| 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 | F | 30.6 | Very low | 30.6 | Very low | 258 Ų | 258 | 142.5 Ų | 142.5 | 100% | 1.132 | 79% | 0.79 | S | S | * | * | 0 | 110.9 | 0 | -67.4 | -82.5 | 0 | 0 | 0 | 107.5 | |||||
| 2 | P | 30.3 | Very low | 31.1 | Very low | 129 Ų | 129 | 140.7 Ų | 140.7 | 84% | 0.838 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -71.3 | 144.9 | -178.1 | 26.5 | -23.2 | 0 | 0 | 0 | 109.8 | ||
| 3 | A | 30.3 | Very low | 31.4 | Very low | 89 Ų | 89 | 138.5 Ų | 138.5 | 74% | 0.736 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -64.5 | 141.8 | 176.8 | 0 | 0 | 0 | 0 | 0 | 110.2 | E5 | A3-E5 PolarHBondContact O-N 3.21Š|
| 4 | P | 32.5 | Very low | 31.8 | Very low | 124 Ų | 124 | 136.7 Ų | 136.7 | 81% | 0.805 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -71.4 | 118.1 | 175 | 26.7 | -28 | 0 | 0 | 0 | 109.6 | ||
| 5 | E | 30.5 | Very low | 32.2 | Very low | 163 Ų | 163 | 134.3 Ų | 134.3 | 76% | 0.762 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -64.8 | 124.9 | 165.8 | -74.4 | 179.2 | 152.1 | 0 | 0 | 109.4 | A3 Y7 | A3-E5 PolarHBondContact O-N 3.21Å; E5-Y7 PolarHBondContact O-N 2.87Å |
| 6 | V | 29.7 | Very low | 33 | Very low | 128 Ų | 128 | 132.6 Ų | 132.6 | 78% | 0.776 | 77% | 0.769 | S | S | * | * | trans | -85.1 | 104.8 | 173.3 | 177 | 0 | 0 | 0 | 0 | 107.9 | V8 | V6-V8 HydrophobicContact CG1-CG2 4.36Å; V6-V8 PolarHBondContact O-N 3.25Å | ||
| 7 | Y | 25.3 | Very low | 34.1 | Very low | 206 Ų | 206 | 133.3 Ų | 133.3 | 81% | 0.808 | 76% | 0.763 | S | S | * | * | trans | -73.4 | 108.4 | 164.3 | -85.1 | -91 | 0 | 0 | 0 | 109.1 | E5 N9 | E5-Y7 PolarHBondContact O-N 2.87Å; Y7-N9 PolarHBondContact O-N 3.14Å | ||
| 8 | V | 30.9 | Very low | 35 | Very low | 119 Ų | 119 | 134.9 Ų | 134.9 | 72% | 0.721 | 76% | 0.763 | S | S | * | * | trans | -77.3 | 100.4 | 167.8 | -179.3 | 0 | 0 | 0 | 0 | 107.4 | V6 T10 | V6-V8 HydrophobicContact CG1-CG2 4.36Å; V6-V8 PolarHBondContact O-N 3.25Å; V8-T10 PolarHBondContact O-N 3.31Å | ||
| 9 | N | 24.5 | Very low | 36.5 | Very low | 141 Ų | 141 | 130.5 Ų | 130.5 | 75% | 0.754 | 74% | 0.741 | S | S | * | * | trans | -75.7 | 106.9 | 175.4 | -142.3 | 13.9 | 0 | 0 | 0 | 108.7 | Y7 S11 | Y7-N9 PolarHBondContact O-N 3.14Å; N9-S11 PolarHBondContact O-N 3.41Å | ||
| 10 | T | 36.5 | Very low | 37.6 | Very low | 130 Ų | 130 | 132.4 Ų | 132.4 | 80% | 0.798 | 74% | 0.743 | S | S | * | * | trans | -79.7 | 41.4 | -175.3 | 28.1 | 0 | 0 | 0 | 0 | 113.9 | V8 | V8-T10 PolarHBondContact O-N 3.31Š| ||
| 11 | S | 35.9 | Very low | 39 | Very low | 81 Ų | 81 | 133.2 Ų | 133.2 | 57% | 0.566 | 75% | 0.745 | S | S | * | * | S | Bend | trans | -133.3 | 122.7 | 174.6 | -2.2 | 0 | 0 | 0 | 0 | 110.4 | N9 | N9-S11 PolarHBondContact O-N 3.41Š|
| 12 | S | 36.3 | Very low | 40.4 | Very low | 120 Ų | 120 | 126.1 Ų | 126.1 | 84% | 0.839 | 71% | 0.711 | S | S | * | * | trans | 67.2 | 69.3 | -178.3 | 65.2 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 13 | V | 34.6 | Very low | 42 | Very low | 113 Ų | 113 | 125 Ų | 125 | 69% | 0.685 | 70% | 0.702 | S | S | * | * | trans | -80.7 | 116.6 | 154.8 | 177.2 | 0 | 0 | 0 | 0 | 107 | S15 V16 | V13-S15 PolarHBondContact O-N 2.89Å; V13-V16 HydrophobicContact CG1-CG2 4.09Å | ||
| 14 | P | 37.3 | Very low | 43.7 | Very low | 113 Ų | 113 | 125 Ų | 125 | 73% | 0.734 | 69% | 0.694 | S | S | * | * | trans | -60.2 | 133.5 | 166.4 | -10 | 24.5 | 0 | 0 | 0 | 107.5 | V16 | P14-V16 PolarHBondContact O-N 3.37Š| ||
| 15 | S | 37.2 | Very low | 45.6 | Very low | 101 Ų | 101 | 122.9 Ų | 122.9 | 71% | 0.706 | 68% | 0.679 | S | S | * | * | trans | -39.3 | 101.6 | -177.3 | 47.6 | 0 | 0 | 0 | 0 | 113.2 | V13 H17 | V13-S15 PolarHBondContact O-N 2.89Å; S15-H17 PolarHBondContact O-N 3.11Å | ||
| 16 | V | 45.3 | Very low | 47.7 | Very low | 107 Ų | 107 | 119.1 Ų | 119.1 | 65% | 0.648 | 67% | 0.67 | S | S | * | * | trans | -66 | 105.6 | 164.1 | 178.4 | 0 | 0 | 0 | 0 | 105.8 | V13 P14 H18 | V13-V16 HydrophobicContact CG1-CG2 4.09Å; P14-V16 PolarHBondContact O-N 3.37Å; V16-H18 PolarHBondContact O-N 2.91Å | ||
| 17 | H | 51.7 | Low | 50.3 | Low | 144 Ų | 144 | 114.4 Ų | 114.4 | 67% | 0.667 | 64% | 0.64 | S | S | * | * | trans | -57.2 | 110 | 172.4 | -85.2 | -74.6 | 0 | 0 | 0 | 108.8 | S15 C19 | S15-H17 PolarHBondContact O-N 3.11Å; H17-C19 PolarHBondContact O-N 2.86Å | ||
| 18 | H | 51.2 | Low | 53.3 | Low | 163 Ų | 163 | 106.6 Ų | 106.6 | 76% | 0.755 | 61% | 0.614 | S | S | * | * | trans | -71.3 | 100.3 | 174.5 | -88.1 | -49.9 | 0 | 0 | 0 | 109.7 | V16 Q20 | V16-H18 PolarHBondContact O-N 2.91Å; H18-Q20 VanDerWaalsContact C-N 3.28Å; H18-Q20 PolarHBondContact O-N 3.19Å | ||
| 19 | C | 63 | Low | 56.1 | Low | 51 Ų | 51 | 105.8 Ų | 105.8 | 35% | 0.345 | 61% | 0.61 | S | S | . | * | trans | -76.7 | 72 | 175.5 | -51.9 | 0 | 0 | 0 | 0 | 111 | H17 D21 W22 C274 | H17-C19 PolarHBondContact O-N 2.86Å; C19-D21 VanDerWaalsContact C-N 3.33Å; C19-D21 PolarHBondContact O-N 3.2Å; C19-W22 HydrophobicContact CB-CB 4.45Å; C19-C274 HydrophobicContact CB-CB 3.73Å; C19-C274 WeakPolarHBondContact CB-SG 3.47Å; C19-C274 WeakPolarHBondContact SG-CA 3.17Å; C19-C274 WeakPolarHBondContact SG-CB 3.4Å; C19-C274 CovalentContact SG-SG 2.03Å; C19-C274 PolarHBondContact SG-SG 3.24Å | ||
| 20 | Q | 59.5 | Low | 59.3 | Low | 167 Ų | 167 | 102.5 Ų | 102.5 | 78% | 0.78 | 60% | 0.595 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67 | -27.3 | -174.9 | -83.2 | 175.4 | -32.7 | 0 | 0 | 114.4 | H18 W22 | H18-Q20 VanDerWaalsContact C-N 3.28Å; H18-Q20 PolarHBondContact O-N 3.19Å; Q20-W22 VanDerWaalsContact C-N 3.34Å; Q20-W22 PolarHBondContact O-N 3.24Å |
| 21 | D | 66.8 | Low | 62 | Low | 150 Ų | 150 | 96.3 Ų | 96.3 | 80% | 0.802 | 56% | 0.557 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.3 | -6.4 | -176.4 | -59.3 | -38.6 | 0 | 0 | 0 | 114.3 | C19 | C19-D21 VanDerWaalsContact C-N 3.33Å; C19-D21 PolarHBondContact O-N 3.2Å |
| 22 | W | 59 | Low | 64.9 | Low | 110 Ų | 110 | 93.1 Ų | 93.1 | 42% | 0.417 | 53% | 0.534 | S | S | . | . | trans | -114.1 | 63.8 | -168.7 | -67.8 | 93.9 | 0 | 0 | 0 | 111.4 | C19 Q20 W275 W278 | C19-W22 HydrophobicContact CB-CB 4.45Å; Q20-W22 VanDerWaalsContact C-N 3.34Å; Q20-W22 PolarHBondContact O-N 3.24Å; W22-W275 HydrophobicContact CH2-CB 4.47Å; W22-W275 HydrophobicContact CZ2-CB 4.38Å; W22-W278 HydrophobicContact CB-CB 4.07Å; W22-W278 HydrophobicContact CB-CG 4.02Å; W22-W278 HydrophobicContact CD2-CB 4.09Å; W22-W278 HydrophobicContact CD2-CG 4.01Å; W22-W278 HydrophobicContact CE3-CB 3.7Å; W22-W278 AromaticContact CE3-CD1 3.58Å; W22-W278 AromaticContact CE3-CD2 3.36Å; W22-W278 HydrophobicContact CE3-CD2 3.36Å; W22-W278 AromaticContact CE3-CE2 3.76Å; W22-W278 AromaticContact CE3-CE3 3.93Å; W22-W278 HydrophobicContact CE3-CE3 3.93Å; W22-W278 AromaticContact CE3-CG 3.24Å; W22-W278 HydrophobicContact CE3-CG 3.24Å; W22-W278 AromaticContact CE3-NE1 3.82Å; W22-W278 HydrophobicContact CG-CB 4.3Å; W22-W278 HydrophobicContact CG-CG 4.36Å; W22-W278 HydrophobicContact CZ3-CB 4.41Å; W22-W278 AromaticContact CZ3-CD2 3.64Å; W22-W278 HydrophobicContact CZ3-CD2 3.64Å; W22-W278 AromaticContact CZ3-CE3 3.7Å; W22-W278 HydrophobicContact CZ3-CE3 3.7Å; W22-W278 AromaticContact CZ3-CG 3.98Å; W22-W278 HydrophobicContact CZ3-CG 3.98Å; W22-W278 HydrophobicContact CZ3-CZ3 4.23Å | ||
| 23 | V | 63.9 | Low | 67.7 | Low | 106 Ų | 106 | 91.1 Ų | 91.1 | 64% | 0.642 | 52% | 0.517 | S | S | * | . | P | Polyproline II helix | trans | -68 | 131 | -178.3 | -175.4 | 0 | 0 | 0 | 0 | 110.7 | W278 | V23-W278 PolarHBondContact O-NE1 2.9Š|
| 24 | P | 65.3 | Low | 70.6 | Confident | 87 Ų | 87 | 88.4 Ų | 88.4 | 57% | 0.565 | 50% | 0.498 | S | S | * | . | P | Polyproline II helix | trans | -64 | 134.5 | 172.8 | -18.3 | 30.2 | 0 | 0 | 0 | 111.3 | T281 | P24-T281 HydrophobicContact CB-CG2 4.39Š|
| 25 | V | 72.7 | Confident | 73.4 | Confident | 80 Ų | 80 | 83.2 Ų | 83.2 | 49% | 0.485 | 46% | 0.464 | S | S | . | . | P | Polyproline II helix | trans | -87.7 | 122.9 | 177.8 | -179.3 | 0 | 0 | 0 | 0 | 109.4 | M27 N282 | V25-M27 HydrophobicContact CB-CE 3.89Å; V25-M27 HydrophobicContact CG1-CE 3.67Å; V25-M27 HydrophobicContact CG1-SD 4.05Å; V25-M27 PolarHBondContact O-N 3.48Å; V25-N282 PolarHBondContact N-OD1 3.08Å |
| 26 | S | 74.8 | Confident | 76.2 | Confident | 84 Ų | 84 | 81.2 Ų | 81.2 | 59% | 0.587 | 45% | 0.45 | S | S | * | . | P | Polyproline II helix | trans | -70.5 | 123.5 | 174.9 | 89.9 | 0 | 0 | 0 | 0 | 109.9 | ||
| 27 | M | 84.7 | Confident | 78.6 | Confident | 29 Ų | 29 | 79.9 Ų | 79.9 | 14% | 0.143 | 44% | 0.442 | C | S | . | . | trans | -108.4 | 35.5 | -174.3 | -65.1 | -66.8 | -173.9 | 0 | 0 | 112.4 | V25 T29 I31 Y93 L286 | V25-M27 HydrophobicContact CB-CE 3.89Å; V25-M27 HydrophobicContact CG1-CE 3.67Å; V25-M27 HydrophobicContact CG1-SD 4.05Å; V25-M27 PolarHBondContact O-N 3.48Å; M27-T29 VanDerWaalsContact C-N 3.25Å; M27-T29 PolarHBondContact O-N 3.23Å; M27-I31 HydrophobicContact CB-CD1 3.29Å; M27-I31 HydrophobicContact CB-CG1 3.78Å; M27-I31 HydrophobicContact CG-CD1 4.14Å; M27-I31 PolarHBondContact O-N 3.07Å; M27-Y93 PolarHBondContact N-OH 3.47Å; M27-L286 HydrophobicContact CE-CD1 4.25Å; M27-L286 HydrophobicContact CE-CD2 4.48Å | ||
| 28 | T | 88.1 | Confident | 80.8 | Confident | 42 Ų | 42 | 73.4 Ų | 73.4 | 26% | 0.258 | 41% | 0.412 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -69.7 | -16.1 | -172 | 55.9 | 0 | 0 | 0 | 0 | 114.2 | P32 Y89 S90 Y93 | T28-P32 WeakPolarHBondContact O-CD 3.38Å; T28-P32 VanDerWaalsContact O-CG 3.23Å; T28-P32 WeakPolarHBondContact O-CG 3.43Å; T28-Y89 WeakPolarHBondContact CA-O 3.37Å; T28-Y89 WeakPolarHBondContact CB-O 3.36Å; T28-Y89 WeakPolarHBondContact CG2-O 3.18Å; T28-S90 WeakPolarHBondContact O-CA 3.28Å; T28-Y93 HydrophobicContact CG2-CE2 4.25Å |
| 29 | T | 89.9 | Confident | 83 | Confident | 102 Ų | 102 | 66.6 Ų | 66.6 | 63% | 0.626 | 38% | 0.382 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -107 | -43.3 | 176.3 | -53.1 | 0 | 0 | 0 | 0 | 112.5 | M27 T33 | M27-T29 VanDerWaalsContact C-N 3.25Å; M27-T29 PolarHBondContact O-N 3.23Å; T29-T33 WeakPolarHBondContact O-CB 3.14Å; T29-T33 PolarHBondContact O-N 3.42Å; T29-T33 PolarHBondContact O-OG1 2.96Å |
| 30 | V | 92 | Very high | 84.5 | Confident | 73 Ų | 73 | 68.1 Ų | 68.1 | 44% | 0.442 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -67.5 | -49.1 | -173.4 | 176.4 | 0 | 0 | 0 | 0 | 111.3 | T33 I34 | V30-T33 PolarHBondContact O-N 3.06Å; V30-I34 HydrophobicContact CG1-CD1 3.79Å; V30-I34 WeakPolarHBondContact O-CG1 3.44Å; V30-I34 PolarHBondContact O-N 2.82Å |
| 31 | I | 93.7 | Very high | 86.2 | Confident | 0 Ų | 0 | 65.2 Ų | 65.2 | 0% | 0 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -65 | -48.6 | -177 | -66 | 164.5 | 0 | 0 | 0 | 111.7 | M27 T33 I34 Y35 Y89 P285 | M27-I31 HydrophobicContact CB-CD1 3.29Å; M27-I31 HydrophobicContact CB-CG1 3.78Å; M27-I31 HydrophobicContact CG-CD1 4.14Å; M27-I31 PolarHBondContact O-N 3.07Å; I31-T33 VanDerWaalsContact C-N 3.26Å; I31-T33 PolarHBondContact O-N 3.49Å; I31-I34 PolarHBondContact O-N 3.28Å; I31-Y35 HydrophobicContact CG2-CD1 4.17Å; I31-Y35 HydrophobicContact CG2-CD2 3.98Å; I31-Y35 HydrophobicContact CG2-CE1 3.83Å; I31-Y35 HydrophobicContact CG2-CE2 3.63Å; I31-Y35 HydrophobicContact CG2-CG 4.23Å; I31-Y35 PolarHBondContact O-N 3.25Å; I31-Y89 HydrophobicContact CB-CD1 4.21Å; I31-Y89 HydrophobicContact CB-CG 4.15Å; I31-Y89 HydrophobicContact CD1-CD1 3.58Å; I31-Y89 HydrophobicContact CD1-CE1 3.41Å; I31-Y89 VanDerWaalsContact CD1-CE1 3.41Å; I31-Y89 HydrophobicContact CD1-CG 4.33Å; I31-Y89 HydrophobicContact CG2-CD1 4.02Å; I31-Y89 HydrophobicContact CG2-CD2 3.55Å; I31-Y89 HydrophobicContact CG2-CE1 4.22Å; I31-Y89 HydrophobicContact CG2-CE2 3.82Å; I31-Y89 HydrophobicContact CG2-CG 3.68Å; I31-P285 HydrophobicContact CD1-CB 3.52Å; I31-P285 HydrophobicContact CD1-CG 4.32Å; I31-P285 HydrophobicContact CG1-CB 4.5Å |
| 32 | P | 95.3 | Very high | 87.5 | Confident | 13 Ų | 13 | 58 Ų | 58 | 8% | 0.084 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -59.5 | -37 | 177.3 | -29.2 | 39.7 | 0 | 0 | 0 | 113.4 | T28 Y35 S36 A86 | T28-P32 WeakPolarHBondContact O-CD 3.38Å; T28-P32 VanDerWaalsContact O-CG 3.23Å; T28-P32 WeakPolarHBondContact O-CG 3.43Å; P32-Y35 PolarHBondContact O-N 3.42Å; P32-S36 WeakPolarHBondContact O-CB 3.26Å; P32-S36 PolarHBondContact O-N 3.38Å; P32-S36 PolarHBondContact O-OG 3Å; P32-A86 HydrophobicContact CB-CB 4.04Å; P32-A86 VanDerWaalsContact CG-O 3.3Å; P32-A86 WeakPolarHBondContact CG-O 3.15Å |
| 33 | T | 95.2 | Very high | 89.2 | Confident | 78 Ų | 78 | 54.6 Ų | 54.6 | 48% | 0.479 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -61.8 | -48.8 | 176.1 | -57.3 | 0 | 0 | 0 | 0 | 110.5 | T29 V30 I31 S36 V37 | T29-T33 WeakPolarHBondContact O-CB 3.14Å; T29-T33 PolarHBondContact O-N 3.42Å; T29-T33 PolarHBondContact O-OG1 2.96Å; V30-T33 PolarHBondContact O-N 3.06Å; I31-T33 VanDerWaalsContact C-N 3.26Å; I31-T33 PolarHBondContact O-N 3.49Å; T33-S36 PolarHBondContact O-N 3.4Å; T33-V37 WeakPolarHBondContact O-CG2 3.48Å; T33-V37 PolarHBondContact O-N 3.32Å |
| 34 | I | 95.9 | Very high | 90.6 | Very high | 56 Ų | 56 | 55 Ų | 55 | 29% | 0.287 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -62.7 | -46.3 | 178.4 | -64.8 | 165.9 | 0 | 0 | 0 | 111 | V30 I31 S36 V37 I38 C289 | V30-I34 HydrophobicContact CG1-CD1 3.79Å; V30-I34 WeakPolarHBondContact O-CG1 3.44Å; V30-I34 PolarHBondContact O-N 2.82Å; I31-I34 PolarHBondContact O-N 3.28Å; I34-S36 VanDerWaalsContact C-N 3.29Å; I34-S36 PolarHBondContact O-N 3.37Å; I34-V37 PolarHBondContact O-N 2.69Å; I34-I38 HydrophobicContact CG2-CD1 3.61Å; I34-I38 HydrophobicContact CG2-CG1 4.23Å; I34-I38 VanDerWaalsContact O-CG1 3.29Å; I34-I38 WeakPolarHBondContact O-CG1 3.39Å; I34-I38 PolarHBondContact O-N 2.78Å; I34-C289 HydrophobicContact CD1-CB 4.38Å; I34-C289 HydrophobicContact CG2-CB 3.85Å |
| 35 | Y | 96.4 | Very high | 91.8 | Very high | 4 Ų | 4 | 51.7 Ų | 51.7 | 2% | 0.016 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -61.1 | -37.8 | 178.2 | -74.5 | 4.4 | 0 | 0 | 0 | 112.4 | I31 P32 I38 C39 L82 W85 Y89 C289 F292 | I31-Y35 HydrophobicContact CG2-CD1 4.17Å; I31-Y35 HydrophobicContact CG2-CD2 3.98Å; I31-Y35 HydrophobicContact CG2-CE1 3.83Å; I31-Y35 HydrophobicContact CG2-CE2 3.63Å; I31-Y35 HydrophobicContact CG2-CG 4.23Å; I31-Y35 PolarHBondContact O-N 3.25Å; P32-Y35 PolarHBondContact O-N 3.42Å; Y35-I38 PolarHBondContact O-N 3.08Å; Y35-C39 VanDerWaalsContact O-CB 3.24Å; Y35-C39 WeakPolarHBondContact O-CB 3.48Å; Y35-C39 PolarHBondContact O-N 3.35Å; Y35-L82 HydrophobicContact CD1-CD2 4.26Å; Y35-L82 HydrophobicContact CD2-CD2 4.08Å; Y35-L82 HydrophobicContact CE2-CD2 4.47Å; Y35-L82 HydrophobicContact CG-CD2 3.98Å; Y35-W85 HydrophobicContact CD2-CB 3.79Å; Y35-W85 HydrophobicContact CE2-CB 3.72Å; Y35-Y89 AromaticContact CE2-CD2 3.84Å; Y35-Y89 HydrophobicContact CE2-CD2 3.84Å; Y35-Y89 AromaticContact CE2-CE2 3.74Å; Y35-Y89 HydrophobicContact CE2-CE2 3.74Å; Y35-C289 HydrophobicContact CE1-CB 4.32Å; Y35-C289 WeakPolarHBondContact CE1-SG 3.47Å; Y35-F292 HydrophobicContact CD1-CD2 4.17Å; Y35-F292 AromaticContact CE1-CD2 3.47Å; Y35-F292 HydrophobicContact CE1-CD2 3.47Å; Y35-F292 VanDerWaalsContact CE1-CD2 3.47Å; Y35-F292 AromaticContact CE1-CE2 3.82Å; Y35-F292 HydrophobicContact CE1-CE2 3.82Å; Y35-F292 HydrophobicContact CE2-CE2 4.3Å; Y35-F292 AromaticContact CZ-CD2 3.74Å; Y35-F292 AromaticContact CZ-CE2 3.56Å; Y35-F292 WeakPolarHBondContact OH-CE2 3.38Å |
| 36 | S | 96.3 | Very high | 92.8 | Very high | 60 Ų | 60 | 47.9 Ų | 47.9 | 42% | 0.42 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -64.9 | -43.9 | 176.5 | -58.9 | 0 | 0 | 0 | 0 | 111.6 | P32 T33 I34 C39 V40 | P32-S36 WeakPolarHBondContact O-CB 3.26Å; P32-S36 PolarHBondContact O-N 3.38Å; P32-S36 PolarHBondContact O-OG 3Å; T33-S36 PolarHBondContact O-N 3.4Å; I34-S36 VanDerWaalsContact C-N 3.29Å; I34-S36 PolarHBondContact O-N 3.37Å; S36-C39 PolarHBondContact O-N 3.47Å; S36-V40 WeakPolarHBondContact O-CG2 3.46Å; S36-V40 PolarHBondContact O-N 3.11Å |
| 37 | V | 96.1 | Very high | 93.6 | Very high | 79 Ų | 79 | 46.2 Ų | 46.2 | 48% | 0.479 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -62.8 | -47.8 | 175.9 | 172.8 | 0 | 0 | 0 | 0 | 111.1 | T33 I34 C39 V40 L41 | T33-V37 WeakPolarHBondContact O-CG2 3.48Å; T33-V37 PolarHBondContact O-N 3.32Å; I34-V37 PolarHBondContact O-N 2.69Å; V37-C39 VanDerWaalsContact C-N 3.3Å; V37-C39 PolarHBondContact O-N 2.9Å; V37-V40 PolarHBondContact O-N 3.07Å; V37-L41 HydrophobicContact CG1-CD1 3.72Å; V37-L41 HydrophobicContact CG1-CG 4.28Å; V37-L41 WeakPolarHBondContact O-CB 3.21Å; V37-L41 WeakPolarHBondContact O-CG 3.46Å; V37-L41 PolarHBondContact O-N 2.92Å |
| 38 | I | 96.5 | Very high | 93.7 | Very high | 7 Ų | 7 | 47.8 Ų | 47.8 | 4% | 0.036 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -59.2 | -43.8 | 177.2 | -66.1 | 167.4 | 0 | 0 | 0 | 110.3 | I34 Y35 G42 L79 L82 C289 F292 S293 A296 | I34-I38 HydrophobicContact CG2-CD1 3.61Å; I34-I38 HydrophobicContact CG2-CG1 4.23Å; I34-I38 VanDerWaalsContact O-CG1 3.29Å; I34-I38 WeakPolarHBondContact O-CG1 3.39Å; I34-I38 PolarHBondContact O-N 2.78Å; Y35-I38 PolarHBondContact O-N 3.08Å; I38-G42 WeakPolarHBondContact O-CA 3.46Å; I38-G42 PolarHBondContact O-N 3.27Å; I38-L79 HydrophobicContact CG2-CD2 3.87Å; I38-L82 HydrophobicContact CB-CD1 3.96Å; I38-L82 HydrophobicContact CG2-CD1 3.52Å; I38-C289 WeakPolarHBondContact CD1-O 3.41Å; I38-F292 HydrophobicContact CD1-CB 4.07Å; I38-S293 WeakPolarHBondContact CD1-OG 3.39Å; I38-A296 HydrophobicContact CG2-CB 4.17Å |
| 39 | C | 97 | Very high | 93.6 | Very high | 20 Ų | 20 | 46 Ų | 46 | 14% | 0.135 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -58.7 | -51.5 | 178.1 | -176.1 | 0 | 0 | 0 | 0 | 111.3 | Y35 S36 V37 T43 L82 | Y35-C39 VanDerWaalsContact O-CB 3.24Å; Y35-C39 WeakPolarHBondContact O-CB 3.48Å; Y35-C39 PolarHBondContact O-N 3.35Å; S36-C39 PolarHBondContact O-N 3.47Å; V37-C39 VanDerWaalsContact C-N 3.3Å; V37-C39 PolarHBondContact O-N 2.9Å; C39-T43 VanDerWaalsContact O-CB 3.26Å; C39-T43 WeakPolarHBondContact O-CB 3.33Å; C39-T43 WeakPolarHBondContact O-CG2 3.38Å; C39-T43 PolarHBondContact O-N 2.96Å; C39-T43 PolarHBondContact O-OG1 3.25Å; C39-L82 HydrophobicContact CB-CB 4.17Å; C39-L82 HydrophobicContact CB-CD1 4.37Å |
