259-T261 VanDerWaalsContact C-N 3.27Å; T259-T261 PolarHBondContact O-N 2.95Å; T259-Q262 PolarHBondContact O-N 2.92Å; T259-I263 WeakPolarHBondContact O-CD1 3.41Å; T259-I263 WeakPolarHBondContact O-CG1 3.49Å; T259-I263 PolarHBondContact O-N 3.06Å |
| 260 | L | 89.5 | Confident | 87.4 | Confident | 90 Ų | 90 | 62 Ų | 62 | 47% | 0.471 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -62.6 | -38.7 | 173.9 | -76.9 | 172 | 0 | 0 | 0 | 111.2 | H256 F258 I263 F264 | H256-L260 WeakPolarHBondContact O-CB 3.31Å; H256-L260 VanDerWaalsContact O-CG 3.29Å; H256-L260 WeakPolarHBondContact O-CG 3.33Å; H256-L260 PolarHBondContact O-N 2.96Å; F258-L260 VanDerWaalsContact C-N 3.35Å; F258-L260 PolarHBondContact O-N 2.93Å; L260-I263 PolarHBondContact O-N 3.34Å; L260-F264 WeakPolarHBondContact O-CB 3.26Å; L260-F264 PolarHBondContact O-N 3.36Å |
| 261 | T | 88.8 | Confident | 87.7 | Confident | 35 Ų | 35 | 65.6 Ų | 65.6 | 22% | 0.215 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -67.5 | -40 | 176.7 | -52.7 | 0 | 0 | 0 | 0 | 111.6 | L257 F258 T259 F264 F265 L296 | L257-T261 WeakPolarHBondContact O-CB 3.38Å; L257-T261 PolarHBondContact O-N 3.09Å; L257-T261 PolarHBondContact O-OG1 2.72Å; F258-T261 WeakPolarHBondContact O-CB 3.36Å; F258-T261 PolarHBondContact O-N 3.45Å; F258-T261 VanDerWaalsContact O-N 3.11Å; T259-T261 VanDerWaalsContact C-N 3.27Å; T259-T261 PolarHBondContact O-N 2.95Å; T261-F264 WeakPolarHBondContact O-CB 3.18Å; T261-F264 PolarHBondContact O-N 3.42Å; T261-F265 HydrophobicContact CG2-CD2 3.93Å; T261-F265 HydrophobicContact CG2-CE2 3.6Å; T261-F265 WeakPolarHBondContact O-CD2 3.24Å; T261-F265 PolarHBondContact O-N 2.87Å; T261-F265 VanDerWaalsContact O-N 3.08Å; T261-L296 HydrophobicContact CG2-CD1 3.69Å; T261-L296 HydrophobicContact CG2-CG 4.46Å |
| 262 | Q | 87.8 | Confident | 87.8 | Confident | 58 Ų | 58 | 62.7 Ų | 62.7 | 27% | 0.271 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -63.1 | -45.3 | 173 | -71.3 | -174 | -44.2 | 0 | 0 | 112.1 | F258 T259 F264 F265 F266 | F258-Q262 HydrophobicContact CD1-CG 4.05Å; F258-Q262 HydrophobicContact CE1-CG 3.75Å; F258-Q262 HydrophobicContact CZ-CG 4.05Å; F258-Q262 VanDerWaalsContact CZ-NE2 3.28Å; F258-Q262 WeakPolarHBondContact O-CG 3.3Å; F258-Q262 PolarHBondContact O-N 3.37Å; T259-Q262 PolarHBondContact O-N 2.92Å; Q262-F264 VanDerWaalsContact C-N 3.32Å; Q262-F264 PolarHBondContact O-N 3.21Å; Q262-F265 PolarHBondContact O-N 3.46Å; Q262-F266 WeakPolarHBondContact O-CB 3.34Å; Q262-F266 PolarHBondContact O-N 3.05Å |
| 263 | I | 88.1 | Confident | 87.8 | Confident | 57 Ų | 57 | 65.3 Ų | 65.3 | 29% | 0.292 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -61 | -43 | 176 | -67.2 | 163.6 | 0 | 0 | 0 | 110.1 | I231 T259 L260 F265 F266 C267 | I231-I263 HydrophobicContact CD1-CD1 4.42Å; I231-I263 HydrophobicContact CD1-CG1 4.3Å; I231-I263 HydrophobicContact CG1-CD1 4.06Å; I231-I263 HydrophobicContact CG1-CG1 4.33Å; T259-I263 WeakPolarHBondContact O-CD1 3.41Å; T259-I263 WeakPolarHBondContact O-CG1 3.49Å; T259-I263 PolarHBondContact O-N 3.06Å; L260-I263 PolarHBondContact O-N 3.34Å; I263-F265 PolarHBondContact O-N 2.86Å; I263-F266 PolarHBondContact O-N 3.34Å; I263-C267 WeakPolarHBondContact O-CB 3.32Å; I263-C267 PolarHBondContact O-N 3.02Å; I263-C267 PolarHBondContact O-SG 3Å |
| 264 | F | 90.5 | Very high | 87.8 | Confident | 127 Ų | 127 | 65.8 Ų | 65.8 | 56% | 0.557 | 33% | 0.326 | S | S | * | . | H | α-helix | trans | -56.9 | -50.7 | 176.1 | 171.6 | -99.3 | 0 | 0 | 0 | 111.8 | L260 T261 Q262 F266 C267 V268 | L260-F264 WeakPolarHBondContact O-CB 3.26Å; L260-F264 PolarHBondContact O-N 3.36Å; T261-F264 WeakPolarHBondContact O-CB 3.18Å; T261-F264 PolarHBondContact O-N 3.42Å; Q262-F264 VanDerWaalsContact C-N 3.32Å; Q262-F264 PolarHBondContact O-N 3.21Å; F264-F266 VanDerWaalsContact C-N 3.34Å; F264-F266 PolarHBondContact O-N 2.92Å; F264-C267 PolarHBondContact O-N 3.33Å; F264-V268 HydrophobicContact CE1-CG2 4.18Å; F264-V268 HydrophobicContact CE2-CG2 4.29Å; F264-V268 HydrophobicContact CZ-CG2 4.03Å; F264-V268 WeakPolarHBondContact O-CG2 3.49Å; F264-V268 PolarHBondContact O-N 2.98Å |
| 265 | F | 89.7 | Confident | 87.6 | Confident | 38 Ų | 38 | 63.3 Ų | 63.3 | 17% | 0.167 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -65.1 | -35.9 | 177.8 | -77.4 | -56.7 | 0 | 0 | 0 | 113.1 | T261 Q262 I263 V268 L269 L289 G292 L296 | T261-F265 HydrophobicContact CG2-CD2 3.93Å; T261-F265 HydrophobicContact CG2-CE2 3.6Å; T261-F265 WeakPolarHBondContact O-CD2 3.24Å; T261-F265 PolarHBondContact O-N 2.87Å; T261-F265 VanDerWaalsContact O-N 3.08Å; Q262-F265 PolarHBondContact O-N 3.46Å; I263-F265 PolarHBondContact O-N 2.86Å; F265-V268 PolarHBondContact O-N 3.42Å; F265-L269 PolarHBondContact O-N 2.85Å; F265-L289 HydrophobicContact CB-CD2 3.62Å; F265-L289 HydrophobicContact CD1-CD2 3.64Å; F265-L289 HydrophobicContact CG-CD2 3.84Å; F265-G292 VanDerWaalsContact CZ-CA 3.46Å; F265-L296 HydrophobicContact CE2-CD1 3.98Å |
| 266 | F | 87 | Confident | 87.2 | Confident | 134 Ų | 134 | 69.3 Ų | 69.3 | 59% | 0.588 | 35% | 0.354 | S | S | * | . | H | α-helix | trans | -64.2 | -44.6 | 173.1 | -180 | -104.1 | 0 | 0 | 0 | 111.6 | Q262 I263 F264 V268 L269 C270 | Q262-F266 WeakPolarHBondContact O-CB 3.34Å; Q262-F266 PolarHBondContact O-N 3.05Å; I263-F266 PolarHBondContact O-N 3.34Å; F264-F266 VanDerWaalsContact C-N 3.34Å; F264-F266 PolarHBondContact O-N 2.92Å; F266-V268 VanDerWaalsContact C-N 3.34Å; F266-V268 PolarHBondContact O-N 3.47Å; F266-L269 WeakPolarHBondContact O-CB 3.48Å; F266-L269 PolarHBondContact O-N 3.37Å; F266-L269 VanDerWaalsContact O-N 3.17Å; F266-C270 WeakPolarHBondContact CE1-SG 3.28Å; F266-C270 WeakPolarHBondContact CZ-SG 3.35Å; F266-C270 PolarHBondContact O-N 3.49Å; F266-C270 PolarHBondContact O-SG 3.24Å; F266-C270 VanDerWaalsContact O-SG 3.34Å |
| 267 | C | 89.4 | Confident | 86.8 | Confident | 63 Ų | 63 | 72.4 Ų | 72.4 | 43% | 0.426 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -61.2 | -41.7 | 175.1 | -71.4 | 0 | 0 | 0 | 0 | 111.9 | I263 F264 L269 C270 V271 | I263-C267 WeakPolarHBondContact O-CB 3.32Å; I263-C267 PolarHBondContact O-N 3.02Å; I263-C267 PolarHBondContact O-SG 3Å; F264-C267 PolarHBondContact O-N 3.33Å; C267-L269 VanDerWaalsContact C-N 3.31Å; C267-L269 PolarHBondContact O-N 3.41Å; C267-C270 PolarHBondContact O-N 2.81Å; C267-V271 WeakPolarHBondContact O-CG2 3.48Å; C267-V271 PolarHBondContact O-N 2.9Å |
| 268 | V | 89.1 | Confident | 86.4 | Confident | 37 Ų | 37 | 71.2 Ų | 71.2 | 22% | 0.224 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -58.5 | -44.9 | 174.2 | 170.2 | 0 | 0 | 0 | 0 | 110.8 | F264 F265 F266 V271 V272 T285 L288 | F264-V268 HydrophobicContact CE1-CG2 4.18Å; F264-V268 HydrophobicContact CE2-CG2 4.29Å; F264-V268 HydrophobicContact CZ-CG2 4.03Å; F264-V268 WeakPolarHBondContact O-CG2 3.49Å; F264-V268 PolarHBondContact O-N 2.98Å; F265-V268 PolarHBondContact O-N 3.42Å; F266-V268 VanDerWaalsContact C-N 3.34Å; F266-V268 PolarHBondContact O-N 3.47Å; V268-V271 PolarHBondContact O-N 2.94Å; V268-V272 WeakPolarHBondContact O-CG2 3.35Å; V268-V272 PolarHBondContact O-N 3.48Å; V268-T285 HydrophobicContact CG1-CG2 4.21Å; V268-L288 HydrophobicContact CG1-CD2 4.24Å |