| 40 | V | 95.7 | Very high | 93.6 | Very high | 84 Ų | 84 | 42.8 Ų | 42.8 | 51% | 0.509 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -64.6 | -52.9 | -177.9 | 173.4 | 0 | 0 | 0 | 0 | 111.3 | S36 V37 T43 L44 | S36-V40 WeakPolarHBondContact O-CG2 3.46Å; S36-V40 PolarHBondContact O-N 3.11Å; V37-V40 PolarHBondContact O-N 3.07Å; V40-T43 PolarHBondContact O-OG1 3.16Å; V40-T43 VanDerWaalsContact O-OG1 3.14Å; V40-L44 HydrophobicContact CG1-CD1 4.01Å; V40-L44 WeakPolarHBondContact O-CB 3.43Å; V40-L44 VanDerWaalsContact O-CG 3.28Å; V40-L44 WeakPolarHBondContact O-CG 3.33Å; V40-L44 PolarHBondContact O-N 3Å |
| 41 | L | 94.4 | Very high | 93.3 | Very high | 105 Ų | 105 | 44.9 Ų | 44.9 | 55% | 0.55 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -66 | -43.4 | -177.1 | -64 | -179.7 | 0 | 0 | 0 | 111.7 | V37 G45 A296 | V37-L41 HydrophobicContact CG1-CD1 3.72Å; V37-L41 HydrophobicContact CG1-CG 4.28Å; V37-L41 WeakPolarHBondContact O-CB 3.21Å; V37-L41 WeakPolarHBondContact O-CG 3.46Å; V37-L41 PolarHBondContact O-N 2.92Å; L41-G45 PolarHBondContact O-N 3.44Å; L41-A296 HydrophobicContact CB-CB 4.42Å |
| 42 | G | 94.9 | Very high | 92.7 | Very high | 0 Ų | 0 | 45 Ų | 45 | 0% | 0 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -66.6 | -42.4 | -179.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | I38 N46 L79 | I38-G42 WeakPolarHBondContact O-CA 3.46Å; I38-G42 PolarHBondContact O-N 3.27Å; G42-N46 VanDerWaalsContact O-CB 3.31Å; G42-N46 WeakPolarHBondContact O-CB 3.45Å; G42-N46 PolarHBondContact O-N 3.47Å; G42-N46 PolarHBondContact O-ND2 2.92Å; G42-L79 WeakPolarHBondContact O-CD1 3.41Å |
| 43 | T | 95.2 | Very high | 92.1 | Very high | 38 Ų | 38 | 45.1 Ų | 45.1 | 23% | 0.233 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -66.9 | -47 | -179.9 | 50.6 | 0 | 0 | 0 | 0 | 111.1 | C39 V40 G45 A47 L79 | C39-T43 VanDerWaalsContact O-CB 3.26Å; C39-T43 WeakPolarHBondContact O-CB 3.33Å; C39-T43 WeakPolarHBondContact O-CG2 3.38Å; C39-T43 PolarHBondContact O-N 2.96Å; C39-T43 PolarHBondContact O-OG1 3.25Å; V40-T43 PolarHBondContact O-OG1 3.16Å; V40-T43 VanDerWaalsContact O-OG1 3.14Å; T43-G45 PolarHBondContact O-N 3.48Å; T43-A47 WeakPolarHBondContact O-CB 3.25Å; T43-A47 PolarHBondContact O-N 3.29Å; T43-L79 HydrophobicContact CG2-CB 3.81Å; T43-L79 HydrophobicContact CG2-CD1 4.3Å |
| 44 | L | 92.6 | Very high | 91.3 | Very high | 115 Ų | 115 | 44.5 Ų | 44.5 | 60% | 0.602 | 26% | 0.262 | S | S | * | . | H | α-helix | trans | -59.5 | -48.6 | 176.9 | -68.7 | 174.1 | 0 | 0 | 0 | 111.5 | V40 L48 | V40-L44 HydrophobicContact CG1-CD1 4.01Å; V40-L44 WeakPolarHBondContact O-CB 3.43Å; V40-L44 VanDerWaalsContact O-CG 3.28Å; V40-L44 WeakPolarHBondContact O-CG 3.33Å; V40-L44 PolarHBondContact O-N 3Å; L44-L48 VanDerWaalsContact O-CB 3.26Å; L44-L48 WeakPolarHBondContact O-CB 3.34Å; L44-L48 PolarHBondContact O-N 3.33Å; L44-L48 VanDerWaalsContact O-N 3.08Å |
| 45 | G | 90.6 | Very high | 90.3 | Very high | 16 Ų | 16 | 45.6 Ų | 45.6 | 17% | 0.165 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -64 | -48.8 | -179 | 0 | 0 | 0 | 0 | 0 | 112.9 | L41 T43 L48 A49 P299 | L41-G45 PolarHBondContact O-N 3.44Å; T43-G45 PolarHBondContact O-N 3.48Å; G45-L48 PolarHBondContact O-N 2.88Å; G45-A49 WeakPolarHBondContact O-CB 3.47Å; G45-A49 PolarHBondContact O-N 2.96Å; G45-P299 VanDerWaalsContact C-CB 3.45Å |
| 46 | N | 93 | Very high | 88.9 | Confident | 0 Ų | 0 | 46.2 Ų | 46.2 | 0% | 0 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -72.6 | -36.5 | -177.9 | -74.6 | -72.7 | 0 | 0 | 0 | 112.1 | G42 L48 A49 V50 C72 L76 S295 P299 | G42-N46 VanDerWaalsContact O-CB 3.31Å; G42-N46 WeakPolarHBondContact O-CB 3.45Å; G42-N46 PolarHBondContact O-N 3.47Å; G42-N46 PolarHBondContact O-ND2 2.92Å; N46-L48 VanDerWaalsContact C-N 3.33Å; N46-L48 PolarHBondContact O-N 3.4Å; N46-A49 PolarHBondContact O-N 3.22Å; N46-V50 WeakPolarHBondContact O-CG2 3.5Å; N46-V50 PolarHBondContact O-N 3.2Å; N46-C72 HydrophobicContact CB-CB 4.33Å; N46-C72 PolarHBondContact OD1-SG 3.31Å; N46-L76 HydrophobicContact CB-CD1 4.32Å; N46-L76 HydrophobicContact CB-CD2 3.79Å; N46-L76 HydrophobicContact CB-CG 3.74Å; N46-S295 PolarHBondContact ND2-O 3.49Å; N46-P299 HydrophobicContact CB-CG 4.31Å |
| 47 | A | 91.6 | Very high | 87.4 | Confident | 49 Ų | 49 | 49.2 Ų | 49.2 | 41% | 0.405 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -63 | -42.1 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | T43 V50 Y51 L76 | T43-A47 WeakPolarHBondContact O-CB 3.25Å; T43-A47 PolarHBondContact O-N 3.29Å; A47-V50 PolarHBondContact O-N 3.38Å; A47-Y51 WeakPolarHBondContact O-CB 3.39Å; A47-Y51 PolarHBondContact O-N 3.11Å; A47-L76 HydrophobicContact CB-CD2 4.44Å |
| 48 | L | 87.9 | Confident | 85.6 | Confident | 63 Ų | 63 | 49.2 Ų | 49.2 | 33% | 0.33 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -62.3 | -43.5 | 173.4 | 177.3 | 62.4 | 0 | 0 | 0 | 111.8 | L44 G45 N46 Y51 V52 L313 | L44-L48 VanDerWaalsContact O-CB 3.26Å; L44-L48 WeakPolarHBondContact O-CB 3.34Å; L44-L48 PolarHBondContact O-N 3.33Å; L44-L48 VanDerWaalsContact O-N 3.08Å; G45-L48 PolarHBondContact O-N 2.88Å; N46-L48 VanDerWaalsContact C-N 3.33Å; N46-L48 PolarHBondContact O-N 3.4Å; L48-Y51 PolarHBondContact O-N 3.43Å; L48-V52 HydrophobicContact CD1-CG2 4.24Å; L48-V52 WeakPolarHBondContact O-CG2 3.38Å; L48-V52 PolarHBondContact O-N 3.31Å; L48-L313 HydrophobicContact CD1-CD1 4.01Å; L48-L313 HydrophobicContact CD2-CD1 3.7Å; L48-L313 HydrophobicContact CG-CD1 4.26Å |
| 49 | A | 86.6 | Confident | 83.8 | Confident | 3 Ų | 3 | 56.1 Ų | 56.1 | 3% | 0.025 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -61.4 | -45.9 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | G45 N46 Y51 V52 L53 Y302 F309 | G45-A49 WeakPolarHBondContact O-CB 3.47Å; G45-A49 PolarHBondContact O-N 2.96Å; N46-A49 PolarHBondContact O-N 3.22Å; A49-Y51 VanDerWaalsContact C-N 3.34Å; A49-Y51 PolarHBondContact O-N 3.43Å; A49-V52 PolarHBondContact O-N 3.4Å; A49-L53 WeakPolarHBondContact O-CB 3.34Å; A49-L53 WeakPolarHBondContact O-CG 3.37Å; A49-L53 PolarHBondContact O-N 3.01Å; A49-Y302 HydrophobicContact CB-CD2 4.44Å; A49-F309 HydrophobicContact CB-CE1 4.5Å; A49-F309 HydrophobicContact CB-CZ 4.47Å |
| 50 | V | 88.9 | Confident | 82.1 | Confident | 35 Ų | 35 | 55.6 Ų | 55.6 | 21% | 0.212 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -57 | -48.2 | 173.5 | 170 | 0 | 0 | 0 | 0 | 110.6 | N46 A47 V52 L53 A54 L69 C72 L76 | N46-V50 WeakPolarHBondContact O-CG2 3.5Å; N46-V50 PolarHBondContact O-N 3.2Å; A47-V50 PolarHBondContact O-N 3.38Å; V50-V52 PolarHBondContact O-N 2.93Å; V50-L53 PolarHBondContact O-N 2.89Å; V50-A54 WeakPolarHBondContact O-CB 3.22Å; V50-A54 PolarHBondContact O-N 2.88Å; V50-L69 HydrophobicContact CB-CD1 4.24Å; V50-L69 HydrophobicContact CG1-CD1 3.99Å; V50-L69 HydrophobicContact CG2-CD1 4.06Å; V50-C72 HydrophobicContact CG2-CB 3.6Å; V50-L76 HydrophobicContact CG2-CD1 3.86Å |
| 51 | Y | 85 | Confident | 80.9 | Confident | 118 Ų | 118 | 60 Ų | 60 | 46% | 0.463 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -58.4 | -48.6 | 179.2 | 176.2 | -101 | 0 | 0 | 0 | 112 | A47 L48 A49 L53 C55 L316 | A47-Y51 WeakPolarHBondContact O-CB 3.39Å; A47-Y51 PolarHBondContact O-N 3.11Å; L48-Y51 PolarHBondContact O-N 3.43Å; A49-Y51 VanDerWaalsContact C-N 3.34Å; A49-Y51 PolarHBondContact O-N 3.43Å; Y51-L53 VanDerWaalsContact C-N 3.34Å; Y51-L53 PolarHBondContact O-N 3.39Å; Y51-C55 HydrophobicContact CE2-CB 4.33Å; Y51-C55 VanDerWaalsContact O-CB 3.23Å; Y51-C55 WeakPolarHBondContact O-CB 3.31Å; Y51-C55 PolarHBondContact O-N 2.97Å; Y51-L316 HydrophobicContact CD1-CD1 4.25Å; Y51-L316 HydrophobicContact CE1-CD1 3.82Å; Y51-L316 HydrophobicContact CE1-CD2 3.69Å; Y51-L316 HydrophobicContact CE1-CG 4.4Å |
| 52 | V | 81.5 | Confident | 80.1 | Confident | 3 Ų | 3 | 56.8 Ų | 56.8 | 2% | 0.018 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -64.1 | -38.5 | 179.6 | 172.4 | 0 | 0 | 0 | 0 | 112 | L48 A49 V50 F309 R312 L316 | L48-V52 HydrophobicContact CD1-CG2 4.24Å; L48-V52 WeakPolarHBondContact O-CG2 3.38Å; L48-V52 PolarHBondContact O-N 3.31Å; A49-V52 PolarHBondContact O-N 3.4Å; V50-V52 PolarHBondContact O-N 2.93Å; V52-F309 HydrophobicContact CB-CD1 4.41Å; V52-F309 HydrophobicContact CB-CE1 3.65Å; V52-F309 HydrophobicContact CB-CZ 4.13Å; V52-F309 HydrophobicContact CG1-CD1 3.96Å; V52-F309 HydrophobicContact CG1-CE1 3.51Å; V52-F309 HydrophobicContact CG1-CZ 3.88Å; V52-F309 HydrophobicContact CG2-CE1 4.14Å; V52-R312 HydrophobicContact CG1-CB 4.45Å; V52-R312 PolarHBondContact O-NH1 3.5Å; V52-R312 PolarHBondContact O-NH2 2.9Å; V52-L316 HydrophobicContact CG2-CD1 3.97Å |
| 53 | L | 82 | Confident | 79.7 | Confident | 15 Ų | 15 | 57.5 Ų | 57.5 | 8% | 0.079 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -75.9 | -39.9 | -179.3 | -68.2 | 170.9 | 0 | 0 | 0 | 112.5 | A49 V50 Y51 N65 M68 L69 F309 | A49-L53 WeakPolarHBondContact O-CB 3.34Å; A49-L53 WeakPolarHBondContact O-CG 3.37Å; A49-L53 PolarHBondContact O-N 3.01Å; V50-L53 PolarHBondContact O-N 2.89Å; Y51-L53 VanDerWaalsContact C-N 3.34Å; Y51-L53 PolarHBondContact O-N 3.39Å; L53-N65 HydrophobicContact CD2-CB 3.99Å; L53-M68 HydrophobicContact CD1-CB 4.19Å; L53-M68 HydrophobicContact CD1-CG 3.83Å; L53-M68 HydrophobicContact CD1-SD 3.96Å; L53-M68 HydrophobicContact CD2-SD 4.31Å; L53-L69 HydrophobicContact CB-CD1 4.22Å; L53-L69 HydrophobicContact CD1-CB 4.29Å; L53-F309 HydrophobicContact CD1-CZ 4.38Å; L53-F309 HydrophobicContact CD2-CE2 3.91Å; L53-F309 HydrophobicContact CD2-CZ 3.96Å; L53-F309 HydrophobicContact CG-CE2 4.34Å; L53-F309 HydrophobicContact CG-CZ 3.88Å |
| 54 | A | 79.7 | Confident | 79 | Confident | 65 Ų | 65 | 56.1 Ų | 56.1 | 54% | 0.537 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -79.2 | -40.4 | -177.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | V50 G56 | V50-A54 WeakPolarHBondContact O-CB 3.22Å; V50-A54 PolarHBondContact O-N 2.88Å; A54-G56 VanDerWaalsContact C-N 3.26Å; A54-G56 PolarHBondContact O-N 3.38Å |
| 55 | C | 75.1 | Confident | 78.6 | Confident | 79 Ų | 79 | 52.2 Ų | 52.2 | 53% | 0.534 | 30% | 0.301 | S | S | . | . | S | Bend | trans | -88.2 | 12.2 | -179.5 | -60.1 | 0 | 0 | 0 | 0 | 113.2 | Y51 | Y51-C55 HydrophobicContact CE2-CB 4.33Å; Y51-C55 VanDerWaalsContact O-CB 3.23Å; Y51-C55 WeakPolarHBondContact O-CB 3.31Å; Y51-C55 PolarHBondContact O-N 2.97Å |
| 56 | G | 66.2 | Low | 78.5 | Confident | 16 Ų | 16 | 52.1 Ų | 52.1 | 17% | 0.165 | 30% | 0.298 | C | S | . | . | S | Bend | trans | -83.3 | 154 | 178.2 | 0 | 0 | 0 | 0 | 0 | 115.3 | A54 T60 | A54-G56 VanDerWaalsContact C-N 3.26Å; A54-G56 PolarHBondContact O-N 3.38Å; G56-T60 VanDerWaalsContact C-OG1 3.26Å; G56-T60 WeakPolarHBondContact CA-OG1 3.42Å; G56-T60 PolarHBondContact O-OG1 3.29Å |
| 57 | N | 64.4 | Low | 78.4 | Confident | 124 Ų | 124 | 52.6 Ų | 52.6 | 66% | 0.663 | 30% | 0.3 | S | S | * | . | trans | -61.1 | 168.2 | 176 | -62.6 | 12.1 | 0 | 0 | 0 | 111 | L59 T60 | N57-L59 PolarHBondContact O-N 2.88Å; N57-T60 WeakPolarHBondContact O-CB 3.38Å; N57-T60 PolarHBondContact O-N 3.38Å; N57-T60 PolarHBondContact O-OG1 3.2Å | ||
| 58 | A | 59.7 | Low | 78.3 | Confident | 79 Ų | 79 | 51.2 Ų | 51.2 | 65% | 0.653 | 29% | 0.285 | S | S | * | . | G | 310 helix | trans | -48.9 | -28.7 | -179.1 | 0 | 0 | 0 | 0 | 0 | 114.6 | T60 R61 | A58-T60 PolarHBondContact O-N 3.16Å; A58-T60 VanDerWaalsContact O-N 3.11Å; A58-R61 WeakPolarHBondContact O-CB 3.48Å; A58-R61 PolarHBondContact O-N 2.88Å; A58-R61 VanDerWaalsContact O-N 3.07Å |
| 59 | L | 58.5 | Low | 78.4 | Confident | 151 Ų | 151 | 50.3 Ų | 50.3 | 79% | 0.791 | 28% | 0.281 | S | S | * | . | G | 310 helix | trans | -58.7 | -18.4 | 173.5 | -67.6 | 168 | 0 | 0 | 0 | 114.6 | N57 | N57-L59 PolarHBondContact O-N 2.88Š|
| 60 | T | 61.6 | Low | 78.8 | Confident | 9 Ų | 9 | 51.4 Ų | 51.4 | 6% | 0.055 | 29% | 0.286 | C | S | . | . | G | 310 helix | trans | -93.3 | -7.2 | 179.9 | 63.1 | 0 | 0 | 0 | 0 | 112.9 | G56 N57 A58 T62 N65 | G56-T60 VanDerWaalsContact C-OG1 3.26Å; G56-T60 WeakPolarHBondContact CA-OG1 3.42Å; G56-T60 PolarHBondContact O-OG1 3.29Å; N57-T60 WeakPolarHBondContact O-CB 3.38Å; N57-T60 PolarHBondContact O-N 3.38Å; N57-T60 PolarHBondContact O-OG1 3.2Å; A58-T60 PolarHBondContact O-N 3.16Å; A58-T60 VanDerWaalsContact O-N 3.11Å; T60-T62 PolarHBondContact O-N 2.94Å; T60-N65 WeakPolarHBondContact O-CB 3.27Å; T60-N65 PolarHBondContact O-ND2 3.34Å |
| 61 | R | 69.1 | Low | 79 | Confident | 178 Ų | 178 | 49.7 Ų | 49.7 | 67% | 0.672 | 28% | 0.276 | S | S | * | . | trans | -81.5 | 67.3 | 175.4 | -63.6 | -174.4 | 177.6 | 174 | -1.3 | 110.8 | A58 | A58-R61 WeakPolarHBondContact O-CB 3.48Å; A58-R61 PolarHBondContact O-N 2.88Å; A58-R61 VanDerWaalsContact O-N 3.07Å | ||
| 62 | T | 79.3 | Confident | 79.5 | Confident | 37 Ų | 37 | 44.1 Ų | 44.1 | 23% | 0.227 | 25% | 0.254 | C | S | . | . | trans | -105.4 | 156.8 | 174.3 | 72.8 | 0 | 0 | 0 | 0 | 110.7 | T60 A64 N65 T66 | T60-T62 PolarHBondContact O-N 2.94Å; T62-A64 VanDerWaalsContact C-N 3.29Å; T62-A64 PolarHBondContact O-N 3.1Å; T62-N65 PolarHBondContact O-N 3.13Å; T62-N65 WeakPolarHBondContact OG1-CB 3.36Å; T62-N65 PolarHBondContact OG1-N 2.94Å; T62-N65 PolarHBondContact OG1-ND2 3.23Å; T62-T66 PolarHBondContact O-N 3.05Å; T62-T66 PolarHBondContact O-OG1 2.96Å | ||
| 63 | V | 84.5 | Confident | 80.1 | Confident | 14 Ų | 14 | 47 Ų | 47 | 9% | 0.085 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -53.2 | -48.1 | 174.4 | 176.3 | 0 | 0 | 0 | 0 | 111.1 | N65 T66 F67 D126 R141 A146 | V63-N65 PolarHBondContact O-N 3.47Å; V63-T66 WeakPolarHBondContact O-CB 3.43Å; V63-T66 PolarHBondContact O-N 2.91Å; V63-T66 VanDerWaalsContact O-N 3.12Å; V63-F67 HydrophobicContact CG1-CD2 4.16Å; V63-F67 HydrophobicContact CG1-CE2 3.47Å; V63-F67 VanDerWaalsContact CG1-CE2 3.47Å; V63-F67 HydrophobicContact CG1-CZ 3.7Å; V63-F67 PolarHBondContact O-N 2.98Å; V63-F67 VanDerWaalsContact O-N 3.11Å; V63-D126 HydrophobicContact CG1-CB 4.45Å; V63-R141 HydrophobicContact CG2-CB 4.17Å; V63-R141 HydrophobicContact CG2-CG 4.02Å; V63-A146 HydrophobicContact CB-CB 4.23Å; V63-A146 HydrophobicContact CG1-CB 3.85Å; V63-A146 HydrophobicContact CG2-CB 4.04Å |
| 64 | A | 81.9 | Confident | 80.8 | Confident | 10 Ų | 10 | 46.4 Ų | 46.4 | 8% | 0.083 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -60.5 | -43.4 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | T62 T66 F67 M68 | T62-A64 VanDerWaalsContact C-N 3.29Å; T62-A64 PolarHBondContact O-N 3.1Å; A64-T66 VanDerWaalsContact C-N 3.27Å; A64-T66 PolarHBondContact O-N 3.28Å; A64-F67 PolarHBondContact O-N 3.38Å; A64-M68 WeakPolarHBondContact O-CB 3.41Å; A64-M68 PolarHBondContact O-N 3.49Å |
| 65 | N | 83.8 | Confident | 81.6 | Confident | 32 Ų | 32 | 43.3 Ų | 43.3 | 17% | 0.171 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -67.4 | -29.3 | 177.2 | -70.7 | -6.5 | 0 | 0 | 0 | 112.3 | L53 T60 T62 V63 L69 | L53-N65 HydrophobicContact CD2-CB 3.99Å; T60-N65 WeakPolarHBondContact O-CB 3.27Å; T60-N65 PolarHBondContact O-ND2 3.34Å; T62-N65 PolarHBondContact O-N 3.13Å; T62-N65 WeakPolarHBondContact OG1-CB 3.36Å; T62-N65 PolarHBondContact OG1-N 2.94Å; T62-N65 PolarHBondContact OG1-ND2 3.23Å; V63-N65 PolarHBondContact O-N 3.47Å; N65-L69 VanDerWaalsContact O-CB 3.31Å; N65-L69 WeakPolarHBondContact O-CB 3.41Å; N65-L69 PolarHBondContact O-N 3.45Å |
| 66 | T | 88.8 | Confident | 82.7 | Confident | 15 Ų | 15 | 41.4 Ų | 41.4 | 9% | 0.092 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -68.6 | -44.2 | 175.8 | -53.4 | 0 | 0 | 0 | 0 | 110.9 | T62 V63 A64 L69 N70 | T62-T66 PolarHBondContact O-N 3.05Å; T62-T66 PolarHBondContact O-OG1 2.96Å; V63-T66 WeakPolarHBondContact O-CB 3.43Å; V63-T66 PolarHBondContact O-N 2.91Å; V63-T66 VanDerWaalsContact O-N 3.12Å; A64-T66 VanDerWaalsContact C-N 3.27Å; A64-T66 PolarHBondContact O-N 3.28Å; T66-L69 PolarHBondContact O-N 2.96Å; T66-N70 PolarHBondContact O-N 3.47Å; T66-N70 PolarHBondContact O-ND2 3.45Å |
| 67 | F | 91.2 | Very high | 84.1 | Confident | 9 Ų | 9 | 43.8 Ų | 43.8 | 4% | 0.039 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -65.1 | -42.7 | 173.6 | -60.3 | -30.6 | 0 | 0 | 0 | 112 | V63 A64 L69 N70 L71 F119 C122 M123 D126 A146 V149 C150 | V63-F67 HydrophobicContact CG1-CD2 4.16Å; V63-F67 HydrophobicContact CG1-CE2 3.47Å; V63-F67 VanDerWaalsContact CG1-CE2 3.47Å; V63-F67 HydrophobicContact CG1-CZ 3.7Å; V63-F67 PolarHBondContact O-N 2.98Å; V63-F67 VanDerWaalsContact O-N 3.11Å; A64-F67 PolarHBondContact O-N 3.38Å; F67-L69 VanDerWaalsContact C-N 3.34Å; F67-L69 PolarHBondContact O-N 2.9Å; F67-N70 PolarHBondContact O-N 2.95Å; F67-L71 WeakPolarHBondContact O-CB 3.37Å; F67-L71 PolarHBondContact O-N 2.96Å; F67-F119 HydrophobicContact CB-CD1 4.29Å; F67-F119 HydrophobicContact CD1-CD1 4.24Å; F67-F119 HydrophobicContact CD1-CE1 4.48Å; F67-C122 HydrophobicContact CD2-CB 3.99Å; F67-C122 HydrophobicContact CE1-CB 4.43Å; F67-C122 HydrophobicContact CE2-CB 3.86Å; F67-C122 HydrophobicContact CG-CB 4.33Å; F67-C122 HydrophobicContact CZ-CB 4.1Å; F67-M123 HydrophobicContact CB-CG 3.63Å; F67-M123 HydrophobicContact CB-SD 4.36Å; F67-M123 HydrophobicContact CD2-CG 4.06Å; F67-M123 HydrophobicContact CG-CG 4.33Å; F67-D126 HydrophobicContact CE2-CB 4.23Å; F67-A146 HydrophobicContact CE1-CB 4.34Å; F67-A146 HydrophobicContact CZ-CB 4.45Å; F67-V149 HydrophobicContact CE1-CB 4.16Å; F67-V149 HydrophobicContact CE1-CG1 3.85Å; F67-V149 HydrophobicContact CZ-CB 4.36Å; F67-V149 HydrophobicContact CZ-CG1 3.97Å; F67-C150 VanDerWaalsContact CD1-SG 3.58Å |
| 68 | M | 89 | Confident | 85.7 | Confident | 20 Ų | 20 | 38 Ų | 38 | 10% | 0.099 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -60.6 | -42.1 | 176.2 | -172.2 | -179.1 | -70.1 | 0 | 0 | 112.1 | L53 A64 N70 L71 C72 M123 Y302 F309 | L53-M68 HydrophobicContact CD1-CB 4.19Å; L53-M68 HydrophobicContact CD1-CG 3.83Å; L53-M68 HydrophobicContact CD1-SD 3.96Å; L53-M68 HydrophobicContact CD2-SD 4.31Å; A64-M68 WeakPolarHBondContact O-CB 3.41Å; A64-M68 PolarHBondContact O-N 3.49Å; M68-N70 PolarHBondContact O-N 3.47Å; M68-L71 WeakPolarHBondContact O-CB 3.49Å; M68-L71 PolarHBondContact O-N 3.04Å; M68-C72 PolarHBondContact O-N 3.35Å; M68-C72 PolarHBondContact O-SG 3.44Å; M68-C72 VanDerWaalsContact O-SG 3.4Å; M68-M123 HydrophobicContact CB-SD 4.49Å; M68-Y302 HydrophobicContact CE-CD1 3.62Å; M68-Y302 HydrophobicContact CE-CE1 3.69Å; M68-Y302 HydrophobicContact CE-CG 4.2Å; M68-Y302 HydrophobicContact CG-CD2 4.3Å; M68-Y302 HydrophobicContact CG-CE1 4.11Å; M68-Y302 HydrophobicContact CG-CE2 3.86Å; M68-Y302 HydrophobicContact SD-CD1 3.97Å; M68-Y302 HydrophobicContact SD-CD2 4.05Å; M68-Y302 HydrophobicContact SD-CE1 4.11Å; M68-Y302 HydrophobicContact SD-CE2 4.2Å; M68-Y302 HydrophobicContact SD-CG 3.97Å; M68-F309 HydrophobicContact SD-CE2 4.02Å |
| 69 | L | 90.5 | Very high | 87.5 | Confident | 45 Ų | 45 | 34.2 Ų | 34.2 | 24% | 0.236 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -61 | -45.1 | 176.7 | 179.6 | 65.3 | 0 | 0 | 0 | 111.6 | V50 L53 N65 T66 F67 L71 C72 I73 | V50-L69 HydrophobicContact CB-CD1 4.24Å; V50-L69 HydrophobicContact CG1-CD1 3.99Å; V50-L69 HydrophobicContact CG2-CD1 4.06Å; L53-L69 HydrophobicContact CB-CD1 4.22Å; L53-L69 HydrophobicContact CD1-CB 4.29Å; N65-L69 VanDerWaalsContact O-CB 3.31Å; N65-L69 WeakPolarHBondContact O-CB 3.41Å; N65-L69 PolarHBondContact O-N 3.45Å; T66-L69 PolarHBondContact O-N 2.96Å; F67-L69 VanDerWaalsContact C-N 3.34Å; F67-L69 PolarHBondContact O-N 2.9Å; L69-L71 VanDerWaalsContact C-N 3.34Å; L69-C72 PolarHBondContact O-N 3.37Å; L69-I73 HydrophobicContact CG-CD1 4.15Å; L69-I73 VanDerWaalsContact O-CG1 3.32Å; L69-I73 WeakPolarHBondContact O-CG1 3.31Å; L69-I73 PolarHBondContact O-N 3.37Å |
| 70 | N | 94.4 | Very high | 89.3 | Confident | 25 Ų | 25 | 32.9 Ų | 32.9 | 13% | 0.134 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -67.2 | -35.3 | 178.1 | -77.5 | -92.4 | 0 | 0 | 0 | 112.5 | T66 F67 M68 I73 S74 F119 C150 W154 | T66-N70 PolarHBondContact O-N 3.47Å; T66-N70 PolarHBondContact O-ND2 3.45Å; F67-N70 PolarHBondContact O-N 2.95Å; M68-N70 PolarHBondContact O-N 3.47Å; N70-I73 PolarHBondContact O-N 3.45Å; N70-S74 WeakPolarHBondContact O-CB 3.2Å; N70-S74 PolarHBondContact O-N 3.17Å; N70-F119 HydrophobicContact CB-CD1 4.19Å; N70-F119 HydrophobicContact CB-CD2 4.15Å; N70-F119 HydrophobicContact CB-CE1 3.62Å; N70-F119 HydrophobicContact CB-CE2 3.58Å; N70-F119 HydrophobicContact CB-CG 4.45Å; N70-F119 HydrophobicContact CB-CZ 3.31Å; N70-C150 PolarHBondContact ND2-SG 3.41Å; N70-W154 PolarHBondContact OD1-NE1 2.97Å |
| 71 | L | 93.4 | Very high | 90.9 | Very high | 0 Ų | 0 | 32.7 Ų | 32.7 | 0% | 0 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -60.7 | -47 | 172.1 | 179.1 | 59.5 | 0 | 0 | 0 | 111.1 | F67 M68 L69 I73 S74 D75 S116 F119 I120 M123 Y302 | F67-L71 WeakPolarHBondContact O-CB 3.37Å; F67-L71 PolarHBondContact O-N 2.96Å; M68-L71 WeakPolarHBondContact O-CB 3.49Å; M68-L71 PolarHBondContact O-N 3.04Å; L69-L71 VanDerWaalsContact C-N 3.34Å; L71-I73 VanDerWaalsContact C-N 3.33Å; L71-I73 PolarHBondContact O-N 2.92Å; L71-S74 WeakPolarHBondContact O-CB 3.4Å; L71-S74 PolarHBondContact O-N 3.41Å; L71-D75 PolarHBondContact O-N 2.81Å; L71-S116 VanDerWaalsContact CD1-CA 3.48Å; L71-S116 WeakPolarHBondContact CD1-OG 3.17Å; L71-F119 HydrophobicContact CB-CB 4.26Å; L71-I120 HydrophobicContact CD2-CG1 4.12Å; L71-M123 HydrophobicContact CD2-CE 3.63Å; L71-Y302 WeakPolarHBondContact CD2-OH 3.38Å |
| 72 | C | 94.1 | Very high | 92.2 | Very high | 0 Ų | 0 | 24.2 Ų | 24.2 | 0% | 0 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -62.3 | -37.8 | 175.1 | -67.7 | 0 | 0 | 0 | 0 | 112.8 | N46 V50 M68 L69 D75 L76 | N46-C72 HydrophobicContact CB-CB 4.33Å; N46-C72 PolarHBondContact OD1-SG 3.31Å; V50-C72 HydrophobicContact CG2-CB 3.6Å; M68-C72 PolarHBondContact O-N 3.35Å; M68-C72 PolarHBondContact O-SG 3.44Å; M68-C72 VanDerWaalsContact O-SG 3.4Å; L69-C72 PolarHBondContact O-N 3.37Å; C72-D75 PolarHBondContact O-N 3.16Å; C72-L76 WeakPolarHBondContact O-CB 3.06Å; C72-L76 VanDerWaalsContact O-CG 3.28Å; C72-L76 WeakPolarHBondContact O-CG 3.46Å; C72-L76 PolarHBondContact O-N 3.49Å |
| 73 | I | 95.7 | Very high | 93.1 | Very high | 64 Ų | 64 | 25.1 Ų | 25.1 | 33% | 0.328 | 14% | 0.137 | S | C | . | . | H | α-helix | trans | -63.3 | -46.3 | 175.1 | -69.4 | 165.3 | 0 | 0 | 0 | 110.4 | L69 N70 L71 D75 L76 L77 W154 | L69-I73 HydrophobicContact CG-CD1 4.15Å; L69-I73 VanDerWaalsContact O-CG1 3.32Å; L69-I73 WeakPolarHBondContact O-CG1 3.31Å; L69-I73 PolarHBondContact O-N 3.37Å; N70-I73 PolarHBondContact O-N 3.45Å; L71-I73 VanDerWaalsContact C-N 3.33Å; L71-I73 PolarHBondContact O-N 2.92Å; I73-D75 VanDerWaalsContact C-N 3.33Å; I73-D75 PolarHBondContact O-N 3.47Å; I73-L76 PolarHBondContact O-N 2.86Å; I73-L77 HydrophobicContact CG2-CD1 4.23Å; I73-L77 WeakPolarHBondContact O-CG 3.41Å; I73-L77 PolarHBondContact O-N 3.22Å; I73-W154 HydrophobicContact CG2-CZ2 4.22Å |
| 74 | S | 96.8 | Very high | 93.7 | Very high | 2 Ų | 2 | 26.6 Ų | 26.6 | 1% | 0.014 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -58.1 | -44.6 | 175.1 | 176.1 | 0 | 0 | 0 | 0 | 112 | N70 L71 L77 F78 N112 | N70-S74 WeakPolarHBondContact O-CB 3.2Å; N70-S74 PolarHBondContact O-N 3.17Å; L71-S74 WeakPolarHBondContact O-CB 3.4Å; L71-S74 PolarHBondContact O-N 3.41Å; S74-L77 PolarHBondContact O-N 3.38Å; S74-F78 PolarHBondContact O-N 2.89Å; S74-N112 PolarHBondContact O-ND2 2.66Å; S74-N112 WeakPolarHBondContact OG-CA 3.49Å; S74-N112 PolarHBondContact OG-ND2 3.36Å; S74-N112 VanDerWaalsContact OG-ND2 3.16Å |
| 75 | D | 96.4 | Very high | 94.4 | Very high | 0 Ų | 0 | 26.9 Ų | 26.9 | 0% | 0 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -63.1 | -46.5 | 177.1 | -76.4 | -24.5 | 0 | 0 | 0 | 111.4 | L71 C72 I73 L77 F78 L79 N112 S295 N298 | L71-D75 PolarHBondContact O-N 2.81Å; C72-D75 PolarHBondContact O-N 3.16Å; I73-D75 VanDerWaalsContact C-N 3.33Å; I73-D75 PolarHBondContact O-N 3.47Å; D75-L77 PolarHBondContact O-N 2.96Å; D75-F78 PolarHBondContact O-N 3.3Å; D75-L79 HydrophobicContact CB-CD1 4.46Å; D75-L79 WeakPolarHBondContact O-CB 3.32Å; D75-L79 WeakPolarHBondContact O-CD1 3.39Å; D75-L79 WeakPolarHBondContact O-CG 3.43Å; D75-L79 PolarHBondContact O-N 2.82Å; D75-N112 VanDerWaalsContact CA-ND2 3.33Å; D75-N112 WeakPolarHBondContact CA-ND2 3.31Å; D75-N112 PolarHBondContact N-ND2 2.87Å; D75-N112 PolarHBondContact OD1-ND2 3.16Å; D75-S295 WeakPolarHBondContact OD1-CB 3.12Å; D75-S295 PolarHBondContact OD1-OG 3.42Å; D75-N298 PolarHBondContact OD2-ND2 2.89Å |
| 76 | L | 97.1 | Very high | 94.9 | Very high | 40 Ų | 40 | 25.7 Ų | 25.7 | 21% | 0.209 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -60 | -44.7 | 177.4 | -73.6 | 169.3 | 0 | 0 | 0 | 112.5 | N46 A47 V50 C72 I73 F78 L79 L80 | N46-L76 HydrophobicContact CB-CD1 4.32Å; N46-L76 HydrophobicContact CB-CD2 3.79Å; N46-L76 HydrophobicContact CB-CG 3.74Å; A47-L76 HydrophobicContact CB-CD2 4.44Å; V50-L76 HydrophobicContact CG2-CD1 3.86Å; C72-L76 WeakPolarHBondContact O-CB 3.06Å; C72-L76 VanDerWaalsContact O-CG 3.28Å; C72-L76 WeakPolarHBondContact O-CG 3.46Å; C72-L76 PolarHBondContact O-N 3.49Å; I73-L76 PolarHBondContact O-N 2.86Å; L76-F78 VanDerWaalsContact C-N 3.28Å; L76-F78 PolarHBondContact O-N 2.89Å; L76-L79 PolarHBondContact O-N 3.38Å; L76-L80 VanDerWaalsContact O-CG 3.32Å; L76-L80 WeakPolarHBondContact O-CG 3.49Å; L76-L80 PolarHBondContact O-N 3.2Å; L76-L80 VanDerWaalsContact O-N 3.08Å |
| 77 | L | 96.8 | Very high | 95.3 | Very high | 66 Ų | 66 | 27.3 Ų | 27.3 | 35% | 0.346 | 15% | 0.148 | S | C | . | . | H | α-helix | trans | -58.6 | -40.8 | 177.7 | -72.1 | 174.1 | 0 | 0 | 0 | 112 | I73 S74 D75 L108 W154 | I73-L77 HydrophobicContact CG2-CD1 4.23Å; I73-L77 WeakPolarHBondContact O-CG 3.41Å; I73-L77 PolarHBondContact O-N 3.22Å; S74-L77 PolarHBondContact O-N 3.38Å; D75-L77 PolarHBondContact O-N 2.96Å; L77-L108 HydrophobicContact CB-CD2 4.37Å; L77-W154 HydrophobicContact CD1-CH2 4.18Å |
| 78 | F | 96.8 | Very high | 95.4 | Very high | 1 Ų | 1 | 28 Ų | 28 | 0% | 0.004 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -70.5 | -45.1 | 175.7 | 156.9 | -108.7 | 0 | 0 | 0 | 112.6 | S74 D75 L76 L80 T81 L82 L109 N112 F292 | S74-F78 PolarHBondContact O-N 2.89Å; D75-F78 PolarHBondContact O-N 3.3Å; L76-F78 VanDerWaalsContact C-N 3.28Å; L76-F78 PolarHBondContact O-N 2.89Å; F78-L80 PolarHBondContact O-N 3.45Å; F78-T81 WeakPolarHBondContact O-CA 3.33Å; F78-T81 WeakPolarHBondContact O-CB 3.32Å; F78-T81 PolarHBondContact O-N 3.4Å; F78-T81 PolarHBondContact O-OG1 2.89Å; F78-L82 HydrophobicContact CE1-CD1 4.12Å; F78-L82 HydrophobicContact CE1-CD2 4.45Å; F78-L82 HydrophobicContact CE1-CG 4.25Å; F78-L82 HydrophobicContact CE2-CD2 3.9Å; F78-L82 HydrophobicContact CE2-CG 4.2Å; F78-L82 HydrophobicContact CZ-CD1 4.05Å; F78-L82 HydrophobicContact CZ-CD2 3.58Å; F78-L82 HydrophobicContact CZ-CG 3.81Å; F78-L109 HydrophobicContact CD2-CB 4.4Å; F78-L109 HydrophobicContact CE2-CG 4.34Å; F78-N112 HydrophobicContact CB-CB 3.48Å; F78-N112 VanDerWaalsContact CB-CB 3.48Å; F78-N112 HydrophobicContact CG-CB 4.01Å; F78-F292 HydrophobicContact CE1-CB 4.09Å; F78-F292 HydrophobicContact CE1-CD1 4.31Å; F78-F292 HydrophobicContact CE1-CG 4.21Å; F78-F292 HydrophobicContact CE2-CD1 4.02Å; F78-F292 HydrophobicContact CE2-CD2 4.32Å; F78-F292 HydrophobicContact CE2-CE1 4.06Å; F78-F292 HydrophobicContact CE2-CE2 4.35Å; F78-F292 HydrophobicContact CE2-CG 4.19Å; F78-F292 HydrophobicContact CE2-CZ 4.25Å; F78-F292 HydrophobicContact CZ-CB 3.72Å; F78-F292 AromaticContact CZ-CD1 3.5Å; F78-F292 HydrophobicContact CZ-CD1 3.5Å; F78-F292 AromaticContact CZ-CD2 3.76Å; F78-F292 HydrophobicContact CZ-CD2 3.76Å; F78-F292 HydrophobicContact CZ-CE1 4.02Å; F78-F292 HydrophobicContact CZ-CE2 4.23Å; F78-F292 AromaticContact CZ-CG 3.39Å; F78-F292 HydrophobicContact CZ-CG 3.39Å; F78-F292 HydrophobicContact CZ-CZ 4.38Å |
| 79 | L | 97.4 | Very high | 95.6 | Very high | 0 Ų | 0 | 28.5 Ų | 28.5 | 0% | 0 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -60 | -32.5 | -178.6 | -70.2 | 163 | 0 | 0 | 0 | 112.1 | I38 G42 T43 D75 L76 T81 L82 P83 | I38-L79 HydrophobicContact CG2-CD2 3.87Å; G42-L79 WeakPolarHBondContact O-CD1 3.41Å; T43-L79 HydrophobicContact CG2-CB 3.81Å; T43-L79 HydrophobicContact CG2-CD1 4.3Å; D75-L79 HydrophobicContact CB-CD1 4.46Å; D75-L79 WeakPolarHBondContact O-CB 3.32Å; D75-L79 WeakPolarHBondContact O-CD1 3.39Å; D75-L79 WeakPolarHBondContact O-CG 3.43Å; D75-L79 PolarHBondContact O-N 2.82Å; L76-L79 PolarHBondContact O-N 3.38Å; L79-T81 PolarHBondContact O-N 3.12Å; L79-L82 HydrophobicContact CD2-CD1 3.82Å; L79-L82 PolarHBondContact O-N 2.76Å; L79-P83 WeakPolarHBondContact O-CD 3.3Å |
| 80 | L | 96.3 | Very high | 95.8 | Very high | 123 Ų | 123 | 29.5 Ų | 29.5 | 64% | 0.644 | 16% | 0.162 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -59.9 | -23.1 | 172.5 | -70.6 | 172.2 | 0 | 0 | 0 | 113.5 | L76 F78 | L76-L80 VanDerWaalsContact O-CG 3.32Å; L76-L80 WeakPolarHBondContact O-CG 3.49Å; L76-L80 PolarHBondContact O-N 3.2Å; L76-L80 VanDerWaalsContact O-N 3.08Å; F78-L80 PolarHBondContact O-N 3.45Å |
| 81 | T | 96.6 | Very high | 95.7 | Very high | 6 Ų | 6 | 36.8 Ų | 36.8 | 4% | 0.037 | 19% | 0.188 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -88.3 | -21.2 | 179.1 | 74.9 | 0 | 0 | 0 | 0 | 113.4 | F78 L79 L84 W85 C105 L108 | F78-T81 WeakPolarHBondContact O-CA 3.33Å; F78-T81 WeakPolarHBondContact O-CB 3.32Å; F78-T81 PolarHBondContact O-N 3.4Å; F78-T81 PolarHBondContact O-OG1 2.89Å; L79-T81 PolarHBondContact O-N 3.12Å; T81-L84 WeakPolarHBondContact O-CB 3.45Å; T81-L84 PolarHBondContact O-N 3.34Å; T81-L84 VanDerWaalsContact O-N 3.11Å; T81-W85 PolarHBondContact O-N 3.28Å; T81-C105 HydrophobicContact CG2-CB 4.24Å; T81-L108 HydrophobicContact CG2-CB 3.91Å; T81-L108 HydrophobicContact CG2-CD1 3.57Å; T81-L108 HydrophobicContact CG2-CG 4.39Å |
| 82 | L | 96.3 | Very high | 95.5 | Very high | 0 Ų | 0 | 38.3 Ų | 38.3 | 0% | 0 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -58.8 | -38.3 | -175.9 | -79.1 | -175.8 | 0 | 0 | 0 | 114.5 | Y35 I38 C39 F78 L79 L84 W85 A86 F292 | Y35-L82 HydrophobicContact CD1-CD2 4.26Å; Y35-L82 HydrophobicContact CD2-CD2 4.08Å; Y35-L82 HydrophobicContact CE2-CD2 4.47Å; Y35-L82 HydrophobicContact CG-CD2 3.98Å; I38-L82 HydrophobicContact CB-CD1 3.96Å; I38-L82 HydrophobicContact CG2-CD1 3.52Å; C39-L82 HydrophobicContact CB-CB 4.17Å; C39-L82 HydrophobicContact CB-CD1 4.37Å; F78-L82 HydrophobicContact CE1-CD1 4.12Å; F78-L82 HydrophobicContact CE1-CD2 4.45Å; F78-L82 HydrophobicContact CE1-CG 4.25Å; F78-L82 HydrophobicContact CE2-CD2 3.9Å; F78-L82 HydrophobicContact CE2-CG 4.2Å; F78-L82 HydrophobicContact CZ-CD1 4.05Å; F78-L82 HydrophobicContact CZ-CD2 3.58Å; F78-L82 HydrophobicContact CZ-CG 3.81Å; L79-L82 HydrophobicContact CD2-CD1 3.82Å; L79-L82 PolarHBondContact O-N 2.76Å; L82-L84 VanDerWaalsContact C-N 3.27Å; L82-L84 PolarHBondContact O-N 2.92Å; L82-W85 PolarHBondContact O-N 3.25Å; L82-A86 WeakPolarHBondContact O-CB 3.37Å; L82-A86 PolarHBondContact O-N 3.31Å; L82-F292 HydrophobicContact CD2-CD2 3.83Å; L82-F292 HydrophobicContact CD2-CE2 4.21Å |
| 83 | P | 97 | Very high | 95.4 | Very high | 56 Ų | 56 | 41.9 Ų | 41.9 | 36% | 0.364 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -59.3 | -37.6 | 175.3 | -26.8 | 36 | 0 | 0 | 0 | 113.1 | L79 A86 V87 | L79-P83 WeakPolarHBondContact O-CD 3.3Å; P83-A86 WeakPolarHBondContact O-CB 3.23Å; P83-A86 PolarHBondContact O-N 2.74Å; P83-V87 WeakPolarHBondContact O-CG2 3.19Å; P83-V87 PolarHBondContact O-N 3.3Å |
| 84 | L | 97.3 | Very high | 95.2 | Very high | 44 Ų | 44 | 40 Ų | 40 | 23% | 0.23 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -68.7 | -39.8 | 177.9 | -79.2 | 64.5 | 0 | 0 | 0 | 110.7 | T81 L82 V87 Y88 W95 F97 A101 C105 | T81-L84 WeakPolarHBondContact O-CB 3.45Å; T81-L84 PolarHBondContact O-N 3.34Å; T81-L84 VanDerWaalsContact O-N 3.11Å; L82-L84 VanDerWaalsContact C-N 3.27Å; L82-L84 PolarHBondContact O-N 2.92Å; L84-V87 PolarHBondContact O-N 3.49Å; L84-Y88 PolarHBondContact O-N 3.4Å; L84-W95 HydrophobicContact CB-CH2 3.86Å; L84-W95 HydrophobicContact CB-CZ3 4.37Å; L84-W95 HydrophobicContact CD2-CH2 4.31Å; L84-W95 HydrophobicContact CD2-CZ2 4.4Å; L84-F97 HydrophobicContact CB-CD2 4.02Å; L84-F97 HydrophobicContact CB-CE2 3.8Å; L84-F97 HydrophobicContact CB-CZ 4.3Å; L84-F97 HydrophobicContact CD2-CB 4.43Å; L84-F97 HydrophobicContact CD2-CD1 4.43Å; L84-F97 HydrophobicContact CD2-CD2 4.18Å; L84-F97 HydrophobicContact CD2-CG 4.09Å; L84-F97 HydrophobicContact CG-CD1 4.25Å; L84-F97 HydrophobicContact CG-CD2 3.92Å; L84-F97 HydrophobicContact CG-CE1 4.17Å; L84-F97 HydrophobicContact CG-CE2 3.85Å; L84-F97 HydrophobicContact CG-CG 4.12Å; L84-F97 HydrophobicContact CG-CZ 3.97Å; L84-F97 WeakPolarHBondContact O-CE2 3.38Å; L84-A101 HydrophobicContact CD2-CB 4.41Å; L84-C105 VanDerWaalsContact CD2-SG 3.59Å |
| 85 | W | 96 | Very high | 95.2 | Very high | 16 Ų | 16 | 40.2 Ų | 40.2 | 6% | 0.061 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -65.6 | -37.5 | 172.7 | -66.9 | 115.9 | 0 | 0 | 0 | 112.5 | Y35 T81 L82 V87 Y88 Y89 W95 C105 | Y35-W85 HydrophobicContact CD2-CB 3.79Å; Y35-W85 HydrophobicContact CE2-CB 3.72Å; T81-W85 PolarHBondContact O-N 3.28Å; L82-W85 PolarHBondContact O-N 3.25Å; W85-V87 VanDerWaalsContact C-N 3.34Å; W85-V87 PolarHBondContact O-N 2.87Å; W85-Y88 HydrophobicContact CE3-CD1 4.16Å; W85-Y88 HydrophobicContact CE3-CG 4.43Å; W85-Y88 HydrophobicContact CZ3-CD1 4.46Å; W85-Y88 WeakPolarHBondContact O-CB 3.34Å; W85-Y88 PolarHBondContact O-N 2.94Å; W85-Y89 VanDerWaalsContact O-CD2 3.28Å; W85-Y89 WeakPolarHBondContact O-CD2 3.46Å; W85-Y89 PolarHBondContact O-N 3.18Å; W85-W95 HydrophobicContact CD2-CZ3 4.16Å; W85-W95 HydrophobicContact CE3-CE3 4.47Å; W85-W95 AromaticContact CE3-CZ3 3.8Å; W85-W95 HydrophobicContact CE3-CZ3 3.8Å; W85-W95 HydrophobicContact CH2-CZ3 4.24Å; W85-W95 HydrophobicContact CZ3-CE3 4.27Å; W85-W95 AromaticContact CZ3-CZ3 3.84Å; W85-W95 HydrophobicContact CZ3-CZ3 3.84Å; W85-C105 HydrophobicContact CZ2-CB 3.88Å |
| 86 | A | 96 | Very high | 95.1 | Very high | 8 Ų | 8 | 43.9 Ų | 43.9 | 7% | 0.066 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -61.7 | -43.6 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.1 | P32 L82 P83 Y89 S90 | P32-A86 HydrophobicContact CB-CB 4.04Å; P32-A86 VanDerWaalsContact CG-O 3.3Å; P32-A86 WeakPolarHBondContact CG-O 3.15Å; L82-A86 WeakPolarHBondContact O-CB 3.37Å; L82-A86 PolarHBondContact O-N 3.31Å; P83-A86 WeakPolarHBondContact O-CB 3.23Å; P83-A86 PolarHBondContact O-N 2.74Å; A86-Y89 PolarHBondContact O-N 3.4Å; A86-S90 PolarHBondContact O-N 2.88Å; A86-S90 PolarHBondContact O-OG 3.4Å |
| 87 | V | 96.2 | Very high | 95.1 | Very high | 49 Ų | 49 | 45.9 Ų | 45.9 | 30% | 0.297 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -63.3 | -41.6 | 173.8 | 173.1 | 0 | 0 | 0 | 0 | 111.7 | P83 L84 W85 Y89 S90 W91 P96 F97 | P83-V87 WeakPolarHBondContact O-CG2 3.19Å; P83-V87 PolarHBondContact O-N 3.3Å; L84-V87 PolarHBondContact O-N 3.49Å; W85-V87 VanDerWaalsContact C-N 3.34Å; W85-V87 PolarHBondContact O-N 2.87Å; V87-Y89 VanDerWaalsContact C-N 3.33Å; V87-Y89 PolarHBondContact O-N 3.49Å; V87-S90 WeakPolarHBondContact CA-OG 3.25Å; V87-S90 PolarHBondContact O-N 3.24Å; V87-S90 PolarHBondContact O-OG 3.42Å; V87-S90 VanDerWaalsContact O-OG 3.14Å; V87-W91 HydrophobicContact CG1-CE3 4.42Å; V87-W91 VanDerWaalsContact O-CB 3.29Å; V87-W91 WeakPolarHBondContact O-CB 3.48Å; V87-W91 PolarHBondContact O-N 2.87Å; V87-P96 HydrophobicContact CG1-CG 4.12Å; V87-F97 HydrophobicContact CB-CE2 3.93Å; V87-F97 HydrophobicContact CB-CZ 3.73Å; V87-F97 HydrophobicContact CG1-CE2 3.93Å; V87-F97 HydrophobicContact CG1-CZ 3.66Å; V87-F97 HydrophobicContact CG2-CZ 4.11Å |
| 88 | Y | 94.3 | Very high | 95 | Very high | 23 Ų | 23 | 44.3 Ų | 44.3 | 9% | 0.09 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -56.1 | -46.3 | 175.9 | 168.8 | -100.7 | 0 | 0 | 0 | 112.3 | L84 W85 Y93 W95 | L84-Y88 PolarHBondContact O-N 3.4Å; W85-Y88 HydrophobicContact CE3-CD1 4.16Å; W85-Y88 HydrophobicContact CE3-CG 4.43Å; W85-Y88 HydrophobicContact CZ3-CD1 4.46Å; W85-Y88 WeakPolarHBondContact O-CB 3.34Å; W85-Y88 PolarHBondContact O-N 2.94Å; Y88-Y93 HydrophobicContact CE1-CD1 4.02Å; Y88-Y93 WeakPolarHBondContact CE2-O 3.23Å; Y88-Y93 WeakPolarHBondContact O-CA 3.13Å; Y88-Y93 PolarHBondContact O-N 3.36Å; Y88-W95 HydrophobicContact CD2-CB 3.96Å; Y88-W95 AromaticContact CD2-CE3 3.88Å; Y88-W95 HydrophobicContact CD2-CE3 3.88Å; Y88-W95 HydrophobicContact CE2-CB 4.33Å; Y88-W95 HydrophobicContact CG-CE3 4.06Å |