| 269 | L | 87.3 | Confident | 86 | Confident | 45 Ų | 45 | 76.2 Ų | 76.2 | 24% | 0.236 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -63.2 | -44 | 175.1 | -79.4 | 169.1 | 0 | 0 | 0 | 112.7 | F265 F266 C267 V271 V272 N273 T285 L289 | F265-L269 PolarHBondContact O-N 2.85Å; F266-L269 WeakPolarHBondContact O-CB 3.48Å; F266-L269 PolarHBondContact O-N 3.37Å; F266-L269 VanDerWaalsContact O-N 3.17Å; C267-L269 VanDerWaalsContact C-N 3.31Å; C267-L269 PolarHBondContact O-N 3.41Å; L269-V271 PolarHBondContact O-N 3.15Å; L269-V272 PolarHBondContact O-N 3.17Å; L269-N273 VanDerWaalsContact O-CB 3.29Å; L269-N273 WeakPolarHBondContact O-CB 3.11Å; L269-N273 PolarHBondContact O-N 2.98Å; L269-T285 HydrophobicContact CD2-CG2 3.59Å; L269-T285 HydrophobicContact CG-CG2 4.33Å; L269-L289 HydrophobicContact CD1-CD1 3.47Å; L269-L289 VanDerWaalsContact CD1-CD1 3.47Å; L269-L289 HydrophobicContact CD1-CD2 4.19Å; L269-L289 HydrophobicContact CD1-CG 4.38Å; L269-L289 HydrophobicContact CD2-CD1 3.86Å; L269-L289 HydrophobicContact CG-CD1 3.9Å; L269-L289 HydrophobicContact CG-CD2 4.31Å; L269-L289 HydrophobicContact CG-CG 4.47Å |
| 270 | C | 87.4 | Confident | 85.8 | Confident | 55 Ų | 55 | 81.3 Ų | 81.3 | 37% | 0.372 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -61.8 | -42.5 | 177.9 | -71.8 | 0 | 0 | 0 | 0 | 111.8 | F266 C267 N273 Y274 | F266-C270 WeakPolarHBondContact CE1-SG 3.28Å; F266-C270 WeakPolarHBondContact CZ-SG 3.35Å; F266-C270 PolarHBondContact O-N 3.49Å; F266-C270 PolarHBondContact O-SG 3.24Å; F266-C270 VanDerWaalsContact O-SG 3.34Å; C267-C270 PolarHBondContact O-N 2.81Å; C270-N273 PolarHBondContact O-N 2.81Å; C270-Y274 WeakPolarHBondContact O-CB 3.15Å; C270-Y274 PolarHBondContact O-N 2.91Å |
| 271 | V | 88 | Confident | 85.5 | Confident | 89 Ų | 89 | 80.9 Ų | 80.9 | 54% | 0.539 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -65.3 | -43.8 | 178 | 171.1 | 0 | 0 | 0 | 0 | 111.1 | C267 V268 L269 N273 Y274 V275 | C267-V271 WeakPolarHBondContact O-CG2 3.48Å; C267-V271 PolarHBondContact O-N 2.9Å; V268-V271 PolarHBondContact O-N 2.94Å; L269-V271 PolarHBondContact O-N 3.15Å; V271-N273 VanDerWaalsContact C-N 3.33Å; V271-N273 PolarHBondContact O-N 3.24Å; V271-Y274 PolarHBondContact O-N 3.49Å; V271-V275 WeakPolarHBondContact O-CG2 3.21Å; V271-V275 PolarHBondContact O-N 3.21Å |
| 272 | V | 87.5 | Confident | 85.3 | Confident | 15 Ų | 15 | 83.3 Ų | 83.3 | 9% | 0.091 | 42% | 0.421 | C | S | . | . | H | α-helix | trans | -63.3 | -40.7 | 177.3 | 166.3 | 0 | 0 | 0 | 0 | 111.5 | V268 L269 I278 T285 | V268-V272 WeakPolarHBondContact O-CG2 3.35Å; V268-V272 PolarHBondContact O-N 3.48Å; L269-V272 PolarHBondContact O-N 3.17Å; V272-I278 HydrophobicContact CB-CG2 4.35Å; V272-I278 HydrophobicContact CG1-CG2 4.13Å; V272-I278 HydrophobicContact CG2-CG2 4.04Å; V272-T285 HydrophobicContact CB-CG2 4.39Å; V272-T285 HydrophobicContact CG1-CG2 4.48Å; V272-T285 WeakPolarHBondContact CG1-OG1 3.3Å; V272-T285 HydrophobicContact CG2-CG2 4.06Å |
| 273 | N | 83.2 | Confident | 85.2 | Confident | 99 Ų | 99 | 82.7 Ų | 82.7 | 53% | 0.529 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -76.8 | -30 | -179.4 | -170.6 | -88.6 | 0 | 0 | 0 | 112.8 | L269 C270 V271 V275 | L269-N273 VanDerWaalsContact O-CB 3.29Å; L269-N273 WeakPolarHBondContact O-CB 3.11Å; L269-N273 PolarHBondContact O-N 2.98Å; C270-N273 PolarHBondContact O-N 2.81Å; V271-N273 VanDerWaalsContact C-N 3.33Å; V271-N273 PolarHBondContact O-N 3.24Å; N273-V275 VanDerWaalsContact C-N 3.34Å |
| 274 | Y | 85.1 | Confident | 85 | Confident | 197 Ų | 197 | 82.4 Ų | 82.4 | 77% | 0.773 | 42% | 0.421 | S | S | * | . | H | α-helix | trans | -71.9 | -28.9 | 178.8 | -179.5 | -99.7 | 0 | 0 | 0 | 112.9 | C270 V271 | C270-Y274 WeakPolarHBondContact O-CB 3.15Å; C270-Y274 PolarHBondContact O-N 2.91Å; V271-Y274 PolarHBondContact O-N 3.49Å |
| 275 | V | 83.9 | Confident | 84.9 | Confident | 50 Ų | 50 | 76.8 Ų | 76.8 | 30% | 0.303 | 40% | 0.397 | S | S | . | . | trans | -98.3 | 105.1 | -179.5 | -175.7 | 0 | 0 | 0 | 0 | 109.6 | V271 N273 V277 I278 E279 | V271-V275 WeakPolarHBondContact O-CG2 3.21Å; V271-V275 PolarHBondContact O-N 3.21Å; N273-V275 VanDerWaalsContact C-N 3.34Å; V275-V277 HydrophobicContact CG1-CB 4.16Å; V275-V277 PolarHBondContact O-N 2.85Å; V275-I278 HydrophobicContact CB-CB 4.19Å; V275-I278 HydrophobicContact CB-CD1 3.9Å; V275-I278 HydrophobicContact CB-CG1 3.98Å; V275-I278 HydrophobicContact CG1-CB 4.31Å; V275-I278 HydrophobicContact CG1-CD1 3.84Å; V275-I278 HydrophobicContact CG1-CG1 3.7Å; V275-I278 HydrophobicContact CG2-CD1 4.24Å; V275-I278 WeakPolarHBondContact O-CA 3.42Å; V275-I278 PolarHBondContact O-N 2.84Å; V275-E279 PolarHBondContact O-N 2.95Å; V275-E279 VanDerWaalsContact O-N 3.14Å | ||
| 276 | D | 77.3 | Confident | 84.8 | Confident | 127 Ų | 127 | 78.5 Ų | 78.5 | 68% | 0.679 | 41% | 0.407 | S | S | * | . | H | α-helix | trans | -52.2 | -34.1 | 179.9 | -58.5 | -25.3 | 0 | 0 | 0 | 113.2 | I278 E279 | D276-I278 VanDerWaalsContact C-N 3.29Å; D276-I278 PolarHBondContact O-N 3.29Å; D276-E279 WeakPolarHBondContact O-CB 3.41Å; D276-E279 PolarHBondContact O-N 2.96Å |
| 277 | V | 78.1 | Confident | 84.8 | Confident | 111 Ų | 111 | 73 Ų | 73 | 67% | 0.673 | 38% | 0.384 | S | S | * | . | H | α-helix | trans | -66.8 | -32.2 | 178 | -173.9 | 0 | 0 | 0 | 0 | 112 | V275 | V275-V277 HydrophobicContact CG1-CB 4.16Å; V275-V277 PolarHBondContact O-N 2.85Å |
| 278 | I | 80.4 | Confident | 84.8 | Confident | 63 Ų | 63 | 74.2 Ų | 74.2 | 32% | 0.323 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -91.4 | -13.8 | -177.5 | -52.7 | 175.6 | 0 | 0 | 0 | 110.9 | V272 V275 D276 I280 F281 | V272-I278 HydrophobicContact CB-CG2 4.35Å; V272-I278 HydrophobicContact CG1-CG2 4.13Å; V272-I278 HydrophobicContact CG2-CG2 4.04Å; V275-I278 HydrophobicContact CB-CB 4.19Å; V275-I278 HydrophobicContact CB-CD1 3.9Å; V275-I278 HydrophobicContact CB-CG1 3.98Å; V275-I278 HydrophobicContact CG1-CB 4.31Å; V275-I278 HydrophobicContact CG1-CD1 3.84Å; V275-I278 HydrophobicContact CG1-CG1 3.7Å; V275-I278 HydrophobicContact CG2-CD1 4.24Å; V275-I278 WeakPolarHBondContact O-CA 3.42Å; V275-I278 PolarHBondContact O-N 2.84Å; D276-I278 VanDerWaalsContact C-N 3.29Å; D276-I278 PolarHBondContact O-N 3.29Å; I278-I280 PolarHBondContact O-N 2.85Å; I278-I280 VanDerWaalsContact O-N 3.07Å; I278-F281 HydrophobicContact CG2-CB 4.3Å; I278-F281 HydrophobicContact CG2-CD2 4.2Å; I278-F281 WeakPolarHBondContact O-CA 3.25Å; I278-F281 VanDerWaalsContact O-CB 3.3Å; I278-F281 WeakPolarHBondContact O-CB 3.25Å; I278-F281 PolarHBondContact O-N 3.47Å |
| 279 | E | 80.6 | Confident | 84.8 | Confident | 106 Ų | 106 | 74.5 Ų | 74.5 | 50% | 0.495 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -54.5 | -32.6 | 178.7 | -168.8 | -175.4 | 177.6 | 0 | 0 | 112.7 | V275 D276 F281 F282 | V275-E279 PolarHBondContact O-N 2.95Å; V275-E279 VanDerWaalsContact O-N 3.14Å; D276-E279 WeakPolarHBondContact O-CB 3.41Å; D276-E279 PolarHBondContact O-N 2.96Å; E279-F281 PolarHBondContact O-N 2.9Å; E279-F282 WeakPolarHBondContact O-CB 3.27Å; E279-F282 PolarHBondContact O-N 3.31Å |