| 89 | Y | 92.8 | Very high | 94.9 | Very high | 30 Ų | 30 | 50.9 Ų | 50.9 | 12% | 0.118 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -72.5 | -36.5 | 178 | -81.3 | -81.8 | 0 | 0 | 0 | 112.8 | T28 I31 Y35 W85 A86 V87 W91 G92 Y93 | T28-Y89 WeakPolarHBondContact CA-O 3.37Å; T28-Y89 WeakPolarHBondContact CB-O 3.36Å; T28-Y89 WeakPolarHBondContact CG2-O 3.18Å; I31-Y89 HydrophobicContact CB-CD1 4.21Å; I31-Y89 HydrophobicContact CB-CG 4.15Å; I31-Y89 HydrophobicContact CD1-CD1 3.58Å; I31-Y89 HydrophobicContact CD1-CE1 3.41Å; I31-Y89 VanDerWaalsContact CD1-CE1 3.41Å; I31-Y89 HydrophobicContact CD1-CG 4.33Å; I31-Y89 HydrophobicContact CG2-CD1 4.02Å; I31-Y89 HydrophobicContact CG2-CD2 3.55Å; I31-Y89 HydrophobicContact CG2-CE1 4.22Å; I31-Y89 HydrophobicContact CG2-CE2 3.82Å; I31-Y89 HydrophobicContact CG2-CG 3.68Å; Y35-Y89 AromaticContact CE2-CD2 3.84Å; Y35-Y89 HydrophobicContact CE2-CD2 3.84Å; Y35-Y89 AromaticContact CE2-CE2 3.74Å; Y35-Y89 HydrophobicContact CE2-CE2 3.74Å; W85-Y89 VanDerWaalsContact O-CD2 3.28Å; W85-Y89 WeakPolarHBondContact O-CD2 3.46Å; W85-Y89 PolarHBondContact O-N 3.18Å; A86-Y89 PolarHBondContact O-N 3.4Å; V87-Y89 VanDerWaalsContact C-N 3.33Å; V87-Y89 PolarHBondContact O-N 3.49Å; Y89-W91 VanDerWaalsContact C-N 3.32Å; Y89-G92 PolarHBondContact O-N 2.93Å; Y89-Y93 AromaticContact CD1-CD1 3.96Å; Y89-Y93 HydrophobicContact CD1-CD1 3.96Å; Y89-Y93 AromaticContact CD1-CE1 3.46Å; Y89-Y93 HydrophobicContact CD1-CE1 3.46Å; Y89-Y93 VanDerWaalsContact CD1-CE1 3.46Å; Y89-Y93 HydrophobicContact CE1-CD1 4.04Å; Y89-Y93 AromaticContact CE1-CE1 3.45Å; Y89-Y93 HydrophobicContact CE1-CE1 3.45Å; Y89-Y93 VanDerWaalsContact CE1-CE1 3.45Å |
| 90 | S | 93.7 | Very high | 94.9 | Very high | 67 Ų | 67 | 55.9 Ų | 55.9 | 47% | 0.469 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -71.6 | -28.1 | 178.6 | 69 | 0 | 0 | 0 | 0 | 112.9 | T28 A86 V87 G92 | T28-S90 WeakPolarHBondContact O-CA 3.28Å; A86-S90 PolarHBondContact O-N 2.88Å; A86-S90 PolarHBondContact O-OG 3.4Å; V87-S90 WeakPolarHBondContact CA-OG 3.25Å; V87-S90 PolarHBondContact O-N 3.24Å; V87-S90 PolarHBondContact O-OG 3.42Å; V87-S90 VanDerWaalsContact O-OG 3.14Å; S90-G92 PolarHBondContact O-N 3.11Å |
| 91 | W | 92.9 | Very high | 94.9 | Very high | 177 Ų | 177 | 51 Ų | 51 | 67% | 0.67 | 28% | 0.275 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -88.2 | 31.1 | 175.6 | -145.6 | -65.5 | 0 | 0 | 0 | 112.8 | V87 Y89 Y93 S94 | V87-W91 HydrophobicContact CG1-CE3 4.42Å; V87-W91 VanDerWaalsContact O-CB 3.29Å; V87-W91 WeakPolarHBondContact O-CB 3.48Å; V87-W91 PolarHBondContact O-N 2.87Å; Y89-W91 VanDerWaalsContact C-N 3.32Å; W91-Y93 VanDerWaalsContact C-N 3.33Å; W91-Y93 PolarHBondContact O-N 3.32Å; W91-S94 WeakPolarHBondContact O-CB 3.32Å; W91-S94 PolarHBondContact O-N 2.88Å |
| 92 | G | 89.9 | Confident | 94.9 | Very high | 32 Ų | 32 | 50.8 Ų | 50.8 | 33% | 0.33 | 27% | 0.273 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 58.9 | 41.5 | 175.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | Y89 S90 S94 | Y89-G92 PolarHBondContact O-N 2.93Å; S90-G92 PolarHBondContact O-N 3.11Å; G92-S94 VanDerWaalsContact C-N 3.28Å; G92-S94 PolarHBondContact O-N 2.84Å |
| 93 | Y | 90.3 | Very high | 94.9 | Very high | 75 Ų | 75 | 52.6 Ų | 52.6 | 29% | 0.294 | 28% | 0.281 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 68.1 | 22.7 | 178.2 | -46.7 | -93.3 | 0 | 0 | 0 | 114.4 | M27 T28 Y88 Y89 W91 | M27-Y93 PolarHBondContact N-OH 3.47Å; T28-Y93 HydrophobicContact CG2-CE2 4.25Å; Y88-Y93 HydrophobicContact CE1-CD1 4.02Å; Y88-Y93 WeakPolarHBondContact CE2-O 3.23Å; Y88-Y93 WeakPolarHBondContact O-CA 3.13Å; Y88-Y93 PolarHBondContact O-N 3.36Å; Y89-Y93 AromaticContact CD1-CD1 3.96Å; Y89-Y93 HydrophobicContact CD1-CD1 3.96Å; Y89-Y93 AromaticContact CD1-CE1 3.46Å; Y89-Y93 HydrophobicContact CD1-CE1 3.46Å; Y89-Y93 VanDerWaalsContact CD1-CE1 3.46Å; Y89-Y93 HydrophobicContact CE1-CD1 4.04Å; Y89-Y93 AromaticContact CE1-CE1 3.45Å; Y89-Y93 HydrophobicContact CE1-CE1 3.45Å; Y89-Y93 VanDerWaalsContact CE1-CE1 3.45Å; W91-Y93 VanDerWaalsContact C-N 3.33Å; W91-Y93 PolarHBondContact O-N 3.32Å |
| 94 | S | 93.4 | Very high | 94.8 | Very high | 25 Ų | 25 | 54.1 Ų | 54.1 | 18% | 0.175 | 29% | 0.285 | C | S | . | . | trans | -96.4 | 134.8 | 170.7 | -164.5 | 0 | 0 | 0 | 0 | 111.1 | W91 G92 P96 V179 | W91-S94 WeakPolarHBondContact O-CB 3.32Å; W91-S94 PolarHBondContact O-N 2.88Å; G92-S94 VanDerWaalsContact C-N 3.28Å; G92-S94 PolarHBondContact O-N 2.84Å; S94-P96 VanDerWaalsContact O-CD 3.28Å; S94-P96 WeakPolarHBondContact O-CD 3.16Å; S94-V179 CarbonylContact C-O 3.59Å | ||
| 95 | W | 95.7 | Very high | 94.8 | Very high | 6 Ų | 6 | 52.4 Ų | 52.4 | 2% | 0.023 | 28% | 0.276 | C | S | . | . | trans | -103.8 | 101.2 | -176.2 | -177.2 | -90.9 | 0 | 0 | 0 | 111.3 | L84 W85 Y88 F97 G98 A101 C102 C105 T170 V179 C181 | L84-W95 HydrophobicContact CB-CH2 3.86Å; L84-W95 HydrophobicContact CB-CZ3 4.37Å; L84-W95 HydrophobicContact CD2-CH2 4.31Å; L84-W95 HydrophobicContact CD2-CZ2 4.4Å; W85-W95 HydrophobicContact CD2-CZ3 4.16Å; W85-W95 HydrophobicContact CE3-CE3 4.47Å; W85-W95 AromaticContact CE3-CZ3 3.8Å; W85-W95 HydrophobicContact CE3-CZ3 3.8Å; W85-W95 HydrophobicContact CH2-CZ3 4.24Å; W85-W95 HydrophobicContact CZ3-CE3 4.27Å; W85-W95 AromaticContact CZ3-CZ3 3.84Å; W85-W95 HydrophobicContact CZ3-CZ3 3.84Å; Y88-W95 HydrophobicContact CD2-CB 3.96Å; Y88-W95 AromaticContact CD2-CE3 3.88Å; Y88-W95 HydrophobicContact CD2-CE3 3.88Å; Y88-W95 HydrophobicContact CE2-CB 4.33Å; Y88-W95 HydrophobicContact CG-CE3 4.06Å; W95-F97 HydrophobicContact CD2-CD2 4.12Å; W95-F97 AromaticContact CE2-CD2 3.85Å; W95-F97 HydrophobicContact CE3-CD2 4.3Å; W95-F97 HydrophobicContact CH2-CD2 4.02Å; W95-F97 HydrophobicContact CZ2-CB 3.9Å; W95-F97 AromaticContact CZ2-CD2 3.81Å; W95-F97 HydrophobicContact CZ2-CD2 3.81Å; W95-F97 HydrophobicContact CZ2-CG 4.29Å; W95-F97 HydrophobicContact CZ3-CD2 4.26Å; W95-G98 PolarHBondContact NE1-O 3.24Å; W95-A101 HydrophobicContact CZ2-CB 3.86Å; W95-C102 HydrophobicContact CD2-CB 4.41Å; W95-C102 HydrophobicContact CZ2-CB 4.29Å; W95-C105 HydrophobicContact CH2-CB 4.01Å; W95-T170 HydrophobicContact CG-CG2 4.48Å; W95-V179 WeakPolarHBondContact CB-O 3.47Å; W95-V179 PolarHBondContact N-O 3.32Å; W95-C181 HydrophobicContact CB-CB 3.86Å; W95-C181 HydrophobicContact CD2-CB 3.72Å; W95-C181 HydrophobicContact CE3-CB 3.9Å; W95-C181 HydrophobicContact CG-CB 3.68Å | ||
| 96 | P | 95.2 | Very high | 94.7 | Very high | 77 Ų | 77 | 51.7 Ų | 51.7 | 50% | 0.5 | 27% | 0.274 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -85.6 | -12.3 | -174.7 | 33.6 | -36.9 | 0 | 0 | 0 | 114.1 | V87 S94 G98 | V87-P96 HydrophobicContact CG1-CG 4.12Å; S94-P96 VanDerWaalsContact O-CD 3.28Å; S94-P96 WeakPolarHBondContact O-CD 3.16Å; P96-G98 PolarHBondContact O-N 2.96Å |
| 97 | F | 96.1 | Very high | 94.6 | Very high | 83 Ų | 83 | 52 Ų | 52 | 36% | 0.364 | 28% | 0.275 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -84.2 | 5.2 | -169.6 | -50.5 | -73.9 | 0 | 0 | 0 | 114.4 | L84 V87 W95 A101 | L84-F97 HydrophobicContact CB-CD2 4.02Å; L84-F97 HydrophobicContact CB-CE2 3.8Å; L84-F97 HydrophobicContact CB-CZ 4.3Å; L84-F97 HydrophobicContact CD2-CB 4.43Å; L84-F97 HydrophobicContact CD2-CD1 4.43Å; L84-F97 HydrophobicContact CD2-CD2 4.18Å; L84-F97 HydrophobicContact CD2-CG 4.09Å; L84-F97 HydrophobicContact CG-CD1 4.25Å; L84-F97 HydrophobicContact CG-CD2 3.92Å; L84-F97 HydrophobicContact CG-CE1 4.17Å; L84-F97 HydrophobicContact CG-CE2 3.85Å; L84-F97 HydrophobicContact CG-CG 4.12Å; L84-F97 HydrophobicContact CG-CZ 3.97Å; L84-F97 WeakPolarHBondContact O-CE2 3.38Å; V87-F97 HydrophobicContact CB-CE2 3.93Å; V87-F97 HydrophobicContact CB-CZ 3.73Å; V87-F97 HydrophobicContact CG1-CE2 3.93Å; V87-F97 HydrophobicContact CG1-CZ 3.66Å; V87-F97 HydrophobicContact CG2-CZ 4.11Å; W95-F97 HydrophobicContact CD2-CD2 4.12Å; W95-F97 AromaticContact CE2-CD2 3.85Å; W95-F97 HydrophobicContact CE3-CD2 4.3Å; W95-F97 HydrophobicContact CH2-CD2 4.02Å; W95-F97 HydrophobicContact CZ2-CB 3.9Å; W95-F97 AromaticContact CZ2-CD2 3.81Å; W95-F97 HydrophobicContact CZ2-CD2 3.81Å; W95-F97 HydrophobicContact CZ2-CG 4.29Å; W95-F97 HydrophobicContact CZ3-CD2 4.26Å; F97-A101 HydrophobicContact CB-CB 3.66Å; F97-A101 WeakPolarHBondContact O-CB 3.38Å |
| 98 | G | 95.2 | Very high | 94.7 | Very high | 33 Ų | 33 | 51.4 Ų | 51.4 | 34% | 0.34 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | 73.4 | 176.7 | 179.3 | 0 | 0 | 0 | 0 | 0 | 115.1 | W95 P96 V100 C102 | W95-G98 PolarHBondContact NE1-O 3.24Å; P96-G98 PolarHBondContact O-N 2.96Å; G98-V100 PolarHBondContact O-N 3.2Å; G98-C102 PolarHBondContact O-N 3.29Å |
| 99 | R | 95.4 | Very high | 94.7 | Very high | 138 Ų | 138 | 51.4 Ų | 51.4 | 52% | 0.521 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -58.4 | -47.2 | -171.9 | 173.5 | 169.5 | -167 | -154.2 | 9.8 | 114.4 | C102 K103 E169 | R99-C102 WeakPolarHBondContact O-CB 3.41Å; R99-C102 PolarHBondContact O-N 2.97Å; R99-K103 PolarHBondContact O-N 2.87Å; R99-K103 VanDerWaalsContact O-N 3.1Å; R99-E169 WeakPolarHBondContact CD-OE1 3.28Å; R99-E169 WeakPolarHBondContact CG-OE1 3.49Å; R99-E169 IonicContact CZ-OE1 3.28Å; R99-E169 IonicContact CZ-OE2 2.95Å; R99-E169 IonicContact NE-OE1 2.7Å; R99-E169 PolarHBondContact NE-OE1 3.44Å; R99-E169 IonicContact NE-OE2 3.68Å; R99-E169 PolarHBondContact NE-OE2 3.3Å; R99-E169 IonicContact NH2-OE1 2.68Å; R99-E169 IonicContact NH2-OE2 3.43Å; R99-E169 PolarHBondContact NH2-OE2 2.84Å |
| 100 | V | 95.9 | Very high | 94.8 | Very high | 105 Ų | 105 | 50.3 Ų | 50.3 | 64% | 0.636 | 27% | 0.268 | S | S | * | . | H | α-helix | trans | -64.1 | -46.1 | -174.6 | 176.6 | 0 | 0 | 0 | 0 | 110.7 | G98 C102 K103 I104 | G98-V100 PolarHBondContact O-N 3.2Å; V100-C102 PolarHBondContact O-N 3.34Å; V100-K103 PolarHBondContact O-N 3.34Å; V100-I104 HydrophobicContact CG1-CD1 3.7Å; V100-I104 HydrophobicContact CG1-CG1 4.42Å; V100-I104 WeakPolarHBondContact O-CG1 3.17Å; V100-I104 PolarHBondContact O-N 2.67Å |
| 101 | A | 96.3 | Very high | 94.9 | Very high | 22 Ų | 22 | 47.3 Ų | 47.3 | 18% | 0.182 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -63.6 | -41.3 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | L84 W95 F97 K103 I104 C105 | L84-A101 HydrophobicContact CD2-CB 4.41Å; W95-A101 HydrophobicContact CZ2-CB 3.86Å; F97-A101 HydrophobicContact CB-CB 3.66Å; F97-A101 WeakPolarHBondContact O-CB 3.38Å; A101-K103 VanDerWaalsContact C-N 3.3Å; A101-K103 PolarHBondContact O-N 3.45Å; A101-I104 PolarHBondContact O-N 2.89Å; A101-C105 VanDerWaalsContact O-CB 3.26Å; A101-C105 WeakPolarHBondContact O-CB 3.48Å; A101-C105 PolarHBondContact O-N 3.46Å; A101-C105 PolarHBondContact O-SG 3.4Å |
| 102 | C | 96.6 | Very high | 95.1 | Very high | 0 Ų | 0 | 39 Ų | 39 | 0% | 0 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -55.7 | -46.1 | 176.4 | 170.8 | 0 | 0 | 0 | 0 | 111.9 | W95 G98 R99 V100 G106 R168 T170 C181 | W95-C102 HydrophobicContact CD2-CB 4.41Å; W95-C102 HydrophobicContact CZ2-CB 4.29Å; G98-C102 PolarHBondContact O-N 3.29Å; R99-C102 WeakPolarHBondContact O-CB 3.41Å; R99-C102 PolarHBondContact O-N 2.97Å; V100-C102 PolarHBondContact O-N 3.34Å; C102-G106 PolarHBondContact O-N 2.96Å; C102-G106 VanDerWaalsContact O-N 3.13Å; C102-R168 WeakPolarHBondContact O-CD 3.49Å; C102-T170 HydrophobicContact CB-CG2 3.66Å; C102-C181 WeakPolarHBondContact CA-SG 3.31Å; C102-C181 HydrophobicContact CB-CB 3.87Å; C102-C181 WeakPolarHBondContact CB-SG 3.41Å; C102-C181 VanDerWaalsContact SG-CA 3.51Å; C102-C181 WeakPolarHBondContact SG-CB 3.46Å; C102-C181 CovalentContact SG-SG 2.02Å; C102-C181 PolarHBondContact SG-SG 3.21Å |
| 103 | K | 96.4 | Very high | 95.3 | Very high | 39 Ų | 39 | 37.4 Ų | 37.4 | 17% | 0.17 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -64.6 | -50.2 | 177 | -77.6 | -169.6 | 175.7 | -157.9 | 0 | 112.4 | R99 V100 A101 T107 L165 R168 E169 | R99-K103 PolarHBondContact O-N 2.87Å; R99-K103 VanDerWaalsContact O-N 3.1Å; V100-K103 PolarHBondContact O-N 3.34Å; A101-K103 VanDerWaalsContact C-N 3.3Å; A101-K103 PolarHBondContact O-N 3.45Å; K103-T107 VanDerWaalsContact O-CB 3.31Å; K103-T107 WeakPolarHBondContact O-CB 3.45Å; K103-T107 PolarHBondContact O-N 3.45Å; K103-T107 PolarHBondContact O-OG1 2.8Å; K103-L165 HydrophobicContact CB-CD1 3.99Å; K103-R168 WeakPolarHBondContact CE-O 3.35Å; K103-R168 VanDerWaalsContact CG-O 3.29Å; K103-R168 WeakPolarHBondContact CG-O 3.18Å; K103-E169 VanDerWaalsContact CE-OE2 3.3Å; K103-E169 WeakPolarHBondContact CE-OE2 3.41Å; K103-E169 IonicContact NZ-OE2 3.92Å; K103-E169 PolarHBondContact NZ-OE2 3.43Å |
| 104 | I | 95.9 | Very high | 95.6 | Very high | 88 Ų | 88 | 33.9 Ų | 33.9 | 45% | 0.451 | 19% | 0.185 | S | C | . | . | H | α-helix | trans | -64.1 | -50.8 | -178 | -67.5 | 172.4 | 0 | 0 | 0 | 110.8 | V100 A101 G106 T107 L108 | V100-I104 HydrophobicContact CG1-CD1 3.7Å; V100-I104 HydrophobicContact CG1-CG1 4.42Å; V100-I104 WeakPolarHBondContact O-CG1 3.17Å; V100-I104 PolarHBondContact O-N 2.67Å; A101-I104 PolarHBondContact O-N 2.89Å; I104-G106 PolarHBondContact O-N 2.83Å; I104-T107 PolarHBondContact O-N 3.09Å; I104-T107 VanDerWaalsContact O-N 3.16Å; I104-L108 HydrophobicContact CG2-CD1 3.8Å; I104-L108 HydrophobicContact CG2-CG 4.22Å; I104-L108 WeakPolarHBondContact O-CB 3.36Å; I104-L108 WeakPolarHBondContact O-CG 3.15Å; I104-L108 PolarHBondContact O-N 3.3Å |
| 105 | C | 96.3 | Very high | 95.8 | Very high | 7 Ų | 7 | 32.7 Ų | 32.7 | 5% | 0.047 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -61.5 | -42.8 | -178.4 | -66.9 | 0 | 0 | 0 | 0 | 112 | T81 L84 W85 W95 A101 T107 L108 L109 | T81-C105 HydrophobicContact CG2-CB 4.24Å; L84-C105 VanDerWaalsContact CD2-SG 3.59Å; W85-C105 HydrophobicContact CZ2-CB 3.88Å; W95-C105 HydrophobicContact CH2-CB 4.01Å; A101-C105 VanDerWaalsContact O-CB 3.26Å; A101-C105 WeakPolarHBondContact O-CB 3.48Å; A101-C105 PolarHBondContact O-N 3.46Å; A101-C105 PolarHBondContact O-SG 3.4Å; C105-T107 VanDerWaalsContact C-N 3.33Å; C105-T107 PolarHBondContact O-N 2.84Å; C105-L108 PolarHBondContact O-N 3.41Å; C105-L109 PolarHBondContact O-N 2.78Å; C105-L109 VanDerWaalsContact O-N 3.14Å |
| 106 | G | 93.9 | Very high | 95.8 | Very high | 1 Ų | 1 | 32.4 Ų | 32.4 | 1% | 0.01 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -68.3 | -32.8 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | C102 I104 N110 | C102-G106 PolarHBondContact O-N 2.96Å; C102-G106 VanDerWaalsContact O-N 3.13Å; I104-G106 PolarHBondContact O-N 2.83Å; G106-N110 PolarHBondContact O-N 2.95Å; G106-N110 PolarHBondContact O-ND2 3.37Å |
| 107 | T | 95.3 | Very high | 95.8 | Very high | 14 Ų | 14 | 28.8 Ų | 28.8 | 9% | 0.086 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -70.5 | -45.1 | 175.2 | -56.3 | 0 | 0 | 0 | 0 | 111.1 | K103 I104 C105 L109 N110 L111 L165 | K103-T107 VanDerWaalsContact O-CB 3.31Å; K103-T107 WeakPolarHBondContact O-CB 3.45Å; K103-T107 PolarHBondContact O-N 3.45Å; K103-T107 PolarHBondContact O-OG1 2.8Å; I104-T107 PolarHBondContact O-N 3.09Å; I104-T107 VanDerWaalsContact O-N 3.16Å; C105-T107 VanDerWaalsContact C-N 3.33Å; C105-T107 PolarHBondContact O-N 2.84Å; T107-L109 VanDerWaalsContact C-N 3.29Å; T107-L109 PolarHBondContact O-N 2.85Å; T107-N110 PolarHBondContact O-N 2.93Å; T107-L111 VanDerWaalsContact O-CB 3.31Å; T107-L111 WeakPolarHBondContact O-CB 3.05Å; T107-L111 PolarHBondContact O-N 3.46Å; T107-L165 HydrophobicContact CG2-CB 4.2Å; T107-L165 WeakPolarHBondContact OG1-CA 3.28Å; T107-L165 WeakPolarHBondContact OG1-CB 3.41Å; T107-L165 WeakPolarHBondContact OG1-CD1 3.47Å |
| 108 | L | 96.7 | Very high | 95.8 | Very high | 37 Ų | 37 | 26 Ų | 26 | 19% | 0.194 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -62.5 | -34.4 | 179.1 | -73.9 | 177.4 | 0 | 0 | 0 | 112.8 | L77 T81 I104 C105 L111 N112 | L77-L108 HydrophobicContact CB-CD2 4.37Å; T81-L108 HydrophobicContact CG2-CB 3.91Å; T81-L108 HydrophobicContact CG2-CD1 3.57Å; T81-L108 HydrophobicContact CG2-CG 4.39Å; I104-L108 HydrophobicContact CG2-CD1 3.8Å; I104-L108 HydrophobicContact CG2-CG 4.22Å; I104-L108 WeakPolarHBondContact O-CB 3.36Å; I104-L108 WeakPolarHBondContact O-CG 3.15Å; I104-L108 PolarHBondContact O-N 3.3Å; C105-L108 PolarHBondContact O-N 3.41Å; L108-L111 HydrophobicContact CD2-CD2 3.92Å; L108-L111 PolarHBondContact O-N 2.96Å; L108-N112 WeakPolarHBondContact O-CB 3.31Å; L108-N112 PolarHBondContact O-N 3.36Å |
| 109 | L | 94.5 | Very high | 95.8 | Very high | 24 Ų | 24 | 24.5 Ų | 24.5 | 13% | 0.126 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -59.9 | -49.9 | 172.3 | -178 | 167.9 | 0 | 0 | 0 | 111.5 | F78 C105 T107 N112 L113 F292 | F78-L109 HydrophobicContact CD2-CB 4.4Å; F78-L109 HydrophobicContact CE2-CG 4.34Å; C105-L109 PolarHBondContact O-N 2.78Å; C105-L109 VanDerWaalsContact O-N 3.14Å; T107-L109 VanDerWaalsContact C-N 3.29Å; T107-L109 PolarHBondContact O-N 2.85Å; L109-N112 PolarHBondContact O-N 3.3Å; L109-L113 PolarHBondContact O-N 3.22Å; L109-L113 VanDerWaalsContact O-N 3.13Å; L109-F292 HydrophobicContact CD1-CE1 4.08Å; L109-F292 HydrophobicContact CD1-CE2 4.42Å; L109-F292 HydrophobicContact CD1-CZ 3.5Å; L109-F292 VanDerWaalsContact CD1-CZ 3.5Å; L109-F292 HydrophobicContact CD2-CE1 4.19Å; L109-F292 HydrophobicContact CD2-CZ 4.37Å; L109-F292 HydrophobicContact CG-CE1 3.88Å; L109-F292 HydrophobicContact CG-CZ 3.83Å |
| 110 | N | 94.3 | Very high | 95.6 | Very high | 7 Ų | 7 | 17.9 Ų | 17.9 | 4% | 0.037 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -71.2 | -35.7 | 179.4 | -71.9 | -78.1 | 0 | 0 | 0 | 111.9 | G106 T107 N112 L113 Y114 S161 H164 | G106-N110 PolarHBondContact O-N 2.95Å; G106-N110 PolarHBondContact O-ND2 3.37Å; T107-N110 PolarHBondContact O-N 2.93Å; N110-N112 VanDerWaalsContact C-N 3.31Å; N110-N112 PolarHBondContact O-N 3.1Å; N110-L113 WeakPolarHBondContact O-CB 3.13Å; N110-L113 PolarHBondContact O-N 2.91Å; N110-Y114 WeakPolarHBondContact O-CD2 3.08Å; N110-Y114 PolarHBondContact O-N 2.98Å; N110-S161 VanDerWaalsContact C-OG 3.28Å; N110-S161 PolarHBondContact O-OG 3.33Å; N110-H164 PolarHBondContact ND2-CD2 3.25Å; N110-H164 PolarHBondContact OD1-NE2 3.09Å |