| 280 | I | 82.6 | Confident | 84.8 | Confident | 112 Ų | 112 | 78.1 Ų | 78.1 | 57% | 0.574 | 40% | 0.404 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -54.9 | -28.8 | 174.5 | -62.3 | 164.9 | 0 | 0 | 0 | 111.9 | I278 F282 | I278-I280 PolarHBondContact O-N 2.85Å; I278-I280 VanDerWaalsContact O-N 3.07Å; I280-F282 VanDerWaalsContact C-N 3.34Å |
| 281 | F | 83.1 | Confident | 84.9 | Confident | 80 Ų | 80 | 79.8 Ų | 79.8 | 35% | 0.351 | 41% | 0.409 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -85.7 | 0.2 | 178.1 | -63.4 | -101.2 | 0 | 0 | 0 | 113.8 | L72 I278 E279 P283 L284 T285 | L72-F281 HydrophobicContact CD1-CD1 3.93Å; L72-F281 HydrophobicContact CD1-CE1 3.55Å; L72-F281 HydrophobicContact CD2-CD1 3.92Å; L72-F281 HydrophobicContact CD2-CE1 3.06Å; L72-F281 HydrophobicContact CD2-CE2 4.2Å; L72-F281 HydrophobicContact CD2-CZ 3.22Å; L72-F281 HydrophobicContact CG-CE1 3.92Å; L72-F281 HydrophobicContact CG-CZ 4.48Å; I278-F281 HydrophobicContact CG2-CB 4.3Å; I278-F281 HydrophobicContact CG2-CD2 4.2Å; I278-F281 WeakPolarHBondContact O-CA 3.25Å; I278-F281 VanDerWaalsContact O-CB 3.3Å; I278-F281 WeakPolarHBondContact O-CB 3.25Å; I278-F281 PolarHBondContact O-N 3.47Å; E279-F281 PolarHBondContact O-N 2.9Å; F281-P283 VanDerWaalsContact C-N 3.29Å; F281-P283 VanDerWaalsContact O-N 3.14Å; F281-L284 HydrophobicContact CD1-CD1 3.98Å; F281-L284 WeakPolarHBondContact O-CA 3.37Å; F281-L284 WeakPolarHBondContact O-CB 3.29Å; F281-L284 PolarHBondContact O-N 3.28Å; F281-T285 PolarHBondContact O-N 2.9Å; F281-T285 PolarHBondContact O-OG1 3.2Å |
| 282 | F | 85.9 | Confident | 85 | Confident | 86 Ų | 86 | 75.8 Ų | 75.8 | 38% | 0.377 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -46.9 | -44 | -180 | 175 | -100.7 | 0 | 0 | 0 | 113.8 | E279 I280 L284 T285 L286 | E279-F282 WeakPolarHBondContact O-CB 3.27Å; E279-F282 PolarHBondContact O-N 3.31Å; I280-F282 VanDerWaalsContact C-N 3.34Å; F282-L284 VanDerWaalsContact C-N 3.31Å; F282-L284 PolarHBondContact O-N 2.87Å; F282-T285 WeakPolarHBondContact O-CB 3.34Å; F282-T285 PolarHBondContact O-N 3.46Å; F282-T285 VanDerWaalsContact O-N 3.11Å; F282-L286 HydrophobicContact CD1-CD1 4.31Å; F282-L286 HydrophobicContact CE1-CD1 3.66Å; F282-L286 HydrophobicContact CE1-CG 4.12Å; F282-L286 HydrophobicContact CE2-CD2 4.33Å; F282-L286 HydrophobicContact CE2-CG 4.47Å; F282-L286 HydrophobicContact CZ-CD1 3.94Å; F282-L286 HydrophobicContact CZ-CD2 4.03Å; F282-L286 HydrophobicContact CZ-CG 4.06Å; F282-L286 PolarHBondContact O-N 3.02Å |
| 283 | P | 84.9 | Confident | 84.9 | Confident | 45 Ų | 45 | 82.3 Ų | 82.3 | 29% | 0.292 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -64.1 | -34.1 | 177.9 | -16.8 | 30.1 | 0 | 0 | 0 | 113 | F65 L68 F281 L286 I287 | F65-P283 HydrophobicContact CD1-CB 4.05Å; F65-P283 HydrophobicContact CE1-CB 3.55Å; L68-P283 HydrophobicContact CD1-CB 3.99Å; L68-P283 HydrophobicContact CD1-CG 3.81Å; F281-P283 VanDerWaalsContact C-N 3.29Å; F281-P283 VanDerWaalsContact O-N 3.14Å; P283-L286 PolarHBondContact O-N 2.63Å; P283-I287 WeakPolarHBondContact O-CD1 3.29Å; P283-I287 VanDerWaalsContact O-CG1 3.29Å; P283-I287 WeakPolarHBondContact O-CG1 3.23Å; P283-I287 PolarHBondContact O-N 3.45Å |
| 284 | L | 84.9 | Confident | 85.2 | Confident | 52 Ų | 52 | 85.3 Ų | 85.3 | 27% | 0.272 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -69.7 | -34.8 | 172.7 | -70.3 | -178.5 | 0 | 0 | 0 | 112.5 | L68 L72 F281 F282 L286 I287 L288 | L68-L284 HydrophobicContact CD1-CG 4.19Å; L68-L284 HydrophobicContact CD2-CD1 3.38Å; L68-L284 HydrophobicContact CD2-CD2 3.85Å; L68-L284 HydrophobicContact CD2-CG 3.41Å; L68-L284 VanDerWaalsContact CD2-CG 3.41Å; L68-L284 HydrophobicContact CG-CG 4.49Å; L72-L284 HydrophobicContact CD1-CD1 3.43Å; L72-L284 VanDerWaalsContact CD1-CD1 3.43Å; F281-L284 HydrophobicContact CD1-CD1 3.98Å; F281-L284 WeakPolarHBondContact O-CA 3.37Å; F281-L284 WeakPolarHBondContact O-CB 3.29Å; F281-L284 PolarHBondContact O-N 3.28Å; F282-L284 VanDerWaalsContact C-N 3.31Å; F282-L284 PolarHBondContact O-N 2.87Å; L284-L286 VanDerWaalsContact C-N 3.32Å; L284-L286 PolarHBondContact O-N 2.92Å; L284-I287 HydrophobicContact CD2-CD1 3.81Å; L284-I287 WeakPolarHBondContact O-CB 3.21Å; L284-I287 PolarHBondContact O-N 3.47Å; L284-I287 VanDerWaalsContact O-N 3.16Å; L284-L288 PolarHBondContact O-N 2.85Å |
| 285 | T | 87.5 | Confident | 85.3 | Confident | 9 Ų | 9 | 80.8 Ų | 80.8 | 6% | 0.055 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -64 | -39.5 | 175.5 | -49.4 | 0 | 0 | 0 | 0 | 110.9 | V268 L269 V272 F281 F282 I287 L288 L289 | V268-T285 HydrophobicContact CG1-CG2 4.21Å; L269-T285 HydrophobicContact CD2-CG2 3.59Å; L269-T285 HydrophobicContact CG-CG2 4.33Å; V272-T285 HydrophobicContact CB-CG2 4.39Å; V272-T285 HydrophobicContact CG1-CG2 4.48Å; V272-T285 WeakPolarHBondContact CG1-OG1 3.3Å; V272-T285 HydrophobicContact CG2-CG2 4.06Å; F281-T285 PolarHBondContact O-N 2.9Å; F281-T285 PolarHBondContact O-OG1 3.2Å; F282-T285 WeakPolarHBondContact O-CB 3.34Å; F282-T285 PolarHBondContact O-N 3.46Å; F282-T285 VanDerWaalsContact O-N 3.11Å; T285-I287 VanDerWaalsContact C-N 3.29Å; T285-I287 PolarHBondContact O-N 2.91Å; T285-L288 WeakPolarHBondContact O-CB 3.23Å; T285-L288 PolarHBondContact O-N 2.8Å; T285-L289 WeakPolarHBondContact O-CG 3.26Å; T285-L289 PolarHBondContact O-N 3.11Å |
| 286 | L | 87.4 | Confident | 85.5 | Confident | 73 Ų | 73 | 79.3 Ų | 79.3 | 38% | 0.382 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -60.2 | -39 | 172.3 | -66.8 | -178.4 | 0 | 0 | 0 | 112.3 | F282 P283 L284 L289 I290 | F282-L286 HydrophobicContact CD1-CD1 4.31Å; F282-L286 HydrophobicContact CE1-CD1 3.66Å; F282-L286 HydrophobicContact CE1-CG 4.12Å; F282-L286 HydrophobicContact CE2-CD2 4.33Å; F282-L286 HydrophobicContact CE2-CG 4.47Å; F282-L286 HydrophobicContact CZ-CD1 3.94Å; F282-L286 HydrophobicContact CZ-CD2 4.03Å; F282-L286 HydrophobicContact CZ-CG 4.06Å; F282-L286 PolarHBondContact O-N 3.02Å; P283-L286 PolarHBondContact O-N 2.63Å; L284-L286 VanDerWaalsContact C-N 3.32Å; L284-L286 PolarHBondContact O-N 2.92Å; L286-L289 HydrophobicContact CD2-CD1 4.26Å; L286-L289 WeakPolarHBondContact O-CB 3.1Å; L286-L289 PolarHBondContact O-N 3.44Å; L286-I290 WeakPolarHBondContact O-CG1 3.36Å; L286-I290 PolarHBondContact O-N 2.86Å; L286-I290 VanDerWaalsContact O-N 3.08Å |
| 287 | I | 86.9 | Confident | 85.9 | Confident | 19 Ų | 19 | 78.6 Ų | 78.6 | 10% | 0.097 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -65.5 | -44 | 176.2 | -61.9 | 162.4 | 0 | 0 | 0 | 110.7 | F61 F65 P283 L284 T285 L289 I290 I291 | F61-I287 HydrophobicContact CE2-CB 4.4Å; F61-I287 HydrophobicContact CE2-CD1 3.43Å; F61-I287 VanDerWaalsContact CE2-CD1 3.43Å; F61-I287 HydrophobicContact CE2-CG1 3.67Å; F61-I287 HydrophobicContact CE2-CG2 3.82Å; F61-I287 HydrophobicContact CZ-CB 4.47Å; F61-I287 HydrophobicContact CZ-CD1 3.36Å; F61-I287 HydrophobicContact CZ-CG1 3.99Å; F61-I287 HydrophobicContact CZ-CG2 3.74Å; F65-I287 HydrophobicContact CD1-CD1 3.96Å; F65-I287 HydrophobicContact CD2-CD1 3.79Å; F65-I287 HydrophobicContact CE1-CD1 3.63Å; F65-I287 HydrophobicContact CE1-CG1 4.37Å; F65-I287 HydrophobicContact CE2-CD1 3.5Å; F65-I287 HydrophobicContact CE2-CG1 4.1Å; F65-I287 HydrophobicContact CG-CD1 4.04Å; F65-I287 HydrophobicContact CZ-CD1 3.41Å; F65-I287 VanDerWaalsContact CZ-CD1 3.41Å; F65-I287 HydrophobicContact CZ-CG1 3.84Å; P283-I287 WeakPolarHBondContact O-CD1 3.29Å; P283-I287 VanDerWaalsContact O-CG1 3.29Å; P283-I287 WeakPolarHBondContact O-CG1 3.23Å; P283-I287 PolarHBondContact O-N 3.45Å; L284-I287 HydrophobicContact CD2-CD1 3.81Å; L284-I287 WeakPolarHBondContact O-CB 3.21Å; L284-I287 PolarHBondContact O-N 3.47Å; L284-I287 VanDerWaalsContact O-N 3.16Å; T285-I287 VanDerWaalsContact C-N 3.29Å; T285-I287 PolarHBondContact O-N 2.91Å; I287-L289 PolarHBondContact O-N 3.25Å; I287-I290 PolarHBondContact O-N 3.25Å; I287-I291 HydrophobicContact CG2-CD1 3.83Å; I287-I291 HydrophobicContact CG2-CG1 4.33Å; I287-I291 WeakPolarHBondContact O-CG1 3.44Å; I287-I291 PolarHBondContact O-N 3.39Å |
| 288 | L | 88.9 | Confident | 86.3 | Confident | 88 Ų | 88 | 82.9 Ų | 82.9 | 46% | 0.461 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -57 | -37.9 | 175.3 | 179.8 | 65.2 | 0 | 0 | 0 | 111.2 | V268 L284 T285 G292 | V268-L288 HydrophobicContact CG1-CD2 4.24Å; L284-L288 PolarHBondContact O-N 2.85Å; T285-L288 WeakPolarHBondContact O-CB 3.23Å; T285-L288 PolarHBondContact O-N 2.8Å; L288-G292 WeakPolarHBondContact O-CA 3.34Å; L288-G292 PolarHBondContact O-N 3.07Å |
| 289 | L | 89.2 | Confident | 86.6 | Confident | 43 Ų | 43 | 86.5 Ų | 86.5 | 23% | 0.225 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -66.1 | -41.1 | 173.4 | -63.5 | 177.2 | 0 | 0 | 0 | 113 | F265 L269 T285 L286 I287 G292 R293 | F265-L289 HydrophobicContact CB-CD2 3.62Å; F265-L289 HydrophobicContact CD1-CD2 3.64Å; F265-L289 HydrophobicContact CG-CD2 3.84Å; L269-L289 HydrophobicContact CD1-CD1 3.47Å; L269-L289 VanDerWaalsContact CD1-CD1 3.47Å; L269-L289 HydrophobicContact CD1-CD2 4.19Å; L269-L289 HydrophobicContact CD1-CG 4.38Å; L269-L289 HydrophobicContact CD2-CD1 3.86Å; L269-L289 HydrophobicContact CG-CD1 3.9Å; L269-L289 HydrophobicContact CG-CD2 4.31Å; L269-L289 HydrophobicContact CG-CG 4.47Å; T285-L289 WeakPolarHBondContact O-CG 3.26Å; T285-L289 PolarHBondContact O-N 3.11Å; L286-L289 HydrophobicContact CD2-CD1 4.26Å; L286-L289 WeakPolarHBondContact O-CB 3.1Å; L286-L289 PolarHBondContact O-N 3.44Å; I287-L289 PolarHBondContact O-N 3.25Å; L289-G292 PolarHBondContact O-N 2.89Å; L289-R293 WeakPolarHBondContact O-CB 3.24Å; L289-R293 PolarHBondContact O-N 3.31Å |
| 290 | I | 87.9 | Confident | 86.9 | Confident | 121 Ų | 121 | 81.9 Ų | 81.9 | 62% | 0.621 | 38% | 0.384 | S | S | * | . | H | α-helix | trans | -64.2 | -44.3 | 177.5 | -66 | 167.4 | 0 | 0 | 0 | 110.3 | L286 I287 R293 K294 | L286-I290 WeakPolarHBondContact O-CG1 3.36Å; L286-I290 PolarHBondContact O-N 2.86Å; L286-I290 VanDerWaalsContact O-N 3.08Å; I287-I290 PolarHBondContact O-N 3.25Å; I290-R293 PolarHBondContact O-N 2.92Å; I290-K294 PolarHBondContact O-N 2.94Å |
| 291 | I | 89.2 | Confident | 86.9 | Confident | 91 Ų | 91 | 79.9 Ų | 79.9 | 47% | 0.467 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -64.3 | -44.8 | 175.2 | -65 | 171.3 | 0 | 0 | 0 | 109.9 | I287 R293 K294 L295 | I287-I291 HydrophobicContact CG2-CD1 3.83Å; I287-I291 HydrophobicContact CG2-CG1 4.33Å; I287-I291 WeakPolarHBondContact O-CG1 3.44Å; I287-I291 PolarHBondContact O-N 3.39Å; I291-R293 PolarHBondContact O-N 2.98Å; I291-K294 CarbonylContact O-C 3.57Å; I291-K294 WeakPolarHBondContact O-CA 3.29Å; I291-K294 WeakPolarHBondContact O-CB 3.05Å; I291-K294 PolarHBondContact O-N 3.49Å; I291-L295 HydrophobicContact CG2-CD1 4.2Å; I291-L295 HydrophobicContact CG2-CG 4.45Å; I291-L295 WeakPolarHBondContact O-CG 3.43Å; I291-L295 PolarHBondContact O-N 3.41Å |
| 292 | G | 89.4 | Confident | 86.9 | Confident | 4 Ų | 4 | 81.9 Ų | 81.9 | 4% | 0.041 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -54.8 | -47.8 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | F265 L288 L289 K294 L295 L296 | F265-G292 VanDerWaalsContact CZ-CA 3.46Å; L288-G292 WeakPolarHBondContact O-CA 3.34Å; L288-G292 PolarHBondContact O-N 3.07Å; L289-G292 PolarHBondContact O-N 2.89Å; G292-K294 VanDerWaalsContact C-N 3.32Å; G292-K294 PolarHBondContact O-N 3.48Å; G292-L295 WeakPolarHBondContact O-CB 3.47Å; G292-L295 PolarHBondContact O-N 3.19Å; G292-L295 VanDerWaalsContact O-N 3.13Å; G292-L296 WeakPolarHBondContact O-CD1 3.34Å; G292-L296 PolarHBondContact O-N 3.44Å |
| 293 | R | 87.4 | Confident | 86.7 | Confident | 152 Ų | 152 | 85.4 Ų | 85.4 | 57% | 0.574 | 41% | 0.405 | S | S | * | . | H | α-helix | trans | -61.3 | -38.8 | 174.6 | -173.4 | 174.7 | -171.7 | 177.5 | 3.3 | 112.2 | L289 I290 I291 L295 L296 D309 | L289-R293 WeakPolarHBondContact O-CB 3.24Å; L289-R293 PolarHBondContact O-N 3.31Å; I290-R293 PolarHBondContact O-N 2.92Å; I291-R293 PolarHBondContact O-N 2.98Å; R293-L295 VanDerWaalsContact C-N 3.34Å; R293-L296 WeakPolarHBondContact O-CB 3.34Å; R293-L296 PolarHBondContact O-N 2.91Å; R293-D309 IonicContact CZ-OD2 3.57Å; R293-D309 IonicContact NE-OD2 3.62Å; R293-D309 IonicContact NH2-OD2 2.78Å; R293-D309 PolarHBondContact NH2-OD2 2.81Å |
| 294 | K | 87.7 | Confident | 86.8 | Confident | 162 Ų | 162 | 84.9 Ų | 84.9 | 70% | 0.704 | 40% | 0.399 | S | S | * | . | H | α-helix | trans | -66.8 | -36.5 | 175.1 | -170 | 176.1 | 179.2 | -174.8 | 0 | 111.8 | I290 I291 G292 L296 K297 | I290-K294 PolarHBondContact O-N 2.94Å; I291-K294 CarbonylContact O-C 3.57Å; I291-K294 WeakPolarHBondContact O-CA 3.29Å; I291-K294 WeakPolarHBondContact O-CB 3.05Å; I291-K294 PolarHBondContact O-N 3.49Å; G292-K294 VanDerWaalsContact C-N 3.32Å; G292-K294 PolarHBondContact O-N 3.48Å; K294-L296 VanDerWaalsContact C-N 3.33Å; K294-K297 WeakPolarHBondContact O-CB 3.3Å; K294-K297 PolarHBondContact O-N 3.32Å |
| 295 | L | 88.9 | Confident | 86.7 | Confident | 103 Ų | 103 | 82.9 Ų | 82.9 | 54% | 0.539 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -67.7 | -31.3 | 174 | -69.2 | 171.6 | 0 | 0 | 0 | 112.1 | I291 G292 R293 K297 Y298 | I291-L295 HydrophobicContact CG2-CD1 4.2Å; I291-L295 HydrophobicContact CG2-CG 4.45Å; I291-L295 WeakPolarHBondContact O-CG 3.43Å; I291-L295 PolarHBondContact O-N 3.41Å; G292-L295 WeakPolarHBondContact O-CB 3.47Å; G292-L295 PolarHBondContact O-N 3.19Å; G292-L295 VanDerWaalsContact O-N 3.13Å; R293-L295 VanDerWaalsContact C-N 3.34Å; L295-K297 PolarHBondContact O-N 3.47Å; L295-Y298 VanDerWaalsContact O-CB 3.26Å; L295-Y298 WeakPolarHBondContact O-CB 3.49Å; L295-Y298 PolarHBondContact O-N 3.23Å |
| 296 | L | 88 | Confident | 86.5 | Confident | 18 Ų | 18 | 85.6 Ų | 85.6 | 9% | 0.094 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -58.3 | -32.3 | 172.9 | -97.5 | 76.2 | 0 | 0 | 0 | 112.7 | F258 T261 F265 G292 R293 K294 Y298 F299 F300 L305 | F258-L296 HydrophobicContact CD2-CD2 3.6Å; F258-L296 HydrophobicContact CE2-CD2 3.49Å; F258-L296 VanDerWaalsContact CE2-CD2 3.49Å; T261-L296 HydrophobicContact CG2-CD1 3.69Å; T261-L296 HydrophobicContact CG2-CG 4.46Å; F265-L296 HydrophobicContact CE2-CD1 3.98Å; G292-L296 WeakPolarHBondContact O-CD1 3.34Å; G292-L296 PolarHBondContact O-N 3.44Å; R293-L296 WeakPolarHBondContact O-CB 3.34Å; R293-L296 PolarHBondContact O-N 2.91Å; K294-L296 VanDerWaalsContact C-N 3.33Å; L296-Y298 PolarHBondContact O-N 3.46Å; L296-Y298 VanDerWaalsContact O-N 3.16Å; L296-F299 PolarHBondContact O-N 2.88Å; L296-F299 VanDerWaalsContact O-N 3.11Å; L296-F300 HydrophobicContact CG-CD2 4.35Å; L296-F300 PolarHBondContact O-N 3.49Å; L296-L305 HydrophobicContact CD2-CD1 4.25Å |