| 111 | L | 96.8 | Very high | 95.6 | Very high | 3 Ų | 3 | 14.3 Ų | 14.3 | 2% | 0.016 | 8% | 0.078 | C | C | . | . | H | α-helix | trans | -59.2 | -45.8 | 174.5 | -178.1 | 68.1 | 0 | 0 | 0 | 110.5 | T107 L108 Y114 A115 W154 A157 F158 S161 | T107-L111 VanDerWaalsContact O-CB 3.31Å; T107-L111 WeakPolarHBondContact O-CB 3.05Å; T107-L111 PolarHBondContact O-N 3.46Å; L108-L111 HydrophobicContact CD2-CD2 3.92Å; L108-L111 PolarHBondContact O-N 2.96Å; L111-Y114 PolarHBondContact O-N 3.4Å; L111-A115 WeakPolarHBondContact O-CB 3.47Å; L111-A115 PolarHBondContact O-N 2.94Å; L111-W154 HydrophobicContact CD1-CE3 4.27Å; L111-W154 HydrophobicContact CD1-CZ3 4.2Å; L111-W154 HydrophobicContact CD2-CZ3 3.91Å; L111-W154 HydrophobicContact CG-CZ3 4.02Å; L111-A157 HydrophobicContact CD1-CB 3.79Å; L111-F158 HydrophobicContact CD1-CB 4.42Å; L111-F158 HydrophobicContact CD1-CD1 3.71Å; L111-F158 HydrophobicContact CD1-CD2 4.01Å; L111-F158 HydrophobicContact CD1-CE1 3.88Å; L111-F158 HydrophobicContact CD1-CE2 4.14Å; L111-F158 HydrophobicContact CD1-CG 3.78Å; L111-F158 HydrophobicContact CD1-CZ 4.08Å; L111-F158 HydrophobicContact CD2-CD1 4.21Å; L111-F158 HydrophobicContact CD2-CE1 3.52Å; L111-F158 HydrophobicContact CD2-CE2 4.28Å; L111-F158 HydrophobicContact CD2-CZ 3.55Å; L111-F158 HydrophobicContact CG-CE1 4.33Å; L111-F158 HydrophobicContact CG-CZ 4.48Å; L111-S161 WeakPolarHBondContact CA-OG 3.33Å; L111-S161 PolarHBondContact N-OG 3.4Å; L111-S161 VanDerWaalsContact N-OG 3.07Å |
| 112 | N | 96.3 | Very high | 95.4 | Very high | 2 Ų | 2 | 14.7 Ų | 14.7 | 1% | 0.011 | 8% | 0.078 | C | C | . | . | H | α-helix | trans | -62.1 | -46.3 | 176.4 | 174.8 | -89.6 | 0 | 0 | 0 | 112 | S74 D75 F78 L108 L109 N110 Y114 A115 S116 | S74-N112 PolarHBondContact O-ND2 2.66Å; S74-N112 WeakPolarHBondContact OG-CA 3.49Å; S74-N112 PolarHBondContact OG-ND2 3.36Å; S74-N112 VanDerWaalsContact OG-ND2 3.16Å; D75-N112 VanDerWaalsContact CA-ND2 3.33Å; D75-N112 WeakPolarHBondContact CA-ND2 3.31Å; D75-N112 PolarHBondContact N-ND2 2.87Å; D75-N112 PolarHBondContact OD1-ND2 3.16Å; F78-N112 HydrophobicContact CB-CB 3.48Å; F78-N112 VanDerWaalsContact CB-CB 3.48Å; F78-N112 HydrophobicContact CG-CB 4.01Å; L108-N112 WeakPolarHBondContact O-CB 3.31Å; L108-N112 PolarHBondContact O-N 3.36Å; L109-N112 PolarHBondContact O-N 3.3Å; N110-N112 VanDerWaalsContact C-N 3.31Å; N110-N112 PolarHBondContact O-N 3.1Å; N112-Y114 PolarHBondContact O-N 3.31Å; N112-A115 PolarHBondContact O-N 3.29Å; N112-S116 PolarHBondContact ND2-OG 2.7Å; N112-S116 WeakPolarHBondContact O-CB 3.25Å; N112-S116 PolarHBondContact O-N 3.45Å; N112-S116 PolarHBondContact O-OG 3.03Å |
| 113 | L | 94.6 | Very high | 95.1 | Very high | 0 Ų | 0 | 14.9 Ų | 14.9 | 0% | 0 | 8% | 0.08 | C | C | . | . | H | α-helix | trans | -51.9 | -54 | 176.2 | 170.3 | 61.3 | 0 | 0 | 0 | 111.6 | L109 N110 I117 K198 A202 F249 W253 | L109-L113 PolarHBondContact O-N 3.22Å; L109-L113 VanDerWaalsContact O-N 3.13Å; N110-L113 WeakPolarHBondContact O-CB 3.13Å; N110-L113 PolarHBondContact O-N 2.91Å; L113-I117 VanDerWaalsContact O-CG2 3.31Å; L113-I117 WeakPolarHBondContact O-CG2 3.29Å; L113-I117 PolarHBondContact O-N 3.31Å; L113-K198 HydrophobicContact CD2-CD 4.31Å; L113-K198 HydrophobicContact CD2-CG 4.13Å; L113-A202 HydrophobicContact CD1-CB 4.01Å; L113-A202 HydrophobicContact CD2-CB 3.99Å; L113-A202 HydrophobicContact CG-CB 3.9Å; L113-F249 HydrophobicContact CD1-CZ 4.48Å; L113-W253 HydrophobicContact CB-CH2 4.16Å; L113-W253 HydrophobicContact CD1-CD2 3.84Å; L113-W253 HydrophobicContact CD1-CE3 3.66Å; L113-W253 HydrophobicContact CD1-CH2 3.74Å; L113-W253 HydrophobicContact CD1-CZ2 3.9Å; L113-W253 HydrophobicContact CD1-CZ3 3.63Å; L113-W253 HydrophobicContact CD2-CZ3 4.35Å; L113-W253 HydrophobicContact CG-CH2 4.4Å; L113-W253 HydrophobicContact CG-CZ3 4.41Å |
| 114 | Y | 96.8 | Very high | 94.9 | Very high | 1 Ų | 1 | 13 Ų | 13 | 0% | 0.004 | 7% | 0.071 | C | C | . | . | H | α-helix | trans | -70.6 | -46.8 | -177.5 | -70.7 | -63.9 | 0 | 0 | 0 | 112.8 | N110 L111 N112 S116 I117 F118 C160 K198 L201 A202 | N110-Y114 WeakPolarHBondContact O-CD2 3.08Å; N110-Y114 PolarHBondContact O-N 2.98Å; L111-Y114 PolarHBondContact O-N 3.4Å; N112-Y114 PolarHBondContact O-N 3.31Å; Y114-S116 VanDerWaalsContact C-N 3.32Å; Y114-S116 PolarHBondContact O-N 3.4Å; Y114-I117 WeakPolarHBondContact O-CG2 3.37Å; Y114-F118 HydrophobicContact CD1-CE2 4.35Å; Y114-F118 AromaticContact CD1-CZ 3.99Å; Y114-F118 HydrophobicContact CD1-CZ 3.99Å; Y114-F118 WeakPolarHBondContact O-CB 3.49Å; Y114-F118 WeakPolarHBondContact O-CD2 3.36Å; Y114-F118 WeakPolarHBondContact O-CG 3.13Å; Y114-F118 PolarHBondContact O-N 2.95Å; Y114-C160 HydrophobicContact CD1-CB 3.94Å; Y114-C160 HydrophobicContact CD2-CB 3.5Å; Y114-C160 HydrophobicContact CE1-CB 3.96Å; Y114-C160 HydrophobicContact CE2-CB 3.55Å; Y114-C160 HydrophobicContact CG-CB 3.71Å; Y114-K198 WeakPolarHBondContact OH-CA 3.38Å; Y114-L201 HydrophobicContact CE1-CB 4.16Å; Y114-A202 HydrophobicContact CD1-CB 4.09Å; Y114-A202 HydrophobicContact CE1-CB 3.85Å |
| 115 | A | 97.1 | Very high | 94.7 | Very high | 0 Ų | 0 | 11.6 Ų | 11.6 | 0% | 0 | 7% | 0.067 | C | C | . | . | H | α-helix | trans | -60.9 | -44.7 | 179.6 | 0 | 0 | 0 | 0 | 0 | 110.7 | L111 N112 F118 F119 W154 A157 | L111-A115 WeakPolarHBondContact O-CB 3.47Å; L111-A115 PolarHBondContact O-N 2.94Å; N112-A115 PolarHBondContact O-N 3.29Å; A115-F118 PolarHBondContact O-N 3.27Å; A115-F119 HydrophobicContact CB-CD2 4.34Å; A115-F119 HydrophobicContact CB-CE2 4.22Å; A115-F119 WeakPolarHBondContact O-CB 3.46Å; A115-F119 WeakPolarHBondContact O-CD2 3.22Å; A115-F119 PolarHBondContact O-N 3.48Å; A115-W154 HydrophobicContact CB-CZ3 4.25Å; A115-A157 HydrophobicContact CB-CB 3.9Å |
| 116 | S | 95.2 | Very high | 94.3 | Very high | 0 Ų | 0 | 11.8 Ų | 11.8 | 0% | 0 | 7% | 0.067 | C | C | . | . | H | α-helix | trans | -62.2 | -48.4 | -177.6 | -66.7 | 0 | 0 | 0 | 0 | 112 | L71 N112 Y114 F119 I120 | L71-S116 VanDerWaalsContact CD1-CA 3.48Å; L71-S116 WeakPolarHBondContact CD1-OG 3.17Å; N112-S116 PolarHBondContact ND2-OG 2.7Å; N112-S116 WeakPolarHBondContact O-CB 3.25Å; N112-S116 PolarHBondContact O-N 3.45Å; N112-S116 PolarHBondContact O-OG 3.03Å; Y114-S116 VanDerWaalsContact C-N 3.32Å; Y114-S116 PolarHBondContact O-N 3.4Å; S116-F119 PolarHBondContact O-N 3.44Å; S116-I120 WeakPolarHBondContact O-CG1 3.44Å; S116-I120 PolarHBondContact O-N 3.46Å |
| 117 | I | 95.2 | Very high | 94 | Very high | 0 Ų | 0 | 12.8 Ų | 12.8 | 0% | 0 | 7% | 0.071 | C | C | . | . | H | α-helix | trans | -69.3 | -35.8 | 179.2 | -168.7 | 47.6 | 0 | 0 | 0 | 113.1 | L113 Y114 I120 T121 P206 I210 F249 | L113-I117 VanDerWaalsContact O-CG2 3.31Å; L113-I117 WeakPolarHBondContact O-CG2 3.29Å; L113-I117 PolarHBondContact O-N 3.31Å; Y114-I117 WeakPolarHBondContact O-CG2 3.37Å; I117-I120 HydrophobicContact CD1-CB 4.46Å; I117-I120 PolarHBondContact O-N 3.07Å; I117-T121 WeakPolarHBondContact O-CB 3.06Å; I117-T121 PolarHBondContact O-N 2.83Å; I117-T121 PolarHBondContact O-OG1 3.48Å; I117-P206 HydrophobicContact CD1-CB 3.59Å; I117-P206 HydrophobicContact CD1-CG 4.31Å; I117-P206 HydrophobicContact CG1-CB 3.32Å; I117-P206 HydrophobicContact CG1-CG 3.47Å; I117-P206 VanDerWaalsContact CG1-CG 3.47Å; I117-P206 HydrophobicContact CG2-CG 4.39Å; I117-I210 HydrophobicContact CD1-CD1 4Å; I117-F249 HydrophobicContact CB-CE1 4.12Å; I117-F249 HydrophobicContact CB-CE2 3.82Å; I117-F249 HydrophobicContact CB-CZ 3.48Å; I117-F249 VanDerWaalsContact CB-CZ 3.48Å; I117-F249 HydrophobicContact CD1-CD1 3.57Å; I117-F249 HydrophobicContact CD1-CD2 4.35Å; I117-F249 HydrophobicContact CD1-CE1 3.29Å; I117-F249 HydrophobicContact CD1-CE2 4.09Å; I117-F249 HydrophobicContact CD1-CG 4.13Å; I117-F249 HydrophobicContact CD1-CZ 3.59Å; I117-F249 HydrophobicContact CG1-CD1 4.49Å; I117-F249 HydrophobicContact CG1-CE1 3.74Å; I117-F249 HydrophobicContact CG1-CE2 4.32Å; I117-F249 HydrophobicContact CG1-CZ 3.65Å |
| 118 | F | 96.6 | Very high | 93.7 | Very high | 26 Ų | 26 | 15 Ų | 15 | 11% | 0.114 | 8% | 0.078 | C | C | . | . | H | α-helix | trans | -65.6 | -42.9 | 174.7 | -64.5 | -20.7 | 0 | 0 | 0 | 111.5 | Y114 A115 I120 T121 C122 V153 L156 A157 | Y114-F118 HydrophobicContact CD1-CE2 4.35Å; Y114-F118 AromaticContact CD1-CZ 3.99Å; Y114-F118 HydrophobicContact CD1-CZ 3.99Å; Y114-F118 WeakPolarHBondContact O-CB 3.49Å; Y114-F118 WeakPolarHBondContact O-CD2 3.36Å; Y114-F118 WeakPolarHBondContact O-CG 3.13Å; Y114-F118 PolarHBondContact O-N 2.95Å; A115-F118 PolarHBondContact O-N 3.27Å; F118-I120 PolarHBondContact O-N 2.99Å; F118-T121 WeakPolarHBondContact O-CB 3.21Å; F118-T121 PolarHBondContact O-N 2.82Å; F118-C122 PolarHBondContact O-N 3.49Å; F118-C122 PolarHBondContact O-SG 3.47Å; F118-V153 HydrophobicContact CB-CG1 3.63Å; F118-V153 HydrophobicContact CB-CG2 4.32Å; F118-V153 HydrophobicContact CD2-CG1 4.43Å; F118-L156 HydrophobicContact CD2-CD2 4.03Å; F118-L156 HydrophobicContact CD2-CG 4.26Å; F118-L156 HydrophobicContact CE2-CB 4.26Å; F118-L156 HydrophobicContact CE2-CD2 3.64Å; F118-L156 HydrophobicContact CE2-CG 3.62Å; F118-L156 HydrophobicContact CZ-CD2 3.92Å; F118-L156 HydrophobicContact CZ-CG 4.16Å; F118-A157 HydrophobicContact CD2-CB 4.38Å |
| 119 | F | 95.1 | Very high | 93.3 | Very high | 0 Ų | 0 | 15.5 Ų | 15.5 | 0% | 0 | 8% | 0.08 | C | C | . | . | H | α-helix | trans | -64.1 | -39.5 | 174.1 | -75.9 | -55.9 | 0 | 0 | 0 | 112.5 | F67 N70 L71 A115 S116 T121 C122 M123 C150 V153 W154 | F67-F119 HydrophobicContact CB-CD1 4.29Å; F67-F119 HydrophobicContact CD1-CD1 4.24Å; F67-F119 HydrophobicContact CD1-CE1 4.48Å; N70-F119 HydrophobicContact CB-CD1 4.19Å; N70-F119 HydrophobicContact CB-CD2 4.15Å; N70-F119 HydrophobicContact CB-CE1 3.62Å; N70-F119 HydrophobicContact CB-CE2 3.58Å; N70-F119 HydrophobicContact CB-CG 4.45Å; N70-F119 HydrophobicContact CB-CZ 3.31Å; L71-F119 HydrophobicContact CB-CB 4.26Å; A115-F119 HydrophobicContact CB-CD2 4.34Å; A115-F119 HydrophobicContact CB-CE2 4.22Å; A115-F119 WeakPolarHBondContact O-CB 3.46Å; A115-F119 WeakPolarHBondContact O-CD2 3.22Å; A115-F119 PolarHBondContact O-N 3.48Å; S116-F119 PolarHBondContact O-N 3.44Å; F119-T121 VanDerWaalsContact C-N 3.31Å; F119-T121 PolarHBondContact O-N 3.42Å; F119-C122 PolarHBondContact O-N 3.09Å; F119-M123 WeakPolarHBondContact O-CG 3.31Å; F119-M123 PolarHBondContact O-N 3.02Å; F119-C150 HydrophobicContact CE1-CB 4.19Å; F119-V153 HydrophobicContact CD1-CB 4.49Å; F119-V153 HydrophobicContact CD1-CG1 4.01Å; F119-V153 HydrophobicContact CD2-CG1 4.01Å; F119-V153 HydrophobicContact CE1-CB 3.9Å; F119-V153 HydrophobicContact CE1-CG1 3.68Å; F119-V153 HydrophobicContact CE1-CG2 4.3Å; F119-V153 HydrophobicContact CE2-CG1 3.67Å; F119-V153 HydrophobicContact CG-CG1 4.14Å; F119-V153 HydrophobicContact CZ-CB 3.93Å; F119-V153 HydrophobicContact CZ-CG1 3.47Å; F119-V153 VanDerWaalsContact CZ-CG1 3.47Å; F119-W154 HydrophobicContact CE2-CZ2 4.34Å; F119-W154 AromaticContact CZ-NE1 3.77Å |
| 120 | I | 92.4 | Very high | 92.9 | Very high | 0 Ų | 0 | 15.7 Ų | 15.7 | 0% | 0 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -63.2 | -39.1 | 174.5 | -68.6 | 167.3 | 0 | 0 | 0 | 111.4 | L71 S116 I117 F118 M123 S124 I210 V245 V246 F249 | L71-I120 HydrophobicContact CD2-CG1 4.12Å; S116-I120 WeakPolarHBondContact O-CG1 3.44Å; S116-I120 PolarHBondContact O-N 3.46Å; I117-I120 HydrophobicContact CD1-CB 4.46Å; I117-I120 PolarHBondContact O-N 3.07Å; F118-I120 PolarHBondContact O-N 2.99Å; I120-M123 HydrophobicContact CB-CE 4.32Å; I120-M123 HydrophobicContact CG1-CE 3.83Å; I120-M123 PolarHBondContact O-N 3.28Å; I120-S124 WeakPolarHBondContact O-CB 3.35Å; I120-S124 PolarHBondContact O-N 3.06Å; I120-S124 PolarHBondContact O-OG 3.37Å; I120-I210 HydrophobicContact CG2-CD1 3.95Å; I120-V245 HydrophobicContact CD1-CG1 4.06Å; I120-V245 HydrophobicContact CG1-CG1 4.02Å; I120-V246 HydrophobicContact CG2-CG2 3.63Å; I120-F249 HydrophobicContact CD1-CB 3.9Å; I120-F249 HydrophobicContact CD1-CD2 3.53Å; I120-F249 HydrophobicContact CD1-CE2 4.38Å; I120-F249 HydrophobicContact CD1-CG 3.89Å |
| 121 | T | 94.6 | Very high | 92.4 | Very high | 30 Ų | 30 | 16.7 Ų | 16.7 | 18% | 0.184 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -64.1 | -48 | 174.9 | -54 | 0 | 0 | 0 | 0 | 110.6 | I117 F118 F119 M123 S124 V125 I210 | I117-T121 WeakPolarHBondContact O-CB 3.06Å; I117-T121 PolarHBondContact O-N 2.83Å; I117-T121 PolarHBondContact O-OG1 3.48Å; F118-T121 WeakPolarHBondContact O-CB 3.21Å; F118-T121 PolarHBondContact O-N 2.82Å; F119-T121 VanDerWaalsContact C-N 3.31Å; F119-T121 PolarHBondContact O-N 3.42Å; T121-M123 VanDerWaalsContact C-N 3.33Å; T121-M123 PolarHBondContact O-N 2.73Å; T121-S124 WeakPolarHBondContact O-CB 3.23Å; T121-S124 PolarHBondContact O-N 3.38Å; T121-S124 VanDerWaalsContact O-N 3.11Å; T121-V125 WeakPolarHBondContact O-CG2 3.22Å; T121-V125 PolarHBondContact O-N 2.88Å; T121-I210 HydrophobicContact CG2-CG1 4.38Å |
| 122 | C | 93.6 | Very high | 91.9 | Very high | 29 Ų | 29 | 17.7 Ų | 17.7 | 20% | 0.196 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -59.6 | -41.4 | 176 | -68.9 | 0 | 0 | 0 | 0 | 112.4 | F67 F118 F119 S124 V125 D126 | F67-C122 HydrophobicContact CD2-CB 3.99Å; F67-C122 HydrophobicContact CE1-CB 4.43Å; F67-C122 HydrophobicContact CE2-CB 3.86Å; F67-C122 HydrophobicContact CG-CB 4.33Å; F67-C122 HydrophobicContact CZ-CB 4.1Å; F118-C122 PolarHBondContact O-N 3.49Å; F118-C122 PolarHBondContact O-SG 3.47Å; F119-C122 PolarHBondContact O-N 3.09Å; C122-S124 VanDerWaalsContact C-N 3.34Å; C122-S124 PolarHBondContact O-N 3.15Å; C122-V125 PolarHBondContact O-N 2.82Å; C122-D126 WeakPolarHBondContact O-CB 3.42Å; C122-D126 PolarHBondContact O-N 2.98Å |
| 123 | M | 90.3 | Very high | 91.4 | Very high | 5 Ų | 5 | 20.9 Ų | 20.9 | 3% | 0.025 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -61.1 | -43.1 | 173.9 | -73.8 | -171.1 | -66.1 | 0 | 0 | 111.5 | F67 M68 L71 F119 I120 T121 D126 R127 V242 | F67-M123 HydrophobicContact CB-CG 3.63Å; F67-M123 HydrophobicContact CB-SD 4.36Å; F67-M123 HydrophobicContact CD2-CG 4.06Å; F67-M123 HydrophobicContact CG-CG 4.33Å; M68-M123 HydrophobicContact CB-SD 4.49Å; L71-M123 HydrophobicContact CD2-CE 3.63Å; F119-M123 WeakPolarHBondContact O-CG 3.31Å; F119-M123 PolarHBondContact O-N 3.02Å; I120-M123 HydrophobicContact CB-CE 4.32Å; I120-M123 HydrophobicContact CG1-CE 3.83Å; I120-M123 PolarHBondContact O-N 3.28Å; T121-M123 VanDerWaalsContact C-N 3.33Å; T121-M123 PolarHBondContact O-N 2.73Å; M123-D126 PolarHBondContact O-N 3.38Å; M123-R127 WeakPolarHBondContact O-CG 3.29Å; M123-R127 PolarHBondContact O-N 3.02Å; M123-V242 HydrophobicContact CB-CG1 4.07Å |
| 124 | S | 90.9 | Very high | 90.7 | Very high | 0 Ų | 0 | 24.5 Ų | 24.5 | 0% | 0 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -63.7 | -41.8 | 178.4 | -57.4 | 0 | 0 | 0 | 0 | 112 | I120 T121 C122 R127 Y128 | I120-S124 WeakPolarHBondContact O-CB 3.35Å; I120-S124 PolarHBondContact O-N 3.06Å; I120-S124 PolarHBondContact O-OG 3.37Å; T121-S124 WeakPolarHBondContact O-CB 3.23Å; T121-S124 PolarHBondContact O-N 3.38Å; T121-S124 VanDerWaalsContact O-N 3.11Å; C122-S124 VanDerWaalsContact C-N 3.34Å; C122-S124 PolarHBondContact O-N 3.15Å; S124-R127 PolarHBondContact O-N 3.46Å; S124-Y128 WeakPolarHBondContact O-CB 3.46Å; S124-Y128 PolarHBondContact O-N 3.34Å |
| 125 | V | 91.7 | Very high | 89.7 | Confident | 58 Ų | 58 | 31.3 Ų | 31.3 | 35% | 0.352 | 17% | 0.171 | S | C | . | . | H | α-helix | trans | -66.5 | -43.5 | 175.7 | 173.9 | 0 | 0 | 0 | 0 | 111.6 | T121 C122 R127 Y128 L129 | T121-V125 WeakPolarHBondContact O-CG2 3.22Å; T121-V125 PolarHBondContact O-N 2.88Å; C122-V125 PolarHBondContact O-N 2.82Å; V125-R127 VanDerWaalsContact C-N 3.29Å; V125-R127 PolarHBondContact O-N 3.36Å; V125-Y128 WeakPolarHBondContact O-CB 3.22Å; V125-Y128 PolarHBondContact O-N 3.06Å; V125-L129 HydrophobicContact CG1-CD1 4.05Å; V125-L129 HydrophobicContact CG1-CG 4.32Å; V125-L129 WeakPolarHBondContact O-CG 3.18Å; V125-L129 PolarHBondContact O-N 3.35Å |
| 126 | D | 88.1 | Confident | 88.6 | Confident | 11 Ų | 11 | 36.3 Ų | 36.3 | 6% | 0.059 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -59.1 | -41 | 175 | 163.6 | 81.9 | 0 | 0 | 0 | 111.4 | V63 F67 C122 M123 A130 R141 | V63-D126 HydrophobicContact CG1-CB 4.45Å; F67-D126 HydrophobicContact CE2-CB 4.23Å; C122-D126 WeakPolarHBondContact O-CB 3.42Å; C122-D126 PolarHBondContact O-N 2.98Å; M123-D126 PolarHBondContact O-N 3.38Å; D126-A130 VanDerWaalsContact O-CB 3.25Å; D126-A130 WeakPolarHBondContact O-CB 3.16Å; D126-A130 PolarHBondContact O-N 2.96Å; D126-R141 IonicContact OD1-NH1 3.99Å; D126-R141 PolarHBondContact OD1-NH1 3.19Å; D126-R141 IonicContact OD2-NH1 3.96Å |
| 127 | R | 87.8 | Confident | 87.7 | Confident | 21 Ų | 21 | 36.8 Ų | 36.8 | 8% | 0.079 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -65.9 | -42.8 | 174.7 | -67 | -57.6 | 86.2 | -164.1 | -3.1 | 112.4 | M123 S124 V125 A130 I131 I217 V242 | M123-R127 WeakPolarHBondContact O-CG 3.29Å; M123-R127 PolarHBondContact O-N 3.02Å; S124-R127 PolarHBondContact O-N 3.46Å; V125-R127 VanDerWaalsContact C-N 3.29Å; V125-R127 PolarHBondContact O-N 3.36Å; R127-A130 PolarHBondContact O-N 3.04Å; R127-I131 WeakPolarHBondContact O-CG1 3.27Å; R127-I131 PolarHBondContact O-N 3.38Å; R127-I131 VanDerWaalsContact O-N 3.1Å; R127-I217 HydrophobicContact CB-CD1 4.37Å; R127-V242 HydrophobicContact CG-CB 4.24Å; R127-V242 HydrophobicContact CG-CG1 4.35Å; R127-V242 HydrophobicContact CG-CG2 3.9Å |
| 128 | Y | 89.6 | Confident | 86.7 | Confident | 61 Ų | 61 | 44.6 Ų | 44.6 | 24% | 0.239 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -58 | -52 | 175.6 | 165 | -105.1 | 0 | 0 | 0 | 111.4 | S124 V125 A130 I131 V132 H133 C213 A216 I217 | S124-Y128 WeakPolarHBondContact O-CB 3.46Å; S124-Y128 PolarHBondContact O-N 3.34Å; V125-Y128 WeakPolarHBondContact O-CB 3.22Å; V125-Y128 PolarHBondContact O-N 3.06Å; Y128-A130 VanDerWaalsContact C-N 3.33Å; Y128-A130 PolarHBondContact O-N 3.36Å; Y128-I131 PolarHBondContact O-N 3.37Å; Y128-V132 HydrophobicContact CD2-CB 4.01Å; Y128-V132 HydrophobicContact CD2-CG2 3.62Å; Y128-V132 HydrophobicContact CE2-CB 3.74Å; Y128-V132 HydrophobicContact CE2-CG1 3.87Å; Y128-V132 HydrophobicContact CE2-CG2 3.68Å; Y128-V132 WeakPolarHBondContact O-CB 3.35Å; Y128-V132 PolarHBondContact O-N 3.5Å; Y128-H133 AromaticContact CE1-CD2 3.87Å; Y128-H133 AromaticContact CZ-CD2 3.7Å; Y128-H133 AromaticContact CZ-NE2 3.69Å; Y128-H133 PolarHBondContact OH-NE2 2.68Å; Y128-C213 HydrophobicContact CG-CB 4.5Å; Y128-A216 HydrophobicContact CD2-CB 3.96Å; Y128-A216 HydrophobicContact CE2-CB 3.54Å; Y128-I217 HydrophobicContact CD2-CG1 4.26Å |
| 129 | L | 88.7 | Confident | 85.2 | Confident | 47 Ų | 47 | 53.3 Ų | 53.3 | 25% | 0.246 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -61.2 | -42.4 | 179 | -68.3 | 175.2 | 0 | 0 | 0 | 111.5 | V125 I131 H133 S137 | V125-L129 HydrophobicContact CG1-CD1 4.05Å; V125-L129 HydrophobicContact CG1-CG 4.32Å; V125-L129 WeakPolarHBondContact O-CG 3.18Å; V125-L129 PolarHBondContact O-N 3.35Å; L129-I131 VanDerWaalsContact C-N 3.32Å; L129-I131 PolarHBondContact O-N 3.49Å; L129-H133 CarbonylContact O-C 3.57Å; L129-H133 WeakPolarHBondContact O-CA 3.46Å; L129-H133 PolarHBondContact O-N 3.48Å; L129-H133 VanDerWaalsContact O-N 3.08Å; L129-S137 WeakPolarHBondContact O-CB 3.43Å |
| 130 | A | 84.5 | Confident | 83.7 | Confident | 28 Ų | 28 | 55.9 Ų | 55.9 | 23% | 0.231 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -65 | -31.1 | -179.6 | 0 | 0 | 0 | 0 | 0 | 114.3 | D126 R127 Y128 S137 | D126-A130 VanDerWaalsContact O-CB 3.25Å; D126-A130 WeakPolarHBondContact O-CB 3.16Å; D126-A130 PolarHBondContact O-N 2.96Å; R127-A130 PolarHBondContact O-N 3.04Å; Y128-A130 VanDerWaalsContact C-N 3.33Å; Y128-A130 PolarHBondContact O-N 3.36Å; A130-S137 WeakPolarHBondContact CA-OG 3.26Å |
| 131 | I | 84.3 | Confident | 82.6 | Confident | 28 Ų | 28 | 60.6 Ų | 60.6 | 14% | 0.144 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -96.6 | -44.9 | -175.4 | -64.3 | 170 | 0 | 0 | 0 | 111.8 | R127 Y128 L129 I217 H220 L221 P236 L239 | R127-I131 WeakPolarHBondContact O-CG1 3.27Å; R127-I131 PolarHBondContact O-N 3.38Å; R127-I131 VanDerWaalsContact O-N 3.1Å; Y128-I131 PolarHBondContact O-N 3.37Å; L129-I131 VanDerWaalsContact C-N 3.32Å; L129-I131 PolarHBondContact O-N 3.49Å; I131-I217 HydrophobicContact CD1-CG2 4.02Å; I131-I217 HydrophobicContact CG2-CG2 4.28Å; I131-H220 PolarHBondContact O-CE1 3.43Å; I131-L221 HydrophobicContact CG2-CD2 4.22Å; I131-L221 HydrophobicContact CG2-CG 4.5Å; I131-P236 HydrophobicContact CD1-CG 4.14Å; I131-L239 HydrophobicContact CD1-CB 4.44Å; I131-L239 HydrophobicContact CD1-CD1 4.05Å; I131-L239 HydrophobicContact CD1-CD2 4.14Å; I131-L239 HydrophobicContact CD1-CG 4.45Å |
| 132 | V | 86.5 | Confident | 81.8 | Confident | 25 Ų | 25 | 62.7 Ų | 62.7 | 15% | 0.152 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -88.9 | -31.4 | -172.6 | -175.4 | 0 | 0 | 0 | 0 | 111.6 | Y128 I217 H220 | Y128-V132 HydrophobicContact CD2-CB 4.01Å; Y128-V132 HydrophobicContact CD2-CG2 3.62Å; Y128-V132 HydrophobicContact CE2-CB 3.74Å; Y128-V132 HydrophobicContact CE2-CG1 3.87Å; Y128-V132 HydrophobicContact CE2-CG2 3.68Å; Y128-V132 WeakPolarHBondContact O-CB 3.35Å; Y128-V132 PolarHBondContact O-N 3.5Å; V132-I217 HydrophobicContact CG2-CG1 4.14Å; V132-H220 HydrophobicContact CG1-CB 4.48Å; V132-H220 HydrophobicContact CG2-CB 3.93Å |
| 133 | H | 84.8 | Confident | 81 | Confident | 69 Ų | 69 | 65.7 Ų | 65.7 | 32% | 0.319 | 32% | 0.322 | S | S | . | . | trans | -130.9 | 63.8 | -175.8 | -62.4 | -69.2 | 0 | 0 | 0 | 112.7 | Y128 L129 L135 L136 S137 | Y128-H133 AromaticContact CE1-CD2 3.87Å; Y128-H133 AromaticContact CZ-CD2 3.7Å; Y128-H133 AromaticContact CZ-NE2 3.69Å; Y128-H133 PolarHBondContact OH-NE2 2.68Å; L129-H133 CarbonylContact O-C 3.57Å; L129-H133 WeakPolarHBondContact O-CA 3.46Å; L129-H133 PolarHBondContact O-N 3.48Å; L129-H133 VanDerWaalsContact O-N 3.08Å; H133-L135 VanDerWaalsContact C-N 3.3Å; H133-L135 PolarHBondContact O-N 2.85Å; H133-L136 HydrophobicContact CB-CB 4.1Å; H133-L136 HydrophobicContact CB-CD1 4.02Å; H133-L136 HydrophobicContact CB-CG 4.35Å; H133-L136 PolarHBondContact O-N 3.3Å; H133-L136 VanDerWaalsContact O-N 3.11Å; H133-S137 PolarHBondContact O-N 2.87Å | ||
| 134 | P | 80.3 | Confident | 80.6 | Confident | 76 Ų | 76 | 69.7 Ų | 69.7 | 49% | 0.494 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -59.8 | -34.3 | -170.5 | 22.8 | -33.8 | 0 | 0 | 0 | 114.1 | S137 Q138 | P134-S137 WeakPolarHBondContact O-CB 3.43Å; P134-S137 PolarHBondContact O-N 2.93Å; P134-Q138 PolarHBondContact O-N 2.87Å |
| 135 | L | 77.3 | Confident | 80.4 | Confident | 143 Ų | 143 | 76 Ų | 76 | 75% | 0.749 | 37% | 0.365 | S | S | * | . | H | α-helix | trans | -69.4 | -38.6 | 177.9 | -62 | 176.4 | 0 | 0 | 0 | 112.5 | H133 R139 | H133-L135 VanDerWaalsContact C-N 3.3Å; H133-L135 PolarHBondContact O-N 2.85Å; L135-R139 PolarHBondContact O-N 2.82Å |
| 136 | L | 74.2 | Confident | 80.2 | Confident | 105 Ų | 105 | 73.4 Ų | 73.4 | 55% | 0.55 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -69.5 | -39.6 | 172.7 | -67 | 178 | 0 | 0 | 0 | 110.7 | H133 R139 S140 | H133-L136 HydrophobicContact CB-CB 4.1Å; H133-L136 HydrophobicContact CB-CD1 4.02Å; H133-L136 HydrophobicContact CB-CG 4.35Å; H133-L136 PolarHBondContact O-N 3.3Å; H133-L136 VanDerWaalsContact O-N 3.11Å; L136-R139 PolarHBondContact O-N 2.84Å; L136-S140 WeakPolarHBondContact O-CB 3.3Å; L136-S140 PolarHBondContact O-N 2.94Å |
| 137 | S | 75.9 | Confident | 80.3 | Confident | 10 Ų | 10 | 78.4 Ų | 78.4 | 7% | 0.07 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -60 | -44 | 175.4 | 179.5 | 0 | 0 | 0 | 0 | 112 | L129 A130 H133 P134 R139 S140 R141 | L129-S137 WeakPolarHBondContact O-CB 3.43Å; A130-S137 WeakPolarHBondContact CA-OG 3.26Å; H133-S137 PolarHBondContact O-N 2.87Å; P134-S137 WeakPolarHBondContact O-CB 3.43Å; P134-S137 PolarHBondContact O-N 2.93Å; S137-R139 VanDerWaalsContact C-N 3.26Å; S137-R139 PolarHBondContact O-N 3.23Å; S137-S140 PolarHBondContact O-N 2.96Å; S137-S140 VanDerWaalsContact O-N 3.14Å; S137-R141 VanDerWaalsContact O-CB 3.26Å; S137-R141 WeakPolarHBondContact O-CB 3.43Å; S137-R141 PolarHBondContact O-N 3.32Å; S137-R141 WeakPolarHBondContact OG-CD 3.11Å |
| 138 | Q | 72.8 | Confident | 80.5 | Confident | 164 Ų | 164 | 82.2 Ų | 82.2 | 77% | 0.766 | 39% | 0.388 | S | S | * | . | H | α-helix | trans | -61.7 | -34.5 | 177.8 | -170.7 | 174.7 | 0.4 | 0 | 0 | 112.5 | P134 | P134-Q138 PolarHBondContact O-N 2.87Å |
| 139 | R | 65 | Low | 80.8 | Confident | 210 Ų | 210 | 81.8 Ų | 81.8 | 79% | 0.792 | 39% | 0.392 | S | S | * | . | H | α-helix | trans | -80.6 | -25.7 | 175.5 | -170.6 | 175.1 | -178.8 | 178.4 | 0.7 | 113.6 | L135 L136 S137 | L135-R139 PolarHBondContact O-N 2.82Å; L136-R139 PolarHBondContact O-N 2.84Å; S137-R139 VanDerWaalsContact C-N 3.26Å; S137-R139 PolarHBondContact O-N 3.23Å |
| 140 | S | 63.8 | Low | 81.1 | Confident | 53 Ų | 53 | 79.8 Ų | 79.8 | 37% | 0.371 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -100.5 | -26.1 | -172.3 | -165.9 | 0 | 0 | 0 | 0 | 114.2 | L136 S137 D142 | L136-S140 WeakPolarHBondContact O-CB 3.3Å; L136-S140 PolarHBondContact O-N 2.94Å; S137-S140 PolarHBondContact O-N 2.96Å; S137-S140 VanDerWaalsContact O-N 3.14Å; S140-D142 PolarHBondContact O-N 3.3Å |
| 141 | R | 69.6 | Low | 81.7 | Confident | 100 Ų | 100 | 83.5 Ų | 83.5 | 38% | 0.377 | 40% | 0.397 | S | S | . | . | trans | -74.3 | 68.7 | 175.9 | -84.6 | 174.8 | 62.4 | 101.6 | -9.8 | 111.1 | V63 D126 S137 | V63-R141 HydrophobicContact CG2-CB 4.17Å; V63-R141 HydrophobicContact CG2-CG 4.02Å; D126-R141 IonicContact OD1-NH1 3.99Å; D126-R141 PolarHBondContact OD1-NH1 3.19Å; D126-R141 IonicContact OD2-NH1 3.96Å; S137-R141 VanDerWaalsContact O-CB 3.26Å; S137-R141 WeakPolarHBondContact O-CB 3.43Å; S137-R141 PolarHBondContact O-N 3.32Å; S137-R141 WeakPolarHBondContact OG-CD 3.11Å | ||
| 142 | D | 77.6 | Confident | 82.4 | Confident | 73 Ų | 73 | 87.4 Ų | 87.4 | 39% | 0.39 | 42% | 0.417 | S | S | . | . | trans | -102.5 | 134.5 | 166.2 | -178.9 | 11 | 0 | 0 | 0 | 109.1 | S140 E144 R145 A146 | S140-D142 PolarHBondContact O-N 3.3Å; D142-E144 VanDerWaalsContact C-N 3.27Å; D142-E144 PolarHBondContact O-N 2.99Å; D142-E144 PolarHBondContact OD1-N 3.31Å; D142-R145 HydrophobicContact CB-CB 4.16Å; D142-R145 HydrophobicContact CB-CG 3.89Å; D142-R145 PolarHBondContact O-N 2.87Å; D142-A146 PolarHBondContact O-N 3.15Å; D142-A146 VanDerWaalsContact O-N 3.07Å | ||
| 143 | Y | 77.1 | Confident | 82.9 | Confident | 92 Ų | 92 | 86.8 Ų | 86.8 | 36% | 0.361 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -60.6 | -38.5 | 177.9 | 172.6 | -104.3 | 0 | 0 | 0 | 111.4 | R145 A146 R147 | Y143-R145 PolarHBondContact O-N 2.93Å; Y143-A146 WeakPolarHBondContact O-CB 2.99Å; Y143-A146 PolarHBondContact O-N 2.89Å; Y143-R147 VanDerWaalsContact CE1-CD 3.42Å; Y143-R147 HydrophobicContact CE1-CG 4.19Å; Y143-R147 HydrophobicContact CE2-CG 4.45Å; Y143-R147 WeakPolarHBondContact O-CG 3.38Å; Y143-R147 PolarHBondContact O-N 2.88Å |
| 144 | E | 81.9 | Confident | 83.5 | Confident | 90 Ų | 90 | 85.3 Ų | 85.3 | 42% | 0.421 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -67.5 | -37.8 | 179 | -65.9 | -56.2 | 142.3 | 0 | 0 | 111.7 | D142 A146 R147 I148 | D142-E144 VanDerWaalsContact C-N 3.27Å; D142-E144 PolarHBondContact O-N 2.99Å; D142-E144 PolarHBondContact OD1-N 3.31Å; E144-A146 VanDerWaalsContact C-N 3.35Å; E144-A146 PolarHBondContact O-N 3.04Å; E144-R147 WeakPolarHBondContact O-CB 3.29Å; E144-R147 PolarHBondContact O-N 3.36Å; E144-R147 IonicContact OE1-NH1 3.2Å; E144-R147 PolarHBondContact OE1-NH1 3Å; E144-R147 IonicContact OE2-CZ 3.69Å; E144-R147 IonicContact OE2-NE 3.21Å; E144-R147 IonicContact OE2-NH1 2.86Å; E144-R147 PolarHBondContact OE2-NH1 2.84Å; E144-I148 WeakPolarHBondContact O-CG1 3.34Å; E144-I148 PolarHBondContact O-N 2.68Å; E144-I148 VanDerWaalsContact O-N 3.08Å |
| 145 | R | 86.1 | Confident | 84.4 | Confident | 133 Ų | 133 | 86.1 Ų | 86.1 | 50% | 0.502 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -63.3 | -41.1 | 172.7 | -66.9 | -178.8 | 179.5 | -147.6 | -5.6 | 112 | D142 Y143 R147 I148 V149 | D142-R145 HydrophobicContact CB-CB 4.16Å; D142-R145 HydrophobicContact CB-CG 3.89Å; D142-R145 PolarHBondContact O-N 2.87Å; Y143-R145 PolarHBondContact O-N 2.93Å; R145-R147 VanDerWaalsContact C-N 3.29Å; R145-R147 PolarHBondContact O-N 3.31Å; R145-I148 PolarHBondContact O-N 3.28Å; R145-V149 WeakPolarHBondContact O-CG2 3.3Å; R145-V149 PolarHBondContact O-N 3.45Å |
| 146 | A | 88.1 | Confident | 85.4 | Confident | 3 Ų | 3 | 83.6 Ų | 83.6 | 3% | 0.025 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -61.4 | -38.9 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | V63 F67 D142 Y143 E144 V149 C150 | V63-A146 HydrophobicContact CB-CB 4.23Å; V63-A146 HydrophobicContact CG1-CB 3.85Å; V63-A146 HydrophobicContact CG2-CB 4.04Å; F67-A146 HydrophobicContact CE1-CB 4.34Å; F67-A146 HydrophobicContact CZ-CB 4.45Å; D142-A146 PolarHBondContact O-N 3.15Å; D142-A146 VanDerWaalsContact O-N 3.07Å; Y143-A146 WeakPolarHBondContact O-CB 2.99Å; Y143-A146 PolarHBondContact O-N 2.89Å; E144-A146 VanDerWaalsContact C-N 3.35Å; E144-A146 PolarHBondContact O-N 3.04Å; A146-V149 PolarHBondContact O-N 3.43Å; A146-C150 PolarHBondContact O-N 3Å; A146-C150 PolarHBondContact O-SG 2.86Å |
| 147 | R | 89.9 | Confident | 86.5 | Confident | 115 Ų | 115 | 78.6 Ų | 78.6 | 43% | 0.434 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -62.5 | -43.8 | 174.3 | -70 | 174.6 | 65.5 | -167.1 | 7.1 | 112.2 | Y143 E144 R145 V149 C150 I151 | Y143-R147 VanDerWaalsContact CE1-CD 3.42Å; Y143-R147 HydrophobicContact CE1-CG 4.19Å; Y143-R147 HydrophobicContact CE2-CG 4.45Å; Y143-R147 WeakPolarHBondContact O-CG 3.38Å; Y143-R147 PolarHBondContact O-N 2.88Å; E144-R147 WeakPolarHBondContact O-CB 3.29Å; E144-R147 PolarHBondContact O-N 3.36Å; E144-R147 IonicContact OE1-NH1 3.2Å; E144-R147 PolarHBondContact OE1-NH1 3Å; E144-R147 IonicContact OE2-CZ 3.69Å; E144-R147 IonicContact OE2-NE 3.21Å; E144-R147 IonicContact OE2-NH1 2.86Å; E144-R147 PolarHBondContact OE2-NH1 2.84Å; R145-R147 VanDerWaalsContact C-N 3.29Å; R145-R147 PolarHBondContact O-N 3.31Å; R147-V149 VanDerWaalsContact C-N 3.33Å; R147-V149 PolarHBondContact O-N 3.49Å; R147-C150 WeakPolarHBondContact O-CB 3.49Å; R147-C150 PolarHBondContact O-N 2.91Å; R147-I151 WeakPolarHBondContact O-CG1 3.47Å; R147-I151 PolarHBondContact O-N 3.48Å |
| 148 | I | 93.4 | Very high | 87.5 | Confident | 101 Ų | 101 | 83.3 Ų | 83.3 | 52% | 0.518 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -60.4 | -45.6 | 175.5 | -64.8 | 166.9 | 0 | 0 | 0 | 110.2 | E144 R145 C150 I151 L152 | E144-I148 WeakPolarHBondContact O-CG1 3.34Å; E144-I148 PolarHBondContact O-N 2.68Å; E144-I148 VanDerWaalsContact O-N 3.08Å; R145-I148 PolarHBondContact O-N 3.28Å; I148-C150 VanDerWaalsContact C-N 3.32Å; I148-C150 PolarHBondContact O-N 3.45Å; I148-I151 PolarHBondContact O-N 3.24Å; I148-I151 VanDerWaalsContact O-N 3.16Å; I148-L152 HydrophobicContact CG2-CD1 4.2Å; I148-L152 HydrophobicContact CG2-CG 4.46Å; I148-L152 WeakPolarHBondContact O-CG 3.39Å; I148-L152 PolarHBondContact O-N 3.31Å |
| 149 | V | 94.9 | Very high | 88.6 | Confident | 52 Ų | 52 | 78.1 Ų | 78.1 | 32% | 0.315 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -59.1 | -42.8 | 175.9 | 173.4 | 0 | 0 | 0 | 0 | 111.2 | F67 R145 A146 R147 I151 L152 V153 | F67-V149 HydrophobicContact CE1-CB 4.16Å; F67-V149 HydrophobicContact CE1-CG1 3.85Å; F67-V149 HydrophobicContact CZ-CB 4.36Å; F67-V149 HydrophobicContact CZ-CG1 3.97Å; R145-V149 WeakPolarHBondContact O-CG2 3.3Å; R145-V149 PolarHBondContact O-N 3.45Å; A146-V149 PolarHBondContact O-N 3.43Å; R147-V149 VanDerWaalsContact C-N 3.33Å; R147-V149 PolarHBondContact O-N 3.49Å; V149-I151 PolarHBondContact O-N 2.93Å; V149-L152 PolarHBondContact O-N 3.02Å; V149-V153 HydrophobicContact CG1-CG2 4.34Å; V149-V153 WeakPolarHBondContact O-CG2 3.28Å; V149-V153 PolarHBondContact O-N 3.27Å |
| 150 | C | 96 | Very high | 90.1 | Very high | 6 Ų | 6 | 68.3 Ų | 68.3 | 4% | 0.041 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -59.2 | -44.6 | 175 | -69.6 | 0 | 0 | 0 | 0 | 112.5 | F67 N70 F119 A146 R147 I148 L152 V153 W154 | F67-C150 VanDerWaalsContact CD1-SG 3.58Å; N70-C150 PolarHBondContact ND2-SG 3.41Å; F119-C150 HydrophobicContact CE1-CB 4.19Å; A146-C150 PolarHBondContact O-N 3Å; A146-C150 PolarHBondContact O-SG 2.86Å; R147-C150 WeakPolarHBondContact O-CB 3.49Å; R147-C150 PolarHBondContact O-N 2.91Å; I148-C150 VanDerWaalsContact C-N 3.32Å; I148-C150 PolarHBondContact O-N 3.45Å; C150-L152 VanDerWaalsContact C-N 3.33Å; C150-L152 PolarHBondContact O-N 3.08Å; C150-V153 PolarHBondContact O-N 3.28Å; C150-W154 PolarHBondContact O-N 3.45Å |
| 151 | I | 96.9 | Very high | 91.6 | Very high | 105 Ų | 105 | 65.8 Ų | 65.8 | 54% | 0.538 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -60.7 | -45.4 | 177.3 | -67 | 164.7 | 0 | 0 | 0 | 110.1 | R147 I148 V149 V153 W154 V155 | R147-I151 WeakPolarHBondContact O-CG1 3.47Å; R147-I151 PolarHBondContact O-N 3.48Å; I148-I151 PolarHBondContact O-N 3.24Å; I148-I151 VanDerWaalsContact O-N 3.16Å; V149-I151 PolarHBondContact O-N 2.93Å; I151-V153 PolarHBondContact O-N 3.35Å; I151-W154 PolarHBondContact O-N 2.87Å; I151-V155 HydrophobicContact CG2-CG2 4.43Å; I151-V155 WeakPolarHBondContact O-CG2 3.36Å; I151-V155 PolarHBondContact O-N 3.38Å |
| 152 | L | 97.4 | Very high | 92.8 | Very high | 111 Ų | 111 | 64.1 Ų | 64.1 | 58% | 0.581 | 32% | 0.323 | S | S | * | . | H | α-helix | trans | -61.9 | -42.2 | 177.4 | -67.6 | 173.9 | 0 | 0 | 0 | 112.2 | I148 V149 C150 V155 L156 | I148-L152 HydrophobicContact CG2-CD1 4.2Å; I148-L152 HydrophobicContact CG2-CG 4.46Å; I148-L152 WeakPolarHBondContact O-CG 3.39Å; I148-L152 PolarHBondContact O-N 3.31Å; V149-L152 PolarHBondContact O-N 3.02Å; C150-L152 VanDerWaalsContact C-N 3.33Å; C150-L152 PolarHBondContact O-N 3.08Å; L152-V155 PolarHBondContact O-N 2.85Å; L152-L156 WeakPolarHBondContact O-CB 3.33Å; L152-L156 PolarHBondContact O-N 2.9Å |
| 153 | V | 98 | Very high | 93.5 | Very high | 11 Ų | 11 | 61.6 Ų | 61.6 | 7% | 0.067 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -60.8 | -45.1 | 175.8 | 167.8 | 0 | 0 | 0 | 0 | 110.9 | F118 F119 V149 C150 I151 L156 A157 | F118-V153 HydrophobicContact CB-CG1 3.63Å; F118-V153 HydrophobicContact CB-CG2 4.32Å; F118-V153 HydrophobicContact CD2-CG1 4.43Å; F119-V153 HydrophobicContact CD1-CB 4.49Å; F119-V153 HydrophobicContact CD1-CG1 4.01Å; F119-V153 HydrophobicContact CD2-CG1 4.01Å; F119-V153 HydrophobicContact CE1-CB 3.9Å; F119-V153 HydrophobicContact CE1-CG1 3.68Å; F119-V153 HydrophobicContact CE1-CG2 4.3Å; F119-V153 HydrophobicContact CE2-CG1 3.67Å; F119-V153 HydrophobicContact CG-CG1 4.14Å; F119-V153 HydrophobicContact CZ-CB 3.93Å; F119-V153 HydrophobicContact CZ-CG1 3.47Å; F119-V153 VanDerWaalsContact CZ-CG1 3.47Å; V149-V153 HydrophobicContact CG1-CG2 4.34Å; V149-V153 WeakPolarHBondContact O-CG2 3.28Å; V149-V153 PolarHBondContact O-N 3.27Å; C150-V153 PolarHBondContact O-N 3.28Å; I151-V153 PolarHBondContact O-N 3.35Å; V153-L156 PolarHBondContact O-N 3.18Å; V153-A157 VanDerWaalsContact O-CB 3.31Å; V153-A157 WeakPolarHBondContact O-CB 3.39Å; V153-A157 PolarHBondContact O-N 3.37Å |
| 154 | W | 98.3 | Very high | 94 | Very high | 38 Ų | 38 | 57.9 Ų | 57.9 | 14% | 0.144 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -61.5 | -49.1 | 176.2 | -81.9 | 114.6 | 0 | 0 | 0 | 111.9 | N70 I73 L77 L111 A115 F119 C150 I151 L156 A157 F158 | N70-W154 PolarHBondContact OD1-NE1 2.97Å; I73-W154 HydrophobicContact CG2-CZ2 4.22Å; L77-W154 HydrophobicContact CD1-CH2 4.18Å; L111-W154 HydrophobicContact CD1-CE3 4.27Å; L111-W154 HydrophobicContact CD1-CZ3 4.2Å; L111-W154 HydrophobicContact CD2-CZ3 3.91Å; L111-W154 HydrophobicContact CG-CZ3 4.02Å; A115-W154 HydrophobicContact CB-CZ3 4.25Å; F119-W154 HydrophobicContact CE2-CZ2 4.34Å; F119-W154 AromaticContact CZ-NE1 3.77Å; C150-W154 PolarHBondContact O-N 3.45Å; I151-W154 PolarHBondContact O-N 2.87Å; W154-L156 VanDerWaalsContact C-N 3.3Å; W154-L156 PolarHBondContact O-N 3.49Å; W154-A157 PolarHBondContact O-N 2.69Å; W154-F158 HydrophobicContact CE3-CD2 4.34Å; W154-F158 AromaticContact CE3-CE2 3.8Å; W154-F158 HydrophobicContact CE3-CE2 3.8Å; W154-F158 HydrophobicContact CZ3-CE2 4.44Å; W154-F158 WeakPolarHBondContact O-CB 2.95Å; W154-F158 WeakPolarHBondContact O-CD2 3.31Å; W154-F158 PolarHBondContact O-N 3.16Å |
| 155 | V | 98.1 | Very high | 94.5 | Very high | 94 Ų | 94 | 57.5 Ų | 57.5 | 57% | 0.57 | 30% | 0.297 | S | S | * | . | H | α-helix | trans | -57.3 | -45.7 | 178 | 170 | 0 | 0 | 0 | 0 | 110.8 | I151 L152 F158 A159 | I151-V155 HydrophobicContact CG2-CG2 4.43Å; I151-V155 WeakPolarHBondContact O-CG2 3.36Å; I151-V155 PolarHBondContact O-N 3.38Å; L152-V155 PolarHBondContact O-N 2.85Å; V155-F158 PolarHBondContact O-N 3.5Å; V155-A159 WeakPolarHBondContact O-CB 3.41Å; V155-A159 PolarHBondContact O-N 3.49Å |