| 297 | K | 85.8 | Confident | 86.1 | Confident | 112 Ų | 112 | 84.1 Ų | 84.1 | 49% | 0.487 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -63.1 | -16.7 | 174.6 | -66.2 | -167.9 | 162.9 | -145.1 | 0 | 113.8 | K294 L295 F300 E302 L305 | K294-K297 WeakPolarHBondContact O-CB 3.3Å; K294-K297 PolarHBondContact O-N 3.32Å; L295-K297 PolarHBondContact O-N 3.47Å; K297-F300 CarbonylContact C-O 3.58Å; K297-F300 VanDerWaalsContact O-O 3.13Å; K297-E302 IonicContact NZ-OE1 2.85Å; K297-E302 PolarHBondContact NZ-OE1 2.91Å; K297-L305 HydrophobicContact CG-CD2 3.87Å |
| 298 | Y | 85.9 | Confident | 85.8 | Confident | 202 Ų | 202 | 83.4 Ų | 83.4 | 79% | 0.792 | 40% | 0.395 | S | S | * | . | H | α-helix | trans | -83.5 | -35 | 174.5 | -174.4 | -102.1 | 0 | 0 | 0 | 111.9 | L295 L296 | L295-Y298 VanDerWaalsContact O-CB 3.26Å; L295-Y298 WeakPolarHBondContact O-CB 3.49Å; L295-Y298 PolarHBondContact O-N 3.23Å; L296-Y298 PolarHBondContact O-N 3.46Å; L296-Y298 VanDerWaalsContact O-N 3.16Å |
| 299 | F | 86.2 | Confident | 85.4 | Confident | 139 Ų | 139 | 81.7 Ų | 81.7 | 61% | 0.61 | 39% | 0.386 | S | S | * | . | H | α-helix | trans | -86.2 | -31.6 | -179.4 | -71.7 | -81.9 | 0 | 0 | 0 | 113.4 | L296 | L296-F299 PolarHBondContact O-N 2.88Å; L296-F299 VanDerWaalsContact O-N 3.11Å |
| 300 | F | 86.6 | Confident | 84.8 | Confident | 9 Ų | 9 | 84.1 Ų | 84.1 | 4% | 0.039 | 40% | 0.4 | C | S | . | . | S | Bend | trans | -115.7 | 140.5 | -178.7 | -66.5 | -86.2 | 0 | 0 | 0 | 110.7 | R254 L257 F258 L296 K297 | R254-F300 HydrophobicContact CB-CE1 4.09Å; R254-F300 WeakPolarHBondContact O-CE1 3.4Å; L257-F300 HydrophobicContact CB-CZ 4.15Å; L257-F300 HydrophobicContact CD2-CE2 4.46Å; L257-F300 HydrophobicContact CD2-CZ 3.99Å; L257-F300 HydrophobicContact CG-CZ 4.01Å; F258-F300 HydrophobicContact CB-CE1 4.13Å; F258-F300 HydrophobicContact CB-CE2 4.26Å; F258-F300 HydrophobicContact CB-CZ 3.69Å; F258-F300 HydrophobicContact CD2-CE2 4.33Å; F258-F300 HydrophobicContact CD2-CZ 4.49Å; L296-F300 HydrophobicContact CG-CD2 4.35Å; L296-F300 PolarHBondContact O-N 3.49Å; K297-F300 CarbonylContact C-O 3.58Å; K297-F300 VanDerWaalsContact O-O 3.13Å |
| 301 | S | 84 | Confident | 83.9 | Confident | 69 Ų | 69 | 84 Ų | 84 | 48% | 0.483 | 41% | 0.407 | S | S | . | . | trans | -65 | 148.6 | 171.2 | -178.9 | 0 | 0 | 0 | 0 | 110.1 | K303 E304 L305 | S301-K303 PolarHBondContact O-N 3.36Å; S301-K303 VanDerWaalsContact O-N 3.13Å; S301-E304 PolarHBondContact N-OE2 2.93Å; S301-E304 WeakPolarHBondContact O-CB 3.26Å; S301-E304 PolarHBondContact O-N 3.22Å; S301-L305 PolarHBondContact O-N 3.04Å | ||
| 302 | E | 83.1 | Confident | 82.8 | Confident | 123 Ų | 123 | 82.2 Ų | 82.2 | 58% | 0.575 | 40% | 0.398 | S | S | * | . | H | α-helix | trans | -56.5 | -33.5 | -178.8 | -62.2 | -156.7 | 132.2 | 0 | 0 | 112.8 | K297 C306 | K297-E302 IonicContact NZ-OE1 2.85Å; K297-E302 PolarHBondContact NZ-OE1 2.91Å; E302-C306 WeakPolarHBondContact O-CB 3.27Å; E302-C306 PolarHBondContact O-N 3.35Å |
| 303 | K | 81.8 | Confident | 82 | Confident | 160 Ų | 160 | 84.8 Ų | 84.8 | 70% | 0.696 | 41% | 0.414 | S | S | * | . | H | α-helix | trans | -67.6 | -43.9 | 174.8 | -64.7 | -175.2 | -179.7 | -178.2 | 0 | 112.1 | S301 L305 C306 I307 | S301-K303 PolarHBondContact O-N 3.36Å; S301-K303 VanDerWaalsContact O-N 3.13Å; K303-L305 VanDerWaalsContact C-N 3.32Å; K303-C306 PolarHBondContact O-N 2.88Å; K303-I307 WeakPolarHBondContact O-CD1 3.46Å; K303-I307 VanDerWaalsContact O-CG1 3.24Å; K303-I307 WeakPolarHBondContact O-CG1 3.47Å; K303-I307 PolarHBondContact O-N 2.81Å |
| 304 | E | 85.2 | Confident | 81.2 | Confident | 34 Ų | 34 | 81.3 Ų | 81.3 | 16% | 0.159 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -63.9 | -40.9 | 177.7 | -60.6 | -177.3 | 150.8 | 0 | 0 | 111 | L250 R254 S301 I307 L308 | L250-E304 HydrophobicContact CD1-CB 4.48Å; L250-E304 HydrophobicContact CD2-CB 3.95Å; L250-E304 HydrophobicContact CD2-CG 3.62Å; R254-E304 WeakPolarHBondContact CD-OE1 3.13Å; R254-E304 IonicContact CZ-OE1 3.67Å; R254-E304 IonicContact CZ-OE2 3.38Å; R254-E304 IonicContact NE-OE1 4Å; R254-E304 PolarHBondContact NE-OE1 3.2Å; R254-E304 IonicContact NE-OE2 3.28Å; R254-E304 IonicContact NH1-OE1 2.77Å; R254-E304 PolarHBondContact NH1-OE1 2.87Å; R254-E304 IonicContact NH1-OE2 3.25Å; R254-E304 PolarHBondContact NH1-OE2 2.94Å; S301-E304 PolarHBondContact N-OE2 2.93Å; S301-E304 WeakPolarHBondContact O-CB 3.26Å; S301-E304 PolarHBondContact O-N 3.22Å; E304-I307 PolarHBondContact O-N 3.31Å; E304-L308 WeakPolarHBondContact O-CB 3.42Å; E304-L308 PolarHBondContact O-N 2.74Å |
| 305 | L | 83.9 | Confident | 80.5 | Confident | 10 Ų | 10 | 78.6 Ų | 78.6 | 5% | 0.052 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -66.7 | -42.4 | 178.3 | -172.4 | 64.1 | 0 | 0 | 0 | 111.7 | F258 L296 K297 S301 K303 L308 D309 | F258-L305 HydrophobicContact CD2-CD1 4.43Å; F258-L305 HydrophobicContact CE2-CD1 3.73Å; L296-L305 HydrophobicContact CD2-CD1 4.25Å; K297-L305 HydrophobicContact CG-CD2 3.87Å; S301-L305 PolarHBondContact O-N 3.04Å; K303-L305 VanDerWaalsContact C-N 3.32Å; L305-L308 PolarHBondContact O-N 3.27Å; L305-D309 WeakPolarHBondContact O-CB 3.23Å; L305-D309 PolarHBondContact O-N 3.41Å |
| 306 | C | 82.4 | Confident | 80 | Confident | 65 Ų | 65 | 81.8 Ų | 81.8 | 44% | 0.439 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -62 | -44.3 | 174.7 | 174.5 | 0 | 0 | 0 | 0 | 112 | E302 K303 L308 D310 | E302-C306 WeakPolarHBondContact O-CB 3.27Å; E302-C306 PolarHBondContact O-N 3.35Å; K303-C306 PolarHBondContact O-N 2.88Å; C306-L308 PolarHBondContact O-N 2.92Å; C306-L308 VanDerWaalsContact O-N 3.14Å; C306-D310 WeakPolarHBondContact O-CB 3.38Å; C306-D310 PolarHBondContact O-N 2.94Å; C306-D310 VanDerWaalsContact O-N 3.09Å; C306-D310 PolarHBondContact SG-OD2 3.17Å |
| 307 | I | 80 | Confident | 79.5 | Confident | 42 Ų | 42 | 85.5 Ų | 85.5 | 22% | 0.215 | 43% | 0.425 | C | S | . | . | H | α-helix | trans | -60.3 | -26.5 | 176.9 | -68.6 | 163.4 | 0 | 0 | 0 | 111.9 | L249 L250 K303 E304 L312 | L249-I307 HydrophobicContact CB-CD1 4.4Å; L249-I307 HydrophobicContact CB-CG2 4.36Å; L249-I307 HydrophobicContact CD1-CD1 4.2Å; L249-I307 HydrophobicContact CD1-CG1 4.42Å; L249-I307 HydrophobicContact CD1-CG2 3.95Å; L250-I307 HydrophobicContact CD1-CB 4.45Å; L250-I307 HydrophobicContact CD1-CG2 4.07Å; L250-I307 HydrophobicContact CG-CG2 4.38Å; K303-I307 WeakPolarHBondContact O-CD1 3.46Å; K303-I307 VanDerWaalsContact O-CG1 3.24Å; K303-I307 WeakPolarHBondContact O-CG1 3.47Å; K303-I307 PolarHBondContact O-N 2.81Å; E304-I307 PolarHBondContact O-N 3.31Å; I307-L312 HydrophobicContact CB-CD1 4.46Å; I307-L312 HydrophobicContact CG2-CD1 4.07Å; I307-L312 HydrophobicContact CG2-CD2 4.49Å; I307-L312 WeakPolarHBondContact O-CD1 3.24Å |
| 308 | L | 81.1 | Confident | 79.1 | Confident | 5 Ų | 5 | 83.3 Ų | 83.3 | 3% | 0.026 | 42% | 0.419 | C | S | . | . | H | α-helix | trans | -101.9 | -26.7 | -172.5 | -165.4 | 53.5 | 0 | 0 | 0 | 114 | R230 F258 E304 L305 C306 | R230-L308 PolarHBondContact NH1-O 3.07Å; F258-L308 HydrophobicContact CB-CD2 3.41Å; F258-L308 VanDerWaalsContact CB-CD2 3.41Å; F258-L308 HydrophobicContact CD1-CD1 4.15Å; F258-L308 HydrophobicContact CD1-CD2 3.13Å; F258-L308 HydrophobicContact CD1-CG 3.44Å; F258-L308 VanDerWaalsContact CD1-CG 3.44Å; F258-L308 HydrophobicContact CD2-CD2 3.67Å; F258-L308 HydrophobicContact CD2-CG 4.37Å; F258-L308 HydrophobicContact CE1-CB 4.41Å; F258-L308 HydrophobicContact CE1-CD1 4.24Å; F258-L308 HydrophobicContact CE1-CD2 3.62Å; F258-L308 HydrophobicContact CE1-CG 3.39Å; F258-L308 HydrophobicContact CE2-CD2 4.13Å; F258-L308 HydrophobicContact CE2-CG 4.36Å; F258-L308 HydrophobicContact CG-CD2 3.12Å; F258-L308 HydrophobicContact CG-CG 3.92Å; F258-L308 HydrophobicContact CZ-CB 4.48Å; F258-L308 HydrophobicContact CZ-CD2 4.1Å; F258-L308 HydrophobicContact CZ-CG 3.89Å; E304-L308 WeakPolarHBondContact O-CB 3.42Å; E304-L308 PolarHBondContact O-N 2.74Å; L305-L308 PolarHBondContact O-N 3.27Å; C306-L308 PolarHBondContact O-N 2.92Å; C306-L308 VanDerWaalsContact O-N 3.14Å |
| 309 | D | 80.2 | Confident | 78.8 | Confident | 52 Ų | 52 | 79.6 Ų | 79.6 | 28% | 0.278 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -82.7 | -40.7 | 175.6 | -81.9 | -6.6 | 0 | 0 | 0 | 112.1 | F258 R293 L305 | F258-D309 WeakPolarHBondContact CZ-OD1 3.27Å; R293-D309 IonicContact CZ-OD2 3.57Å; R293-D309 IonicContact NE-OD2 3.62Å; R293-D309 IonicContact NH2-OD2 2.78Å; R293-D309 PolarHBondContact NH2-OD2 2.81Å; L305-D309 WeakPolarHBondContact O-CB 3.23Å; L305-D309 PolarHBondContact O-N 3.41Å |
| 310 | D | 76 | Confident | 78.7 | Confident | 94 Ų | 94 | 78.9 Ų | 78.9 | 50% | 0.503 | 40% | 0.403 | S | S | . | . | S | Bend | trans | -86.1 | 142.7 | -174.5 | -67.5 | -37.6 | 0 | 0 | 0 | 112.1 | C306 L312 | C306-D310 WeakPolarHBondContact O-CB 3.38Å; C306-D310 PolarHBondContact O-N 2.94Å; C306-D310 VanDerWaalsContact O-N 3.09Å; C306-D310 PolarHBondContact SG-OD2 3.17Å; D310-L312 PolarHBondContact O-N 2.97Å |
| 311 | P | 69.1 | Low | 78.4 | Confident | 119 Ų | 119 | 79.9 Ų | 79.9 | 77% | 0.773 | 42% | 0.416 | S | S | * | . | trans | -67.6 | 103.1 | 172.1 | 27.7 | -32.5 | 0 | 0 | 0 | 109.8 | ||||
| 312 | L | 65.3 | Low | 78.3 | Confident | 52 Ų | 52 | 78.9 Ų | 78.9 | 27% | 0.272 | 41% | 0.412 | S | S | . | . | P | Polyproline II helix | trans | -68.9 | 139.7 | 174.9 | -88.7 | 88.4 | 0 | 0 | 0 | 111.4 | L249 I307 D310 | L249-L312 HydrophobicContact CD1-CD2 3.94Å; I307-L312 HydrophobicContact CB-CD1 4.46Å; I307-L312 HydrophobicContact CG2-CD1 4.07Å; I307-L312 HydrophobicContact CG2-CD2 4.49Å; I307-L312 WeakPolarHBondContact O-CD1 3.24Å; D310-L312 PolarHBondContact O-N 2.97Å |
| 313 | P | 72.9 | Confident | 78.4 | Confident | 58 Ų | 58 | 78.5 Ų | 78.5 | 38% | 0.377 | 41% | 0.41 | S | S | . | . | P | Polyproline II helix | trans | -62.1 | 152.2 | 170.6 | 26.5 | -33.2 | 0 | 0 | 0 | 111.1 | S245 L317 L318 | S245-P313 PolarHBondContact OG-O 3.38Å; S245-P313 VanDerWaalsContact OG-O 3.06Å; P313-L317 HydrophobicContact CB-CB 4.33Å; P313-L317 HydrophobicContact CB-CD1 4.36Å; P313-L318 HydrophobicContact CG-CD2 3.71Å; P313-L318 HydrophobicContact CG-CG 4.01Å |
| 314 | P | 71.7 | Confident | 78.5 | Confident | 79 Ų | 79 | 79.8 Ų | 79.8 | 51% | 0.513 | 41% | 0.41 | S | S | . | . | P | Polyproline II helix | trans | -58.3 | 144.9 | 177.1 | 18.8 | -30 | 0 | 0 | 0 | 111.5 | K316 L317 L318 | P314-K316 PolarHBondContact O-N 3.22Å; P314-L317 HydrophobicContact CG-CD1 3.79Å; P314-L317 HydrophobicContact CG-CG 4Å; P314-L317 WeakPolarHBondContact O-CB 3.41Å; P314-L317 PolarHBondContact O-N 3.09Å; P314-L318 PolarHBondContact O-N 3.33Å |
| 315 | W | 71.8 | Confident | 78.2 | Confident | 105 Ų | 105 | 84.3 Ų | 84.3 | 40% | 0.398 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -51.1 | -32.7 | -175 | -171.6 | -99.2 | 0 | 0 | 0 | 114.5 | S245 L317 L318 K319 | S245-W315 PolarHBondContact OG-N 2.99Å; W315-L317 VanDerWaalsContact C-N 3.27Å; W315-L317 PolarHBondContact O-N 2.87Å; W315-L318 HydrophobicContact CE3-CD1 4.18Å; W315-L318 PolarHBondContact O-N 3.13Å; W315-K319 WeakPolarHBondContact O-CB 3.45Å; W315-K319 PolarHBondContact O-N 3.41Å |
| 316 | K | 78.7 | Confident | 78.1 | Confident | 170 Ų | 170 | 88 Ų | 88 | 74% | 0.739 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -60.7 | -35.5 | 176 | -65.2 | -179.7 | -177.6 | 175.6 | 0 | 112.4 | P314 K320 | P314-K316 PolarHBondContact O-N 3.22Å; K316-K320 WeakPolarHBondContact O-CB 3.46Å; K316-K320 VanDerWaalsContact O-CG 3.25Å; K316-K320 WeakPolarHBondContact O-CG 3.26Å; K316-K320 PolarHBondContact O-N 3.13Å; K316-K320 VanDerWaalsContact O-N 3.1Å |
| 317 | L | 77.8 | Confident | 78.1 | Confident | 97 Ų | 97 | 87.1 Ų | 87.1 | 51% | 0.508 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -77 | -39.6 | 177.4 | -63.7 | -178 | 0 | 0 | 0 | 111.6 | P313 P314 W315 K319 K320 G321 | P313-L317 HydrophobicContact CB-CB 4.33Å; P313-L317 HydrophobicContact CB-CD1 4.36Å; P314-L317 HydrophobicContact CG-CD1 3.79Å; P314-L317 HydrophobicContact CG-CG 4Å; P314-L317 WeakPolarHBondContact O-CB 3.41Å; P314-L317 PolarHBondContact O-N 3.09Å; W315-L317 VanDerWaalsContact C-N 3.27Å; W315-L317 PolarHBondContact O-N 2.87Å; L317-K319 PolarHBondContact O-N 3.31Å; L317-K320 PolarHBondContact O-N 3.2Å; L317-G321 PolarHBondContact O-N 3.05Å |
| 318 | L | 77.7 | Confident | 78.1 | Confident | 66 Ų | 66 | 89 Ų | 89 | 35% | 0.346 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -59.9 | -45.6 | 173.6 | -68.3 | 172 | 0 | 0 | 0 | 111.4 | P313 P314 W315 G321 A322 | P313-L318 HydrophobicContact CG-CD2 3.71Å; P313-L318 HydrophobicContact CG-CG 4.01Å; P314-L318 PolarHBondContact O-N 3.33Å; W315-L318 HydrophobicContact CE3-CD1 4.18Å; W315-L318 PolarHBondContact O-N 3.13Å; L318-G321 PolarHBondContact O-N 3.48Å; L318-A322 PolarHBondContact O-N 3.23Å |
| 319 | K | 80.1 | Confident | 78 | Confident | 123 Ų | 123 | 92.3 Ų | 92.3 | 54% | 0.535 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -64.2 | -42.6 | 176.5 | -169.9 | 178.9 | -178.6 | -177.9 | 0 | 112.2 | W315 L317 G321 A322 Q323 | W315-K319 WeakPolarHBondContact O-CB 3.45Å; W315-K319 PolarHBondContact O-N 3.41Å; L317-K319 PolarHBondContact O-N 3.31Å; K319-G321 VanDerWaalsContact C-N 3.34Å; K319-A322 PolarHBondContact O-N 3.32Å; K319-Q323 WeakPolarHBondContact O-CB 3.26Å; K319-Q323 VanDerWaalsContact O-CG 3.27Å; K319-Q323 WeakPolarHBondContact O-CG 3.36Å; K319-Q323 PolarHBondContact O-N 3.01Å |
| 320 | K | 84.3 | Confident | 78.1 | Confident | 125 Ų | 125 | 95.7 Ų | 95.7 | 54% | 0.543 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -64 | -38.3 | 175.5 | -79.9 | 179.3 | 178.5 | -172.8 | 0 | 112.1 | K316 L317 R324 | K316-K320 WeakPolarHBondContact O-CB 3.46Å; K316-K320 VanDerWaalsContact O-CG 3.25Å; K316-K320 WeakPolarHBondContact O-CG 3.26Å; K316-K320 PolarHBondContact O-N 3.13Å; K316-K320 VanDerWaalsContact O-N 3.1Å; L317-K320 PolarHBondContact O-N 3.2Å; K320-R324 WeakPolarHBondContact O-CG 3.19Å; K320-R324 PolarHBondContact O-N 3.23Å |