| 156 | L | 97.4 | Very high | 94.8 | Very high | 90 Ų | 90 | 54.1 Ų | 54.1 | 47% | 0.471 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -64.6 | -43.6 | 178.1 | -175.1 | 62.5 | 0 | 0 | 0 | 111.8 | F118 L152 V153 W154 F158 A159 C160 | F118-L156 HydrophobicContact CD2-CD2 4.03Å; F118-L156 HydrophobicContact CD2-CG 4.26Å; F118-L156 HydrophobicContact CE2-CB 4.26Å; F118-L156 HydrophobicContact CE2-CD2 3.64Å; F118-L156 HydrophobicContact CE2-CG 3.62Å; F118-L156 HydrophobicContact CZ-CD2 3.92Å; F118-L156 HydrophobicContact CZ-CG 4.16Å; L152-L156 WeakPolarHBondContact O-CB 3.33Å; L152-L156 PolarHBondContact O-N 2.9Å; V153-L156 PolarHBondContact O-N 3.18Å; W154-L156 VanDerWaalsContact C-N 3.3Å; W154-L156 PolarHBondContact O-N 3.49Å; L156-F158 PolarHBondContact O-N 2.86Å; L156-A159 PolarHBondContact O-N 2.9Å; L156-C160 WeakPolarHBondContact O-CB 3.49Å; L156-C160 PolarHBondContact O-N 3.23Å; L156-C160 PolarHBondContact O-SG 2.8Å |
| 157 | A | 97.8 | Very high | 95.1 | Very high | 0 Ų | 0 | 56 Ų | 56 | 0% | 0 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -64.1 | -40.4 | 178 | 0 | 0 | 0 | 0 | 0 | 112 | L111 A115 F118 V153 W154 C160 S161 | L111-A157 HydrophobicContact CD1-CB 3.79Å; A115-A157 HydrophobicContact CB-CB 3.9Å; F118-A157 HydrophobicContact CD2-CB 4.38Å; V153-A157 VanDerWaalsContact O-CB 3.31Å; V153-A157 WeakPolarHBondContact O-CB 3.39Å; V153-A157 PolarHBondContact O-N 3.37Å; W154-A157 PolarHBondContact O-N 2.69Å; A157-C160 PolarHBondContact O-N 3.33Å; A157-S161 VanDerWaalsContact O-CB 3.31Å; A157-S161 WeakPolarHBondContact O-CB 3.49Å; A157-S161 PolarHBondContact O-N 2.91Å; A157-S161 PolarHBondContact O-OG 2.89Å |
| 158 | F | 97.2 | Very high | 95.3 | Very high | 108 Ų | 108 | 52.3 Ų | 52.3 | 47% | 0.474 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -64.3 | -43.8 | 172.9 | -84.7 | -67.1 | 0 | 0 | 0 | 111.8 | L111 W154 V155 L156 C160 S161 S162 | L111-F158 HydrophobicContact CD1-CB 4.42Å; L111-F158 HydrophobicContact CD1-CD1 3.71Å; L111-F158 HydrophobicContact CD1-CD2 4.01Å; L111-F158 HydrophobicContact CD1-CE1 3.88Å; L111-F158 HydrophobicContact CD1-CE2 4.14Å; L111-F158 HydrophobicContact CD1-CG 3.78Å; L111-F158 HydrophobicContact CD1-CZ 4.08Å; L111-F158 HydrophobicContact CD2-CD1 4.21Å; L111-F158 HydrophobicContact CD2-CE1 3.52Å; L111-F158 HydrophobicContact CD2-CE2 4.28Å; L111-F158 HydrophobicContact CD2-CZ 3.55Å; L111-F158 HydrophobicContact CG-CE1 4.33Å; L111-F158 HydrophobicContact CG-CZ 4.48Å; W154-F158 HydrophobicContact CE3-CD2 4.34Å; W154-F158 AromaticContact CE3-CE2 3.8Å; W154-F158 HydrophobicContact CE3-CE2 3.8Å; W154-F158 HydrophobicContact CZ3-CE2 4.44Å; W154-F158 WeakPolarHBondContact O-CB 2.95Å; W154-F158 WeakPolarHBondContact O-CD2 3.31Å; W154-F158 PolarHBondContact O-N 3.16Å; V155-F158 PolarHBondContact O-N 3.5Å; L156-F158 PolarHBondContact O-N 2.86Å; F158-C160 PolarHBondContact O-N 3.44Å; F158-S161 CarbonylContact O-C 3.08Å; F158-S161 PolarHBondContact O-N 3.41Å; F158-S161 VanDerWaalsContact O-N 3.16Å; F158-S162 PolarHBondContact O-N 3.14Å |
| 159 | A | 96.6 | Very high | 95.3 | Very high | 55 Ų | 55 | 49.5 Ų | 49.5 | 46% | 0.455 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -58.7 | -47.7 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.1 | V155 L156 S161 S162 | V155-A159 WeakPolarHBondContact O-CB 3.41Å; V155-A159 PolarHBondContact O-N 3.49Å; L156-A159 PolarHBondContact O-N 2.9Å; A159-S161 VanDerWaalsContact C-N 3.27Å; A159-S161 PolarHBondContact O-N 3.48Å; A159-S162 WeakPolarHBondContact O-CB 3.47Å; A159-S162 PolarHBondContact O-N 3.2Å; A159-S162 PolarHBondContact O-OG 2.81Å |
| 160 | C | 95.6 | Very high | 95.3 | Very high | 5 Ų | 5 | 48.8 Ų | 48.8 | 3% | 0.034 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -63.8 | -30.3 | 176.6 | -66.3 | 0 | 0 | 0 | 0 | 113.5 | Y114 L156 A157 F158 P163 M197 | Y114-C160 HydrophobicContact CD1-CB 3.94Å; Y114-C160 HydrophobicContact CD2-CB 3.5Å; Y114-C160 HydrophobicContact CE1-CB 3.96Å; Y114-C160 HydrophobicContact CE2-CB 3.55Å; Y114-C160 HydrophobicContact CG-CB 3.71Å; L156-C160 WeakPolarHBondContact O-CB 3.49Å; L156-C160 PolarHBondContact O-N 3.23Å; L156-C160 PolarHBondContact O-SG 2.8Å; A157-C160 PolarHBondContact O-N 3.33Å; F158-C160 PolarHBondContact O-N 3.44Å; C160-P163 WeakPolarHBondContact O-CD 3.27Å; C160-M197 HydrophobicContact CB-CE 3.75Å; C160-M197 VanDerWaalsContact SG-CE 3.55Å |
| 161 | S | 95.6 | Very high | 95 | Very high | 0 Ų | 0 | 53 Ų | 53 | 0% | 0 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -86.9 | -18.3 | -179.6 | -54 | 0 | 0 | 0 | 0 | 113.3 | N110 L111 A157 F158 A159 H164 L165 | N110-S161 VanDerWaalsContact C-OG 3.28Å; N110-S161 PolarHBondContact O-OG 3.33Å; L111-S161 WeakPolarHBondContact CA-OG 3.33Å; L111-S161 PolarHBondContact N-OG 3.4Å; L111-S161 VanDerWaalsContact N-OG 3.07Å; A157-S161 VanDerWaalsContact O-CB 3.31Å; A157-S161 WeakPolarHBondContact O-CB 3.49Å; A157-S161 PolarHBondContact O-N 2.91Å; A157-S161 PolarHBondContact O-OG 2.89Å; F158-S161 CarbonylContact O-C 3.08Å; F158-S161 PolarHBondContact O-N 3.41Å; F158-S161 VanDerWaalsContact O-N 3.16Å; A159-S161 VanDerWaalsContact C-N 3.27Å; A159-S161 PolarHBondContact O-N 3.48Å; S161-H164 WeakPolarHBondContact O-CB 3.4Å; S161-H164 PolarHBondContact O-N 3.46Å; S161-L165 PolarHBondContact O-N 3.4Å |
| 162 | S | 94.9 | Very high | 94.7 | Very high | 64 Ų | 64 | 51.8 Ų | 51.8 | 45% | 0.448 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -56.1 | -35.8 | -175.3 | 70.6 | 0 | 0 | 0 | 0 | 115.4 | F158 A159 H164 L165 A166 | F158-S162 PolarHBondContact O-N 3.14Å; A159-S162 WeakPolarHBondContact O-CB 3.47Å; A159-S162 PolarHBondContact O-N 3.2Å; A159-S162 PolarHBondContact O-OG 2.81Å; S162-H164 PolarHBondContact O-N 3.02Å; S162-L165 WeakPolarHBondContact O-CB 3.38Å; S162-L165 PolarHBondContact O-N 3.42Å; S162-L165 VanDerWaalsContact O-N 3.09Å; S162-A166 PolarHBondContact O-N 2.97Å; S162-A166 VanDerWaalsContact O-N 3.1Å |
| 163 | P | 92.1 | Very high | 94.2 | Very high | 21 Ų | 21 | 49.4 Ų | 49.4 | 14% | 0.136 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -64.5 | -31.8 | 177 | -21.5 | 35.7 | 0 | 0 | 0 | 112.1 | C160 L165 A166 F167 L194 | C160-P163 WeakPolarHBondContact O-CD 3.27Å; P163-L165 VanDerWaalsContact C-N 3.32Å; P163-L165 PolarHBondContact O-N 3.08Å; P163-A166 PolarHBondContact O-N 2.88Å; P163-F167 HydrophobicContact CB-CD2 4.15Å; P163-F167 HydrophobicContact CB-CE2 4.1Å; P163-F167 WeakPolarHBondContact O-CB 3.06Å; P163-F167 VanDerWaalsContact O-CD2 3.28Å; P163-F167 WeakPolarHBondContact O-CD2 3.49Å; P163-F167 WeakPolarHBondContact O-CG 3.33Å; P163-F167 PolarHBondContact O-N 3.17Å; P163-L194 HydrophobicContact CB-CD1 3.82Å; P163-L194 HydrophobicContact CB-CD2 3.61Å; P163-L194 HydrophobicContact CB-CG 4.4Å; P163-L194 HydrophobicContact CG-CD2 3.68Å |
| 164 | H | 87.3 | Confident | 93.6 | Very high | 13 Ų | 13 | 57.7 Ų | 57.7 | 6% | 0.06 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -68.8 | -33.3 | 176.1 | -65.9 | 80.8 | 0 | 0 | 0 | 111.5 | N110 S161 S162 R168 | N110-H164 PolarHBondContact ND2-CD2 3.25Å; N110-H164 PolarHBondContact OD1-NE2 3.09Å; S161-H164 WeakPolarHBondContact O-CB 3.4Å; S161-H164 PolarHBondContact O-N 3.46Å; S162-H164 PolarHBondContact O-N 3.02Å; H164-R168 WeakPolarHBondContact O-CB 3.49Å; H164-R168 PolarHBondContact O-N 3.32Å; H164-R168 VanDerWaalsContact O-N 3.08Å |
| 165 | L | 92.8 | Very high | 92.8 | Very high | 83 Ų | 83 | 64.1 Ų | 64.1 | 44% | 0.435 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -66.8 | -39.5 | 173 | -179.4 | 61.4 | 0 | 0 | 0 | 111.6 | K103 T107 S161 S162 P163 | K103-L165 HydrophobicContact CB-CD1 3.99Å; T107-L165 HydrophobicContact CG2-CB 4.2Å; T107-L165 WeakPolarHBondContact OG1-CA 3.28Å; T107-L165 WeakPolarHBondContact OG1-CB 3.41Å; T107-L165 WeakPolarHBondContact OG1-CD1 3.47Å; S161-L165 PolarHBondContact O-N 3.4Å; S162-L165 WeakPolarHBondContact O-CB 3.38Å; S162-L165 PolarHBondContact O-N 3.42Å; S162-L165 VanDerWaalsContact O-N 3.09Å; P163-L165 VanDerWaalsContact C-N 3.32Å; P163-L165 PolarHBondContact O-N 3.08Å |
| 166 | A | 93.4 | Very high | 92 | Very high | 61 Ų | 61 | 66.5 Ų | 66.5 | 50% | 0.504 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -70.5 | -46.9 | -179.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | S162 P163 | S162-A166 PolarHBondContact O-N 2.97Å; S162-A166 VanDerWaalsContact O-N 3.1Å; P163-A166 PolarHBondContact O-N 2.88Å |
| 167 | F | 92.6 | Very high | 91.5 | Very high | 42 Ų | 42 | 68.1 Ų | 68.1 | 18% | 0.184 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -96.2 | -14.1 | -168.7 | -60.3 | -36.1 | 0 | 0 | 0 | 115.1 | P163 V183 F184 P186 W190 L194 | P163-F167 HydrophobicContact CB-CD2 4.15Å; P163-F167 HydrophobicContact CB-CE2 4.1Å; P163-F167 WeakPolarHBondContact O-CB 3.06Å; P163-F167 VanDerWaalsContact O-CD2 3.28Å; P163-F167 WeakPolarHBondContact O-CD2 3.49Å; P163-F167 WeakPolarHBondContact O-CG 3.33Å; P163-F167 PolarHBondContact O-N 3.17Å; F167-V183 HydrophobicContact CB-CG1 3.85Å; F167-F184 WeakPolarHBondContact CB-O 3.23Å; F167-F184 PolarHBondContact O-N 3.06Å; F167-P186 HydrophobicContact CD1-CG 4.12Å; F167-P186 HydrophobicContact CE1-CG 3.66Å; F167-P186 HydrophobicContact CZ-CG 4.01Å; F167-W190 HydrophobicContact CE2-CD2 4.01Å; F167-W190 AromaticContact CE2-CE3 3.61Å; F167-W190 HydrophobicContact CE2-CE3 3.61Å; F167-W190 AromaticContact CE2-CZ3 3.9Å; F167-W190 HydrophobicContact CE2-CZ3 3.9Å; F167-W190 AromaticContact CZ-CD2 4Å; F167-W190 HydrophobicContact CZ-CD2 4Å; F167-W190 AromaticContact CZ-CE3 3.93Å; F167-W190 HydrophobicContact CZ-CE3 3.93Å; F167-W190 HydrophobicContact CZ-CH2 4.24Å; F167-W190 HydrophobicContact CZ-CZ2 4.31Å; F167-W190 HydrophobicContact CZ-CZ3 4.05Å; F167-L194 HydrophobicContact CD2-CD1 3.87Å; F167-L194 HydrophobicContact CE2-CD1 3.94Å |
| 168 | R | 94.4 | Very high | 91.1 | Very high | 38 Ų | 38 | 69.3 Ų | 69.3 | 14% | 0.143 | 36% | 0.356 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -78.3 | 131 | 177.7 | -176.8 | 160.5 | -87.6 | -86.6 | 1.7 | 111 | C102 K103 H164 C181 V182 V183 | C102-R168 WeakPolarHBondContact O-CD 3.49Å; K103-R168 WeakPolarHBondContact CE-O 3.35Å; K103-R168 VanDerWaalsContact CG-O 3.29Å; K103-R168 WeakPolarHBondContact CG-O 3.18Å; H164-R168 WeakPolarHBondContact O-CB 3.49Å; H164-R168 PolarHBondContact O-N 3.32Å; H164-R168 VanDerWaalsContact O-N 3.08Å; R168-C181 VanDerWaalsContact NH1-C 3.34Å; R168-C181 PolarHBondContact NH1-O 3.27Å; R168-C181 PolarHBondContact NH1-SG 3.39Å; R168-V182 CarbonylContact C-O 3.52Å; R168-V182 WeakPolarHBondContact CA-O 3.28Å; R168-V183 HydrophobicContact CB-CG2 4.32Å |
| 169 | E | 94.1 | Very high | 90.9 | Very high | 43 Ų | 43 | 66.8 Ų | 66.8 | 20% | 0.201 | 35% | 0.35 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -148.1 | 158.5 | -174.2 | -158.9 | 54.8 | -90.6 | 0 | 0 | 111.1 | R99 K103 V182 F184 | R99-E169 WeakPolarHBondContact CD-OE1 3.28Å; R99-E169 WeakPolarHBondContact CG-OE1 3.49Å; R99-E169 IonicContact CZ-OE1 3.28Å; R99-E169 IonicContact CZ-OE2 2.95Å; R99-E169 IonicContact NE-OE1 2.7Å; R99-E169 PolarHBondContact NE-OE1 3.44Å; R99-E169 IonicContact NE-OE2 3.68Å; R99-E169 PolarHBondContact NE-OE2 3.3Å; R99-E169 IonicContact NH2-OE1 2.68Å; R99-E169 IonicContact NH2-OE2 3.43Å; R99-E169 PolarHBondContact NH2-OE2 2.84Å; K103-E169 VanDerWaalsContact CE-OE2 3.3Å; K103-E169 WeakPolarHBondContact CE-OE2 3.41Å; K103-E169 IonicContact NZ-OE2 3.92Å; K103-E169 PolarHBondContact NZ-OE2 3.43Å; E169-V182 PolarHBondContact N-O 3.13Å; E169-V182 PolarHBondContact O-N 3.45Å; E169-V182 VanDerWaalsContact O-N 3.08Å; E169-F184 HydrophobicContact CB-CD2 4.11Å |
| 170 | T | 94.3 | Very high | 90.7 | Very high | 37 Ų | 37 | 64.4 Ų | 64.4 | 23% | 0.227 | 33% | 0.33 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.4 | 127.9 | 168.6 | 50.5 | 0 | 0 | 0 | 0 | 110 | W95 C102 A180 | W95-T170 HydrophobicContact CG-CG2 4.48Å; C102-T170 HydrophobicContact CB-CG2 3.66Å; T170-A180 WeakPolarHBondContact CA-O 3.43Å |
| 171 | H | 90.9 | Very high | 90.7 | Very high | 95 Ų | 95 | 64.3 Ų | 64.3 | 44% | 0.44 | 33% | 0.329 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -138 | 140.8 | -179.2 | -171 | -80.1 | 0 | 0 | 0 | 111.6 | L173 V179 A180 F184 | H171-L173 PolarHBondContact O-N 2.86Å; H171-V179 CarbonylContact O-C 3.58Å; H171-V179 WeakPolarHBondContact O-CA 3.38Å; H171-A180 PolarHBondContact N-O 2.9Å; H171-A180 PolarHBondContact O-N 2.88Å; H171-F184 HydrophobicContact CB-CE2 3.43Å; H171-F184 VanDerWaalsContact CB-CE2 3.43Å; H171-F184 HydrophobicContact CB-CZ 3.41Å; H171-F184 VanDerWaalsContact CB-CZ 3.41Å; H171-F184 AromaticContact CD2-CZ 3.78Å; H171-F184 AromaticContact CG-CE2 3.97Å; H171-F184 AromaticContact CG-CZ 3.49Å; H171-F184 VanDerWaalsContact CG-CZ 3.49Å |
| 172 | H | 91.1 | Very high | 90.5 | Very high | 79 Ų | 79 | 66.4 Ų | 66.4 | 37% | 0.366 | 34% | 0.342 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -83.2 | 113.4 | 176.3 | -174.8 | -93.9 | 0 | 0 | 0 | 110.1 | K174 D177 V178 V179 | H172-K174 PolarHBondContact O-N 2.68Å; H172-D177 IonicContact CE1-OD1 3.33Å; H172-D177 PolarHBondContact CE1-OD1 3.01Å; H172-D177 IonicContact NE2-OD1 2.85Å; H172-D177 PolarHBondContact NE2-OD1 3.21Å; H172-V178 CarbonylContact C-O 3.6Å; H172-V178 WeakPolarHBondContact CA-O 3.28Å; H172-V179 HydrophobicContact CB-CG2 4.5Å |
| 173 | L | 86.9 | Confident | 90.2 | Very high | 61 Ų | 61 | 64.7 Ų | 64.7 | 32% | 0.319 | 33% | 0.328 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -86.7 | 101 | 172.9 | -73 | 110.4 | 0 | 0 | 0 | 108.8 | H171 E175 F176 D177 V178 A180 | H171-L173 PolarHBondContact O-N 2.86Å; L173-E175 PolarHBondContact O-N 3.39Å; L173-F176 HydrophobicContact CB-CD2 4.24Å; L173-F176 HydrophobicContact CD2-CD2 4.3Å; L173-F176 PolarHBondContact O-N 3.2Å; L173-F176 VanDerWaalsContact O-N 3.14Å; L173-D177 WeakPolarHBondContact O-CA 3.21Å; L173-D177 PolarHBondContact O-N 3.08Å; L173-V178 HydrophobicContact CB-CG2 4.28Å; L173-V178 HydrophobicContact CD1-CG2 4.27Å; L173-V178 PolarHBondContact N-O 3.39Å; L173-V178 PolarHBondContact O-N 3.23Å; L173-A180 HydrophobicContact CD1-CB 3.25Å |
| 174 | K | 84.4 | Confident | 90.1 | Very high | 185 Ų | 185 | 68 Ų | 68 | 80% | 0.804 | 34% | 0.341 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.8 | -34 | -178.3 | -66.5 | -177.2 | 179.1 | 179.9 | 0 | 113.6 | H172 F176 | H172-K174 PolarHBondContact O-N 2.68Å; K174-F176 PolarHBondContact O-N 3.46Å |
| 175 | E | 81.7 | Confident | 90.1 | Very high | 172 Ų | 172 | 71 Ų | 71 | 80% | 0.804 | 35% | 0.352 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.9 | -28.7 | -179 | -66.1 | 174.3 | -174 | 0 | 0 | 113 | L173 | L173-E175 PolarHBondContact O-N 3.39Š|
| 176 | F | 80.4 | Confident | 89.9 | Confident | 145 Ų | 145 | 71 Ų | 71 | 64% | 0.636 | 36% | 0.357 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -116.2 | -3.8 | -176.2 | -58.1 | -74 | 0 | 0 | 0 | 112.7 | L173 K174 V178 | L173-F176 HydrophobicContact CB-CD2 4.24Å; L173-F176 HydrophobicContact CD2-CD2 4.3Å; L173-F176 PolarHBondContact O-N 3.2Å; L173-F176 VanDerWaalsContact O-N 3.14Å; K174-F176 PolarHBondContact O-N 3.46Å; F176-V178 VanDerWaalsContact C-N 3.29Å; F176-V178 HydrophobicContact CB-CG2 3.97Å; F176-V178 WeakPolarHBondContact O-CG1 3.46Å; F176-V178 PolarHBondContact O-N 3.29Å |
| 177 | D | 87.6 | Confident | 89.6 | Confident | 123 Ų | 123 | 71.6 Ų | 71.6 | 66% | 0.658 | 35% | 0.352 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 49.2 | 43.8 | -172.3 | -163.5 | 30.7 | 0 | 0 | 0 | 114.1 | H172 L173 | H172-D177 IonicContact CE1-OD1 3.33Å; H172-D177 PolarHBondContact CE1-OD1 3.01Å; H172-D177 IonicContact NE2-OD1 2.85Å; H172-D177 PolarHBondContact NE2-OD1 3.21Å; L173-D177 WeakPolarHBondContact O-CA 3.21Å; L173-D177 PolarHBondContact O-N 3.08Å |
| 178 | V | 90.3 | Very high | 89.3 | Confident | 26 Ų | 26 | 75.8 Ų | 75.8 | 16% | 0.158 | 38% | 0.376 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.4 | 147.4 | 179.2 | -61.2 | 0 | 0 | 0 | 0 | 112.4 | H172 L173 F176 | H172-V178 CarbonylContact C-O 3.6Å; H172-V178 WeakPolarHBondContact CA-O 3.28Å; L173-V178 HydrophobicContact CB-CG2 4.28Å; L173-V178 HydrophobicContact CD1-CG2 4.27Å; L173-V178 PolarHBondContact N-O 3.39Å; L173-V178 PolarHBondContact O-N 3.23Å; F176-V178 VanDerWaalsContact C-N 3.29Å; F176-V178 HydrophobicContact CB-CG2 3.97Å; F176-V178 WeakPolarHBondContact O-CG1 3.46Å; F176-V178 PolarHBondContact O-N 3.29Å |
| 179 | V | 92.6 | Very high | 89.1 | Confident | 55 Ų | 55 | 78.4 Ų | 78.4 | 33% | 0.333 | 40% | 0.397 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -92.1 | 96.8 | 169 | -179.7 | 0 | 0 | 0 | 0 | 108.2 | S94 W95 H171 H172 | S94-V179 CarbonylContact C-O 3.59Å; W95-V179 WeakPolarHBondContact CB-O 3.47Å; W95-V179 PolarHBondContact N-O 3.32Å; H171-V179 CarbonylContact O-C 3.58Å; H171-V179 WeakPolarHBondContact O-CA 3.38Å; H172-V179 HydrophobicContact CB-CG2 4.5Å |
| 180 | A | 92.3 | Very high | 88.9 | Confident | 4 Ų | 4 | 81.5 Ų | 81.5 | 3% | 0.033 | 41% | 0.406 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -89.3 | 150.7 | -178.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | T170 H171 L173 V182 | T170-A180 WeakPolarHBondContact CA-O 3.43Å; H171-A180 PolarHBondContact N-O 2.9Å; H171-A180 PolarHBondContact O-N 2.88Å; L173-A180 HydrophobicContact CD1-CB 3.25Å; A180-V182 HydrophobicContact CB-CG1 3.84Å |
| 181 | C | 94.6 | Very high | 88.6 | Confident | 3 Ų | 3 | 81.5 Ų | 81.5 | 2% | 0.02 | 40% | 0.404 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.5 | 100.7 | 170.4 | 175.3 | 0 | 0 | 0 | 0 | 109.2 | W95 C102 R168 | W95-C181 HydrophobicContact CB-CB 3.86Å; W95-C181 HydrophobicContact CD2-CB 3.72Å; W95-C181 HydrophobicContact CE3-CB 3.9Å; W95-C181 HydrophobicContact CG-CB 3.68Å; C102-C181 WeakPolarHBondContact CA-SG 3.31Å; C102-C181 HydrophobicContact CB-CB 3.87Å; C102-C181 WeakPolarHBondContact CB-SG 3.41Å; C102-C181 VanDerWaalsContact SG-CA 3.51Å; C102-C181 WeakPolarHBondContact SG-CB 3.46Å; C102-C181 CovalentContact SG-SG 2.02Å; C102-C181 PolarHBondContact SG-SG 3.21Å; R168-C181 VanDerWaalsContact NH1-C 3.34Å; R168-C181 PolarHBondContact NH1-O 3.27Å; R168-C181 PolarHBondContact NH1-SG 3.39Å |
| 182 | V | 90.8 | Very high | 88.5 | Confident | 44 Ų | 44 | 78.7 Ų | 78.7 | 27% | 0.267 | 39% | 0.391 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -132.5 | 166.2 | -171.5 | -59.9 | 0 | 0 | 0 | 0 | 111.9 | R168 E169 A180 F184 | R168-V182 CarbonylContact C-O 3.52Å; R168-V182 WeakPolarHBondContact CA-O 3.28Å; E169-V182 PolarHBondContact N-O 3.13Å; E169-V182 PolarHBondContact O-N 3.45Å; E169-V182 VanDerWaalsContact O-N 3.08Å; A180-V182 HydrophobicContact CB-CG1 3.84Å; V182-F184 HydrophobicContact CG2-CD2 3.87Å; V182-F184 HydrophobicContact CG2-CE1 4.4Å; V182-F184 HydrophobicContact CG2-CE2 3.2Å; V182-F184 HydrophobicContact CG2-CZ 3.51Å |