| 321 | G | 79.3 | Confident | 78.3 | Confident | 29 Ų | 29 | 97.5 Ų | 97.5 | 30% | 0.299 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -61.2 | -53.4 | 174 | 0 | 0 | 0 | 0 | 0 | 111.2 | L317 L318 K319 Q323 R324 E325 | L317-G321 PolarHBondContact O-N 3.05Å; L318-G321 PolarHBondContact O-N 3.48Å; K319-G321 VanDerWaalsContact C-N 3.34Å; G321-Q323 VanDerWaalsContact C-N 3.31Å; G321-Q323 PolarHBondContact O-N 3.41Å; G321-R324 WeakPolarHBondContact O-CA 3.25Å; G321-R324 WeakPolarHBondContact O-CB 3.44Å; G321-R324 PolarHBondContact O-N 3.34Å; G321-E325 PolarHBondContact O-N 2.95Å |
| 322 | A | 81.9 | Confident | 78.7 | Confident | 48 Ų | 48 | 95.1 Ų | 95.1 | 40% | 0.397 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -59.2 | -39.4 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | L318 K319 R324 E325 V326 | L318-A322 PolarHBondContact O-N 3.23Å; K319-A322 PolarHBondContact O-N 3.32Å; A322-R324 VanDerWaalsContact C-N 3.33Å; A322-R324 PolarHBondContact O-N 3.23Å; A322-E325 PolarHBondContact O-N 3.5Å; A322-V326 VanDerWaalsContact O-CG2 3.29Å; A322-V326 WeakPolarHBondContact O-CG2 3.43Å; A322-V326 PolarHBondContact O-N 3.45Å |
| 323 | Q | 85 | Confident | 79 | Confident | 115 Ų | 115 | 95.3 Ų | 95.3 | 54% | 0.537 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -65 | -36.1 | 174.6 | -76.5 | 179.5 | -45.1 | 0 | 0 | 112.8 | K319 G321 A327 | K319-Q323 WeakPolarHBondContact O-CB 3.26Å; K319-Q323 VanDerWaalsContact O-CG 3.27Å; K319-Q323 WeakPolarHBondContact O-CG 3.36Å; K319-Q323 PolarHBondContact O-N 3.01Å; G321-Q323 VanDerWaalsContact C-N 3.31Å; G321-Q323 PolarHBondContact O-N 3.41Å; Q323-A327 WeakPolarHBondContact O-CB 3.36Å; Q323-A327 PolarHBondContact O-N 3.33Å |
| 324 | R | 83.3 | Confident | 79.3 | Confident | 188 Ų | 188 | 98.7 Ų | 98.7 | 71% | 0.709 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -69.5 | -42.1 | 174.5 | -77.7 | 177 | 177.4 | 178.8 | -2.6 | 111.7 | K320 G321 A322 A327 V328 | K320-R324 WeakPolarHBondContact O-CG 3.19Å; K320-R324 PolarHBondContact O-N 3.23Å; G321-R324 WeakPolarHBondContact O-CA 3.25Å; G321-R324 WeakPolarHBondContact O-CB 3.44Å; G321-R324 PolarHBondContact O-N 3.34Å; A322-R324 VanDerWaalsContact C-N 3.33Å; A322-R324 PolarHBondContact O-N 3.23Å; R324-A327 PolarHBondContact O-N 3.41Å; R324-V328 WeakPolarHBondContact O-CB 3.38Å; R324-V328 VanDerWaalsContact O-CG2 3.23Å; R324-V328 WeakPolarHBondContact O-CG2 3.4Å; R324-V328 PolarHBondContact O-N 3.37Å |
| 325 | E | 79.8 | Confident | 79.4 | Confident | 129 Ų | 129 | 100 Ų | 100 | 60% | 0.603 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -60 | -47.7 | 175.9 | -72.4 | 174.1 | 171.1 | 0 | 0 | 110.9 | G321 A322 A327 V328 D329 | G321-E325 PolarHBondContact O-N 2.95Å; A322-E325 PolarHBondContact O-N 3.5Å; E325-A327 VanDerWaalsContact C-N 3.33Å; E325-A327 PolarHBondContact O-N 3.45Å; E325-V328 PolarHBondContact O-N 3.34Å; E325-D329 WeakPolarHBondContact O-CB 3.48Å; E325-D329 PolarHBondContact O-N 3.33Å |
| 326 | V | 82.2 | Confident | 79 | Confident | 87 Ų | 87 | 96.7 Ų | 96.7 | 53% | 0.527 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -60.5 | -41.9 | 175.3 | 173.9 | 0 | 0 | 0 | 0 | 111.7 | A322 D329 E330 | A322-V326 VanDerWaalsContact O-CG2 3.29Å; A322-V326 WeakPolarHBondContact O-CG2 3.43Å; A322-V326 PolarHBondContact O-N 3.45Å; V326-D329 PolarHBondContact O-N 2.97Å; V326-E330 VanDerWaalsContact O-CB 3.29Å; V326-E330 WeakPolarHBondContact O-CB 3.19Å; V326-E330 PolarHBondContact O-N 3.33Å |
| 327 | A | 82.4 | Confident | 78.1 | Confident | 46 Ų | 46 | 92.5 Ų | 92.5 | 38% | 0.38 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -65.9 | -38.8 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | Q323 R324 E325 E330 E331 | Q323-A327 WeakPolarHBondContact O-CB 3.36Å; Q323-A327 PolarHBondContact O-N 3.33Å; R324-A327 PolarHBondContact O-N 3.41Å; E325-A327 VanDerWaalsContact C-N 3.33Å; E325-A327 PolarHBondContact O-N 3.45Å; A327-E330 PolarHBondContact O-N 3.38Å; A327-E331 WeakPolarHBondContact O-CB 3.26Å; A327-E331 WeakPolarHBondContact O-CG 3.41Å; A327-E331 PolarHBondContact O-N 3.21Å |
| 328 | V | 80.4 | Confident | 77 | Confident | 81 Ų | 81 | 90.2 Ų | 90.2 | 49% | 0.491 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -68.7 | -41.1 | 176.3 | 170.4 | 0 | 0 | 0 | 0 | 110.9 | R324 E325 E330 E331 L332 | R324-V328 WeakPolarHBondContact O-CB 3.38Å; R324-V328 VanDerWaalsContact O-CG2 3.23Å; R324-V328 WeakPolarHBondContact O-CG2 3.4Å; R324-V328 PolarHBondContact O-N 3.37Å; E325-V328 PolarHBondContact O-N 3.34Å; V328-E330 VanDerWaalsContact C-N 3.32Å; V328-E330 PolarHBondContact O-N 3.01Å; V328-E331 PolarHBondContact O-N 3.19Å; V328-L332 VanDerWaalsContact O-CB 3.25Å; V328-L332 WeakPolarHBondContact O-CB 3.1Å; V328-L332 PolarHBondContact O-N 3.03Å |
| 329 | D | 77.6 | Confident | 75.8 | Confident | 76 Ų | 76 | 98.4 Ų | 98.4 | 41% | 0.406 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -63.1 | -39.7 | 174.7 | -75.2 | -20.2 | 0 | 0 | 0 | 111.2 | E325 V326 L332 A333 | E325-D329 WeakPolarHBondContact O-CB 3.48Å; E325-D329 PolarHBondContact O-N 3.33Å; V326-D329 PolarHBondContact O-N 2.97Å; D329-L332 PolarHBondContact O-N 3.27Å; D329-A333 VanDerWaalsContact O-CB 3.27Å; D329-A333 WeakPolarHBondContact O-CB 3.5Å; D329-A333 PolarHBondContact O-N 3.22Å |
| 330 | E | 83.3 | Confident | 74.6 | Confident | 123 Ų | 123 | 96.9 Ų | 96.9 | 58% | 0.575 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -68 | -42 | 176.1 | -167.3 | 168.8 | -163.3 | 0 | 0 | 111.7 | V326 A327 V328 A333 N334 | V326-E330 VanDerWaalsContact O-CB 3.29Å; V326-E330 WeakPolarHBondContact O-CB 3.19Å; V326-E330 PolarHBondContact O-N 3.33Å; A327-E330 PolarHBondContact O-N 3.38Å; V328-E330 VanDerWaalsContact C-N 3.32Å; V328-E330 PolarHBondContact O-N 3.01Å; E330-A333 PolarHBondContact O-N 3.35Å; E330-N334 WeakPolarHBondContact O-CB 3.41Å; E330-N334 PolarHBondContact O-N 3.46Å; E330-N334 PolarHBondContact O-ND2 3.13Å; E330-N334 VanDerWaalsContact O-ND2 3.14Å |
| 331 | E | 80.6 | Confident | 73.3 | Confident | 132 Ų | 132 | 96.2 Ų | 96.2 | 62% | 0.617 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -61.2 | -44.7 | 170.5 | -79.5 | -177.1 | 173.1 | 0 | 0 | 111.8 | A327 V328 N334 T335 | A327-E331 WeakPolarHBondContact O-CB 3.26Å; A327-E331 WeakPolarHBondContact O-CG 3.41Å; A327-E331 PolarHBondContact O-N 3.21Å; V328-E331 PolarHBondContact O-N 3.19Å; E331-N334 PolarHBondContact O-N 3.49Å; E331-T335 WeakPolarHBondContact O-CB 3.31Å; E331-T335 PolarHBondContact O-N 3.23Å; E331-T335 PolarHBondContact O-OG1 2.99Å |
| 332 | L | 75.8 | Confident | 72 | Confident | 69 Ų | 69 | 98 Ų | 98 | 36% | 0.361 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -66.5 | -38.9 | -179.7 | -170.9 | 67.7 | 0 | 0 | 0 | 111.9 | V328 D329 T335 L337 I338 | V328-L332 VanDerWaalsContact O-CB 3.25Å; V328-L332 WeakPolarHBondContact O-CB 3.1Å; V328-L332 PolarHBondContact O-N 3.03Å; D329-L332 PolarHBondContact O-N 3.27Å; L332-T335 PolarHBondContact O-N 2.97Å; L332-L337 HydrophobicContact CD1-CB 3.94Å; L332-L337 HydrophobicContact CD1-CD2 3.73Å; L332-L337 HydrophobicContact CD1-CG 4.47Å; L332-I338 HydrophobicContact CB-CD1 4.23Å; L332-I338 HydrophobicContact CB-CG1 4.48Å; L332-I338 HydrophobicContact CD2-CD1 4.02Å; L332-I338 HydrophobicContact CD2-CG1 3.99Å; L332-I338 HydrophobicContact CG-CD1 3.94Å; L332-I338 HydrophobicContact CG-CG1 3.74Å |
| 333 | A | 73.5 | Confident | 70.2 | Confident | 56 Ų | 56 | 101.5 Ų | 101.5 | 46% | 0.463 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -63.2 | -42.3 | 172.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | D329 E330 G336 I338 | D329-A333 VanDerWaalsContact O-CB 3.27Å; D329-A333 WeakPolarHBondContact O-CB 3.5Å; D329-A333 PolarHBondContact O-N 3.22Å; E330-A333 PolarHBondContact O-N 3.35Å; A333-G336 PolarHBondContact O-N 3.22Å; A333-I338 HydrophobicContact CB-CD1 4.06Å |
| 334 | N | 77.4 | Confident | 68.3 | Low | 129 Ų | 129 | 100 Ų | 100 | 69% | 0.69 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -71.2 | -31.2 | 178.6 | -71.9 | -24 | 0 | 0 | 0 | 113.1 | E330 E331 G336 | E330-N334 WeakPolarHBondContact O-CB 3.41Å; E330-N334 PolarHBondContact O-N 3.46Å; E330-N334 PolarHBondContact O-ND2 3.13Å; E330-N334 VanDerWaalsContact O-ND2 3.14Å; E331-N334 PolarHBondContact O-N 3.49Å; N334-G336 PolarHBondContact O-N 3.23Å |
| 335 | T | 74 | Confident | 66.6 | Low | 106 Ų | 106 | 95.9 Ų | 95.9 | 65% | 0.65 | 55% | 0.549 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -73.8 | -1.2 | 177.4 | -41.6 | 0 | 0 | 0 | 0 | 112.3 | E331 L332 L337 | E331-T335 WeakPolarHBondContact O-CB 3.31Å; E331-T335 PolarHBondContact O-N 3.23Å; E331-T335 PolarHBondContact O-OG1 2.99Å; L332-T335 PolarHBondContact O-N 2.97Å; T335-L337 PolarHBondContact O-N 3.27Å |
| 336 | G | 65.1 | Low | 64.7 | Low | 35 Ų | 35 | 98.7 Ų | 98.7 | 36% | 0.361 | 56% | 0.559 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 70.5 | -2.1 | 176.2 | 0 | 0 | 0 | 0 | 0 | 114.9 | A333 N334 I338 R339 S340 | A333-G336 PolarHBondContact O-N 3.22Å; N334-G336 PolarHBondContact O-N 3.23Å; G336-I338 VanDerWaalsContact C-N 3.26Å; G336-I338 PolarHBondContact O-N 3.19Å; G336-R339 PolarHBondContact O-N 3.33Å; G336-R339 VanDerWaalsContact O-N 3.11Å; G336-S340 PolarHBondContact O-N 2.9Å |
| 337 | L | 59 | Low | 62.5 | Low | 82 Ų | 82 | 102.6 Ų | 102.6 | 43% | 0.429 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -61.5 | -35.9 | -177.5 | -151.2 | 93.8 | 0 | 0 | 0 | 111.7 | L332 T335 R339 S340 I341 | L332-L337 HydrophobicContact CD1-CB 3.94Å; L332-L337 HydrophobicContact CD1-CD2 3.73Å; L332-L337 HydrophobicContact CD1-CG 4.47Å; T335-L337 PolarHBondContact O-N 3.27Å; L337-R339 VanDerWaalsContact C-N 3.33Å; L337-R339 PolarHBondContact O-N 3.16Å; L337-S340 WeakPolarHBondContact CA-OG 3.3Å; L337-S340 PolarHBondContact O-N 3.42Å; L337-S340 VanDerWaalsContact O-N 3.17Å; L337-S340 PolarHBondContact O-OG 3.47Å; L337-I341 HydrophobicContact CD2-CD1 3.97Å; L337-I341 HydrophobicContact CG-CD1 4.14Å; L337-I341 WeakPolarHBondContact O-CG1 3.43Å; L337-I341 PolarHBondContact O-N 3.01Å; L337-I341 VanDerWaalsContact O-N 3.1Å |
| 338 | I | 54.6 | Low | 60.4 | Low | 49 Ų | 49 | 106.3 Ų | 106.3 | 25% | 0.251 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -63.8 | -37.2 | 177.5 | -56.9 | -172.7 | 0 | 0 | 0 | 111.4 | L332 A333 G336 G342 L343 | L332-I338 HydrophobicContact CB-CD1 4.23Å; L332-I338 HydrophobicContact CB-CG1 4.48Å; L332-I338 HydrophobicContact CD2-CD1 4.02Å; L332-I338 HydrophobicContact CD2-CG1 3.99Å; L332-I338 HydrophobicContact CG-CD1 3.94Å; L332-I338 HydrophobicContact CG-CG1 3.74Å; A333-I338 HydrophobicContact CB-CD1 4.06Å; G336-I338 VanDerWaalsContact C-N 3.26Å; G336-I338 PolarHBondContact O-N 3.19Å; I338-G342 PolarHBondContact O-N 3.14Å; I338-G342 VanDerWaalsContact O-N 3.16Å; I338-L343 WeakPolarHBondContact CG2-O 3.48Å |
| 339 | R | 52 | Low | 58.3 | Low | 239 Ų | 239 | 111.2 Ų | 111.2 | 90% | 0.902 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -70.2 | -33.6 | 174.5 | -101 | -176.5 | -176.8 | 173.2 | 2.5 | 112.4 | G336 L337 | G336-R339 PolarHBondContact O-N 3.33Å; G336-R339 VanDerWaalsContact O-N 3.11Å; L337-R339 VanDerWaalsContact C-N 3.33Å; L337-R339 PolarHBondContact O-N 3.16Å |
| 340 | S | 55.3 | Low | 56 | Low | 91 Ų | 91 | 115 Ų | 115 | 64% | 0.636 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -73.6 | -27.2 | 177.6 | 59 | 0 | 0 | 0 | 0 | 114.2 | G336 L337 | G336-S340 PolarHBondContact O-N 2.9Å; L337-S340 WeakPolarHBondContact CA-OG 3.3Å; L337-S340 PolarHBondContact O-N 3.42Å; L337-S340 VanDerWaalsContact O-N 3.17Å; L337-S340 PolarHBondContact O-OG 3.47Å |
| 341 | I | 57.8 | Low | 53.3 | Low | 111 Ų | 111 | 121.7 Ų | 121.7 | 57% | 0.569 | 65% | 0.651 | S | S | * | * | H | α-helix | trans | -95.8 | -6 | -179.6 | -58.8 | 170.7 | 0 | 0 | 0 | 111.5 | L337 L343 | L337-I341 HydrophobicContact CD2-CD1 3.97Å; L337-I341 HydrophobicContact CG-CD1 4.14Å; L337-I341 WeakPolarHBondContact O-CG1 3.43Å; L337-I341 PolarHBondContact O-N 3.01Å; L337-I341 VanDerWaalsContact O-N 3.1Å; I341-L343 VanDerWaalsContact C-N 3.3Å; I341-L343 HydrophobicContact CG2-CD1 4.03Å; I341-L343 PolarHBondContact O-N 2.97Å |
| 342 | G | 52.1 | Low | 52 | Low | 67 Ų | 67 | 121.2 Ų | 121.2 | 69% | 0.691 | 65% | 0.652 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 73.1 | 15.8 | 171 | 0 | 0 | 0 | 0 | 0 | 115.1 | I338 | I338-G342 PolarHBondContact O-N 3.14Å; I338-G342 VanDerWaalsContact O-N 3.16Å |
| 343 | L | 43.4 | Very low | 50.7 | Low | 120 Ų | 120 | 123.9 Ų | 123.9 | 63% | 0.628 | 67% | 0.668 | S | S | * | * | trans | -90.7 | 121.4 | 177.2 | -76.3 | 161.7 | 0 | 0 | 0 | 110.3 | I338 I341 | I338-L343 WeakPolarHBondContact CG2-O 3.48Å; I341-L343 VanDerWaalsContact C-N 3.3Å; I341-L343 HydrophobicContact CG2-CD1 4.03Å; I341-L343 PolarHBondContact O-N 2.97Å | ||
| 344 | S | 44.8 | Very low | 49.4 | Very low | 85 Ų | 85 | 127.7 Ų | 127.7 | 59% | 0.594 | 68% | 0.679 | S | S | * | * | trans | -80.7 | 132.3 | 177 | -175.4 | 0 | 0 | 0 | 0 | 110.6 | K346 E347 | S344-K346 PolarHBondContact O-N 3.15Å; S344-E347 PolarHBondContact O-N 3.27Å | ||
| 345 | S | 47.1 | Very low | 47.8 | Very low | 100 Ų | 100 | 127.6 Ų | 127.6 | 70% | 0.699 | 68% | 0.678 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -52.9 | -6.5 | -175.3 | 176.1 | 0 | 0 | 0 | 0 | 116.5 | ||
| 346 | K | 39.9 | Very low | 46.2 | Very low | 188 Ų | 188 | 128.9 Ų | 128.9 | 82% | 0.817 | 68% | 0.68 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -104.5 | -10.4 | -172.1 | -76.7 | -171.3 | 174.9 | -177.7 | 0 | 115.8 | S344 | S344-K346 PolarHBondContact O-N 3.15Š|
| 347 | E | 36.8 | Very low | 44.9 | Very low | 170 Ų | 170 | 135.2 Ų | 135.2 | 79% | 0.794 | 70% | 0.701 | S | S | * | * | S | Bend | trans | -91.7 | -3.2 | -172.1 | -77.7 | -175.1 | 157.5 | 0 | 0 | 116 | S344 | S344-E347 PolarHBondContact O-N 3.27Š|
| 348 | T | 38.2 | Very low | 43.9 | Very low | 124 Ų | 124 | 139 Ų | 139 | 76% | 0.761 | 72% | 0.721 | S | S | * | * | S | Bend | trans | -93.9 | 0.6 | -173.4 | 6.6 | 0 | 0 | 0 | 0 | 117.2 | ||
| 349 | Y | 35 | Very low | 43.1 | Very low | 183 Ų | 183 | 145.9 Ų | 145.9 | 72% | 0.718 | 76% | 0.757 | S | S | * | * | S | Bend | trans | -101.8 | 4.2 | -172.7 | -80.8 | -78.7 | 0 | 0 | 0 | 116.8 | ||
| 350 | I | 29.5 | Very low | 42.3 | Very low | 157 Ų | 157 | 138.2 Ų | 138.2 | 81% | 0.805 | 75% | 0.745 | S | S | * | * | trans | -140.3 | 81.6 | 177.9 | -47.2 | 177.2 | 0 | 0 | 0 | 110.6 | ||||
| 351 | Q | 27.9 | Very low | 41.1 | Very low | 262 Ų | 262 | 142.5 Ų | 142.5 | 100% | 1.224 | 76% | 0.755 | S | S | * | * | trans | -156 | 0 | 145.4 | -108.2 | 172.6 | 16.4 | 0 | 0 | 110.7 |
Retrieved 351 of 351 residues in 402.3 ms
(Link to these results)