| 183 | V | 90.4 | Very high | 88.5 | Confident | 28 Ų | 28 | 78.5 Ų | 78.5 | 17% | 0.17 | 40% | 0.396 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -95.9 | 123.2 | 174.6 | -175.4 | 0 | 0 | 0 | 0 | 108.5 | F167 R168 Y185 | F167-V183 HydrophobicContact CB-CG1 3.85Å; R168-V183 HydrophobicContact CB-CG2 4.32Å; V183-Y185 HydrophobicContact CB-CE2 4.04Å; V183-Y185 HydrophobicContact CG1-CD1 4.25Å; V183-Y185 HydrophobicContact CG1-CD2 4.3Å; V183-Y185 HydrophobicContact CG1-CE1 3.8Å; V183-Y185 HydrophobicContact CG1-CE2 3.83Å |
| 184 | F | 88.3 | Confident | 88.7 | Confident | 91 Ų | 91 | 76 Ų | 76 | 40% | 0.399 | 38% | 0.383 | S | S | . | . | trans | -99.9 | 105.3 | 174.1 | -75.1 | -82.8 | 0 | 0 | 0 | 109.9 | F167 E169 H171 V182 | F167-F184 WeakPolarHBondContact CB-O 3.23Å; F167-F184 PolarHBondContact O-N 3.06Å; E169-F184 HydrophobicContact CB-CD2 4.11Å; H171-F184 HydrophobicContact CB-CE2 3.43Å; H171-F184 VanDerWaalsContact CB-CE2 3.43Å; H171-F184 HydrophobicContact CB-CZ 3.41Å; H171-F184 VanDerWaalsContact CB-CZ 3.41Å; H171-F184 AromaticContact CD2-CZ 3.78Å; H171-F184 AromaticContact CG-CE2 3.97Å; H171-F184 AromaticContact CG-CZ 3.49Å; H171-F184 VanDerWaalsContact CG-CZ 3.49Å; V182-F184 HydrophobicContact CG2-CD2 3.87Å; V182-F184 HydrophobicContact CG2-CE1 4.4Å; V182-F184 HydrophobicContact CG2-CE2 3.2Å; V182-F184 HydrophobicContact CG2-CZ 3.51Å | ||
| 185 | Y | 87.8 | Confident | 89 | Confident | 76 Ų | 76 | 67.7 Ų | 67.7 | 30% | 0.298 | 35% | 0.35 | S | S | . | . | trans | -77.2 | 129.7 | 174.6 | -59.3 | -81.4 | 0 | 0 | 0 | 109.4 | V183 N187 W190 F191 L194 | V183-Y185 HydrophobicContact CB-CE2 4.04Å; V183-Y185 HydrophobicContact CG1-CD1 4.25Å; V183-Y185 HydrophobicContact CG1-CD2 4.3Å; V183-Y185 HydrophobicContact CG1-CE1 3.8Å; V183-Y185 HydrophobicContact CG1-CE2 3.83Å; Y185-N187 PolarHBondContact O-N 3.27Å; Y185-W190 HydrophobicContact CD1-CB 4.39Å; Y185-F191 HydrophobicContact CD1-CB 4.05Å; Y185-F191 HydrophobicContact CD2-CB 3.99Å; Y185-F191 AromaticContact CD2-CD2 3.71Å; Y185-F191 HydrophobicContact CD2-CD2 3.71Å; Y185-F191 HydrophobicContact CD2-CG 4.35Å; Y185-F191 HydrophobicContact CE1-CB 4.49Å; Y185-F191 HydrophobicContact CE1-CD2 4.45Å; Y185-F191 HydrophobicContact CE2-CB 4.47Å; Y185-F191 AromaticContact CE2-CD2 3.48Å; Y185-F191 HydrophobicContact CE2-CD2 3.48Å; Y185-F191 VanDerWaalsContact CE2-CD2 3.48Å; Y185-F191 HydrophobicContact CE2-CE2 4.23Å; Y185-F191 HydrophobicContact CE2-CG 4.45Å; Y185-F191 HydrophobicContact CG-CB 3.76Å; Y185-F191 HydrophobicContact CG-CD2 4.29Å; Y185-F191 AromaticContact CZ-CD2 3.86Å; Y185-L194 HydrophobicContact CD1-CD1 4Å; Y185-L194 HydrophobicContact CE1-CB 4.26Å; Y185-L194 HydrophobicContact CE1-CD1 3.68Å | ||
| 186 | P | 88.2 | Confident | 89.4 | Confident | 83 Ų | 83 | 63.5 Ų | 63.5 | 54% | 0.539 | 33% | 0.326 | S | S | . | . | S | Bend | trans | -61 | -29.6 | 179.9 | -25.3 | 33.4 | 0 | 0 | 0 | 114.2 | F167 W190 | F167-P186 HydrophobicContact CD1-CG 4.12Å; F167-P186 HydrophobicContact CE1-CG 3.66Å; F167-P186 HydrophobicContact CZ-CG 4.01Å; P186-W190 HydrophobicContact CG-CG 4.32Å |
| 187 | N | 88.6 | Confident | 90.1 | Very high | 74 Ų | 74 | 59 Ų | 59 | 40% | 0.396 | 31% | 0.308 | S | S | . | . | S | Bend | trans | -155.9 | 169.7 | 174.6 | 59.5 | 36.6 | 0 | 0 | 0 | 109.7 | Y185 T189 W190 F191 | Y185-N187 PolarHBondContact O-N 3.27Å; N187-T189 PolarHBondContact O-N 3.15Å; N187-T189 WeakPolarHBondContact OD1-CA 3.27Å; N187-T189 VanDerWaalsContact OD1-CB 3.25Å; N187-T189 WeakPolarHBondContact OD1-CB 3.39Å; N187-T189 PolarHBondContact OD1-N 3.4Å; N187-T189 VanDerWaalsContact OD1-N 3.15Å; N187-W190 PolarHBondContact O-N 3.37Å; N187-W190 VanDerWaalsContact O-N 3.15Å; N187-W190 PolarHBondContact OD1-N 3.46Å; N187-F191 PolarHBondContact O-N 3.26Å |
| 188 | D | 86 | Confident | 90.3 | Very high | 129 Ų | 129 | 54.3 Ų | 54.3 | 69% | 0.69 | 28% | 0.282 | S | S | * | . | H | α-helix | trans | -61.3 | -31.1 | 178.6 | -64.5 | -30.7 | 0 | 0 | 0 | 112.2 | W190 F191 L192 | D188-W190 VanDerWaalsContact C-N 3.31Å; D188-W190 PolarHBondContact O-N 2.93Å; D188-F191 WeakPolarHBondContact O-CB 3.48Å; D188-F191 PolarHBondContact O-N 3.49Å; D188-L192 VanDerWaalsContact O-CG 3.28Å; D188-L192 WeakPolarHBondContact O-CG 3.22Å; D188-L192 PolarHBondContact O-N 3.04Å |
| 189 | T | 89.3 | Confident | 90.3 | Very high | 93 Ų | 93 | 53.6 Ų | 53.6 | 57% | 0.571 | 28% | 0.278 | S | S | * | . | H | α-helix | trans | -61.3 | -39.4 | 176.9 | -36.8 | 0 | 0 | 0 | 0 | 111.8 | N187 T193 | N187-T189 PolarHBondContact O-N 3.15Å; N187-T189 WeakPolarHBondContact OD1-CA 3.27Å; N187-T189 VanDerWaalsContact OD1-CB 3.25Å; N187-T189 WeakPolarHBondContact OD1-CB 3.39Å; N187-T189 PolarHBondContact OD1-N 3.4Å; N187-T189 VanDerWaalsContact OD1-N 3.15Å; T189-T193 VanDerWaalsContact O-CB 3.22Å; T189-T193 WeakPolarHBondContact O-CB 3.48Å; T189-T193 PolarHBondContact O-N 3.35Å; T189-T193 PolarHBondContact O-OG1 3.09Å |
| 190 | W | 90.1 | Very high | 90.4 | Very high | 108 Ų | 108 | 54.5 Ų | 54.5 | 41% | 0.409 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -67.3 | -42 | 175.4 | -84.6 | 107.3 | 0 | 0 | 0 | 112 | F167 Y185 P186 N187 D188 T193 L194 | F167-W190 HydrophobicContact CE2-CD2 4.01Å; F167-W190 AromaticContact CE2-CE3 3.61Å; F167-W190 HydrophobicContact CE2-CE3 3.61Å; F167-W190 AromaticContact CE2-CZ3 3.9Å; F167-W190 HydrophobicContact CE2-CZ3 3.9Å; F167-W190 AromaticContact CZ-CD2 4Å; F167-W190 HydrophobicContact CZ-CD2 4Å; F167-W190 AromaticContact CZ-CE3 3.93Å; F167-W190 HydrophobicContact CZ-CE3 3.93Å; F167-W190 HydrophobicContact CZ-CH2 4.24Å; F167-W190 HydrophobicContact CZ-CZ2 4.31Å; F167-W190 HydrophobicContact CZ-CZ3 4.05Å; Y185-W190 HydrophobicContact CD1-CB 4.39Å; P186-W190 HydrophobicContact CG-CG 4.32Å; N187-W190 PolarHBondContact O-N 3.37Å; N187-W190 VanDerWaalsContact O-N 3.15Å; N187-W190 PolarHBondContact OD1-N 3.46Å; D188-W190 VanDerWaalsContact C-N 3.31Å; D188-W190 PolarHBondContact O-N 2.93Å; W190-T193 PolarHBondContact O-N 3.22Å; W190-L194 HydrophobicContact CE3-CD1 4.28Å; W190-L194 HydrophobicContact CE3-CG 4.34Å; W190-L194 WeakPolarHBondContact O-CB 3.41Å; W190-L194 VanDerWaalsContact O-CG 3.29Å; W190-L194 WeakPolarHBondContact O-CG 3.03Å; W190-L194 PolarHBondContact O-N 2.91Å |
| 191 | F | 87.9 | Confident | 90.5 | Very high | 38 Ų | 38 | 57.1 Ų | 57.1 | 17% | 0.167 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -57.4 | -51.9 | 174.2 | 171 | -94.5 | 0 | 0 | 0 | 110.9 | Y185 N187 D188 L194 G195 D263 L264 K267 | Y185-F191 HydrophobicContact CD1-CB 4.05Å; Y185-F191 HydrophobicContact CD2-CB 3.99Å; Y185-F191 AromaticContact CD2-CD2 3.71Å; Y185-F191 HydrophobicContact CD2-CD2 3.71Å; Y185-F191 HydrophobicContact CD2-CG 4.35Å; Y185-F191 HydrophobicContact CE1-CB 4.49Å; Y185-F191 HydrophobicContact CE1-CD2 4.45Å; Y185-F191 HydrophobicContact CE2-CB 4.47Å; Y185-F191 AromaticContact CE2-CD2 3.48Å; Y185-F191 HydrophobicContact CE2-CD2 3.48Å; Y185-F191 VanDerWaalsContact CE2-CD2 3.48Å; Y185-F191 HydrophobicContact CE2-CE2 4.23Å; Y185-F191 HydrophobicContact CE2-CG 4.45Å; Y185-F191 HydrophobicContact CG-CB 3.76Å; Y185-F191 HydrophobicContact CG-CD2 4.29Å; Y185-F191 AromaticContact CZ-CD2 3.86Å; N187-F191 PolarHBondContact O-N 3.26Å; D188-F191 WeakPolarHBondContact O-CB 3.48Å; D188-F191 PolarHBondContact O-N 3.49Å; F191-L194 PolarHBondContact O-N 3.48Å; F191-G195 PolarHBondContact O-N 3.15Å; F191-D263 WeakPolarHBondContact CZ-OD2 3.21Å; F191-L264 HydrophobicContact CD1-CD2 4.36Å; F191-L264 HydrophobicContact CE1-CD2 3.83Å; F191-L264 HydrophobicContact CZ-CD2 4.43Å; F191-K267 HydrophobicContact CD1-CG 4.49Å; F191-K267 HydrophobicContact CE1-CB 4.02Å; F191-K267 HydrophobicContact CE1-CG 3.72Å; F191-K267 HydrophobicContact CZ-CG 4.26Å |
| 192 | L | 88.9 | Confident | 90.3 | Very high | 35 Ų | 35 | 57 Ų | 57 | 18% | 0.183 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -62.2 | -47.7 | 179.6 | -66.7 | 171.3 | 0 | 0 | 0 | 111.4 | D188 L194 G195 W196 L264 K267 N268 | D188-L192 VanDerWaalsContact O-CG 3.28Å; D188-L192 WeakPolarHBondContact O-CG 3.22Å; D188-L192 PolarHBondContact O-N 3.04Å; L192-L194 PolarHBondContact O-N 3.47Å; L192-G195 PolarHBondContact O-N 2.89Å; L192-W196 WeakPolarHBondContact O-CB 3.4Å; L192-W196 PolarHBondContact O-N 3.27Å; L192-L264 HydrophobicContact CD2-CD2 3.86Å; L192-K267 HydrophobicContact CD2-CB 4.38Å; L192-N268 WeakPolarHBondContact CD1-OD1 3.32Å; L192-N268 WeakPolarHBondContact CD2-OD1 3.32Å |
| 193 | T | 91.3 | Very high | 90.2 | Very high | 75 Ų | 75 | 55.8 Ų | 55.8 | 46% | 0.46 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -59.4 | -47.6 | -178.6 | -60.5 | 0 | 0 | 0 | 0 | 111.2 | T189 W190 M197 | T189-T193 VanDerWaalsContact O-CB 3.22Å; T189-T193 WeakPolarHBondContact O-CB 3.48Å; T189-T193 PolarHBondContact O-N 3.35Å; T189-T193 PolarHBondContact O-OG1 3.09Å; W190-T193 PolarHBondContact O-N 3.22Å; T193-M197 WeakPolarHBondContact O-CB 3.36Å; T193-M197 PolarHBondContact O-N 2.93Å |
| 194 | L | 91.3 | Very high | 90.3 | Very high | 10 Ų | 10 | 57.1 Ų | 57.1 | 5% | 0.052 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -70.9 | -35.9 | -179.5 | -67 | 176.4 | 0 | 0 | 0 | 112.1 | P163 F167 Y185 W190 F191 L192 M197 K198 | P163-L194 HydrophobicContact CB-CD1 3.82Å; P163-L194 HydrophobicContact CB-CD2 3.61Å; P163-L194 HydrophobicContact CB-CG 4.4Å; P163-L194 HydrophobicContact CG-CD2 3.68Å; F167-L194 HydrophobicContact CD2-CD1 3.87Å; F167-L194 HydrophobicContact CE2-CD1 3.94Å; Y185-L194 HydrophobicContact CD1-CD1 4Å; Y185-L194 HydrophobicContact CE1-CB 4.26Å; Y185-L194 HydrophobicContact CE1-CD1 3.68Å; W190-L194 HydrophobicContact CE3-CD1 4.28Å; W190-L194 HydrophobicContact CE3-CG 4.34Å; W190-L194 WeakPolarHBondContact O-CB 3.41Å; W190-L194 VanDerWaalsContact O-CG 3.29Å; W190-L194 WeakPolarHBondContact O-CG 3.03Å; W190-L194 PolarHBondContact O-N 2.91Å; F191-L194 PolarHBondContact O-N 3.48Å; L192-L194 PolarHBondContact O-N 3.47Å; L194-M197 HydrophobicContact CD2-SD 4.25Å; L194-K198 VanDerWaalsContact O-CB 3.29Å; L194-K198 WeakPolarHBondContact O-CB 3.07Å; L194-K198 PolarHBondContact O-N 3.31Å |
| 195 | G | 90.1 | Very high | 90.6 | Very high | 10 Ų | 10 | 56.8 Ų | 56.8 | 10% | 0.103 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -63.7 | -49.1 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | F191 L192 K198 V199 | F191-G195 PolarHBondContact O-N 3.15Å; L192-G195 PolarHBondContact O-N 2.89Å; G195-K198 WeakPolarHBondContact O-CB 3.45Å; G195-K198 PolarHBondContact O-N 3.5Å; G195-V199 WeakPolarHBondContact O-CG2 3.35Å; G195-V199 PolarHBondContact O-N 2.9Å |
| 196 | W | 91.6 | Very high | 90.9 | Very high | 83 Ų | 83 | 53.3 Ų | 53.3 | 31% | 0.314 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -62.9 | -44.5 | 175.8 | -77.2 | 115.5 | 0 | 0 | 0 | 112 | L192 K198 V199 I200 F261 L264 | L192-W196 WeakPolarHBondContact O-CB 3.4Å; L192-W196 PolarHBondContact O-N 3.27Å; W196-K198 PolarHBondContact O-N 3.42Å; W196-V199 PolarHBondContact O-N 3.36Å; W196-I200 HydrophobicContact CB-CD1 4.44Å; W196-I200 WeakPolarHBondContact O-CB 3.24Å; W196-I200 VanDerWaalsContact O-CG1 3.22Å; W196-I200 WeakPolarHBondContact O-CG1 3.38Å; W196-I200 PolarHBondContact O-N 3.39Å; W196-F261 AromaticContact CH2-CD2 3.96Å; W196-F261 HydrophobicContact CH2-CD2 3.96Å; W196-F261 AromaticContact CH2-CE2 3.48Å; W196-F261 HydrophobicContact CH2-CE2 3.48Å; W196-F261 VanDerWaalsContact CH2-CE2 3.48Å; W196-F261 HydrophobicContact CH2-CZ 4.49Å; W196-F261 AromaticContact CZ3-CD2 3.93Å; W196-F261 HydrophobicContact CZ3-CD2 3.93Å; W196-F261 AromaticContact CZ3-CE2 3.66Å; W196-F261 HydrophobicContact CZ3-CE2 3.66Å; W196-L264 HydrophobicContact CD2-CD1 4.14Å; W196-L264 HydrophobicContact CE3-CD1 4.49Å; W196-L264 HydrophobicContact CG-CD1 4.36Å |
| 197 | M | 93.8 | Very high | 91 | Very high | 51 Ų | 51 | 51.9 Ų | 51.9 | 25% | 0.251 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -54.5 | -44.4 | 173.4 | 178.3 | -173.2 | 178.7 | 0 | 0 | 111 | C160 T193 L194 L201 | C160-M197 HydrophobicContact CB-CE 3.75Å; C160-M197 VanDerWaalsContact SG-CE 3.55Å; T193-M197 WeakPolarHBondContact O-CB 3.36Å; T193-M197 PolarHBondContact O-N 2.93Å; L194-M197 HydrophobicContact CD2-SD 4.25Å; M197-L201 HydrophobicContact CE-CD1 3.73Å; M197-L201 HydrophobicContact CG-CD1 3.61Å; M197-L201 HydrophobicContact CG-CG 4.25Å; M197-L201 VanDerWaalsContact O-CB 3.23Å; M197-L201 WeakPolarHBondContact O-CB 3.09Å; M197-L201 WeakPolarHBondContact O-CG 3.11Å; M197-L201 PolarHBondContact O-N 3.49Å |
| 198 | K | 91.7 | Very high | 91.3 | Very high | 25 Ų | 25 | 53.4 Ų | 53.4 | 11% | 0.109 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -64.1 | -47.4 | 177.4 | -171.5 | 175.2 | -174.1 | -178.9 | 0 | 112.2 | L113 Y114 L194 G195 W196 A202 | L113-K198 HydrophobicContact CD2-CD 4.31Å; L113-K198 HydrophobicContact CD2-CG 4.13Å; Y114-K198 WeakPolarHBondContact OH-CA 3.38Å; L194-K198 VanDerWaalsContact O-CB 3.29Å; L194-K198 WeakPolarHBondContact O-CB 3.07Å; L194-K198 PolarHBondContact O-N 3.31Å; G195-K198 WeakPolarHBondContact O-CB 3.45Å; G195-K198 PolarHBondContact O-N 3.5Å; W196-K198 PolarHBondContact O-N 3.42Å; K198-A202 WeakPolarHBondContact O-CA 3.26Å; K198-A202 WeakPolarHBondContact O-CB 3.45Å; K198-A202 PolarHBondContact O-N 2.9Å |
| 199 | V | 91 | Very high | 91.6 | Very high | 11 Ų | 11 | 48.7 Ų | 48.7 | 7% | 0.067 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -62.6 | -44 | 177.3 | 172.6 | 0 | 0 | 0 | 0 | 111.4 | G195 W196 F203 V204 T260 L264 | G195-V199 WeakPolarHBondContact O-CG2 3.35Å; G195-V199 PolarHBondContact O-N 2.9Å; W196-V199 PolarHBondContact O-N 3.36Å; V199-F203 VanDerWaalsContact O-CB 3.27Å; V199-F203 WeakPolarHBondContact O-CB 3Å; V199-F203 PolarHBondContact O-N 3.18Å; V199-V204 HydrophobicContact CG1-CG2 4.13Å; V199-V204 PolarHBondContact O-N 2.92Å; V199-T260 HydrophobicContact CG2-CG2 4.21Å; V199-L264 HydrophobicContact CG2-CD1 4.16Å |
| 200 | I | 93.9 | Very high | 91.8 | Very high | 74 Ų | 74 | 44.4 Ų | 44.4 | 38% | 0.379 | 23% | 0.234 | S | C | . | . | I | π-helix | trans | -71.2 | -52.4 | -176.3 | -66.2 | 167.1 | 0 | 0 | 0 | 110.8 | W196 V204 V205 | W196-I200 HydrophobicContact CB-CD1 4.44Å; W196-I200 WeakPolarHBondContact O-CB 3.24Å; W196-I200 VanDerWaalsContact O-CG1 3.22Å; W196-I200 WeakPolarHBondContact O-CG1 3.38Å; W196-I200 PolarHBondContact O-N 3.39Å; I200-V204 PolarHBondContact O-N 3.49Å; I200-V205 HydrophobicContact CG2-CG2 3.81Å; I200-V205 WeakPolarHBondContact O-CB 3.49Å; I200-V205 PolarHBondContact O-N 3.04Å |
| 201 | L | 94.3 | Very high | 91.8 | Very high | 58 Ų | 58 | 42.1 Ų | 42.1 | 30% | 0.304 | 23% | 0.234 | S | C | . | . | I | π-helix | trans | -83.7 | -32 | -170.8 | -60.3 | -177.3 | 0 | 0 | 0 | 113.7 | Y114 M197 P206 | Y114-L201 HydrophobicContact CE1-CB 4.16Å; M197-L201 HydrophobicContact CE-CD1 3.73Å; M197-L201 HydrophobicContact CG-CD1 3.61Å; M197-L201 HydrophobicContact CG-CG 4.25Å; M197-L201 VanDerWaalsContact O-CB 3.23Å; M197-L201 WeakPolarHBondContact O-CB 3.09Å; M197-L201 WeakPolarHBondContact O-CG 3.11Å; M197-L201 PolarHBondContact O-N 3.49Å; L201-P206 VanDerWaalsContact O-CD 3.3Å; L201-P206 WeakPolarHBondContact O-CD 3.08Å; L201-P206 WeakPolarHBondContact O-CG 3.32Å |
| 202 | A | 91.1 | Very high | 92.1 | Very high | 0 Ų | 0 | 44.1 Ų | 44.1 | 0% | 0 | 25% | 0.252 | C | S | . | . | I | π-helix | trans | -92.3 | -10 | 179.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | L113 Y114 K198 | L113-A202 HydrophobicContact CD1-CB 4.01Å; L113-A202 HydrophobicContact CD2-CB 3.99Å; L113-A202 HydrophobicContact CG-CB 3.9Å; Y114-A202 HydrophobicContact CD1-CB 4.09Å; Y114-A202 HydrophobicContact CE1-CB 3.85Å; K198-A202 WeakPolarHBondContact O-CA 3.26Å; K198-A202 WeakPolarHBondContact O-CB 3.45Å; K198-A202 PolarHBondContact O-N 2.9Å |
| 203 | F | 89.8 | Confident | 92.2 | Very high | 19 Ų | 19 | 43.2 Ų | 43.2 | 8% | 0.083 | 25% | 0.248 | C | C | . | . | I | π-helix | trans | -135.1 | -67.5 | -176.8 | -164.7 | -99.5 | 0 | 0 | 0 | 113.9 | V199 P206 L207 F250 F254 H257 | V199-F203 VanDerWaalsContact O-CB 3.27Å; V199-F203 WeakPolarHBondContact O-CB 3Å; V199-F203 PolarHBondContact O-N 3.18Å; F203-P206 WeakPolarHBondContact O-CD 3.26Å; F203-L207 HydrophobicContact CE1-CD2 3.83Å; F203-L207 HydrophobicContact CZ-CD2 4.17Å; F203-L207 WeakPolarHBondContact O-CB 3.39Å; F203-L207 PolarHBondContact O-N 3.47Å; F203-F250 HydrophobicContact CD2-CD1 4.17Å; F203-F250 HydrophobicContact CD2-CE1 4.24Å; F203-F250 AromaticContact CE2-CD1 3.52Å; F203-F250 HydrophobicContact CE2-CD1 3.52Å; F203-F250 HydrophobicContact CE2-CE1 4Å; F203-F250 AromaticContact CZ-CD1 3.94Å; F203-F250 HydrophobicContact CZ-CD1 3.94Å; F203-F250 HydrophobicContact CZ-CE1 4.41Å; F203-F254 AromaticContact CE1-CD2 3.87Å; F203-F254 HydrophobicContact CE1-CD2 3.87Å; F203-F254 HydrophobicContact CE1-CE2 4.43Å; F203-F254 HydrophobicContact CE2-CB 3.92Å; F203-F254 HydrophobicContact CE2-CD2 4.15Å; F203-F254 HydrophobicContact CZ-CB 3.92Å; F203-F254 AromaticContact CZ-CD2 3.36Å; F203-F254 HydrophobicContact CZ-CD2 3.36Å; F203-F254 HydrophobicContact CZ-CE2 4.27Å; F203-F254 HydrophobicContact CZ-CG 4.1Å; F203-H257 HydrophobicContact CB-CB 4.4Å; F203-H257 HydrophobicContact CD1-CB 4.42Å; F203-H257 HydrophobicContact CD2-CB 4.2Å; F203-H257 AromaticContact CD2-CD2 3.23Å; F203-H257 WeakPolarHBondContact CD2-CD2 3.37Å; F203-H257 AromaticContact CD2-CG 3.83Å; F203-H257 AromaticContact CD2-NE2 3.93Å; F203-H257 HydrophobicContact CG-CB 4.08Å; F203-H257 AromaticContact CG-CD2 3.64Å; F203-H257 AromaticContact CG-CG 3.81Å |
| 204 | V | 92.4 | Very high | 92.1 | Very high | 57 Ų | 57 | 41.9 Ų | 41.9 | 35% | 0.345 | 24% | 0.235 | S | C | . | . | I | π-helix | trans | -63.8 | -52.9 | -168.6 | 177.3 | 0 | 0 | 0 | 0 | 112.8 | V199 I200 L207 L208 | V199-V204 HydrophobicContact CG1-CG2 4.13Å; V199-V204 PolarHBondContact O-N 2.92Å; I200-V204 PolarHBondContact O-N 3.49Å; V204-L207 PolarHBondContact O-N 2.8Å; V204-L208 HydrophobicContact CG1-CD1 4.02Å; V204-L208 HydrophobicContact CG1-CG 4.49Å; V204-L208 WeakPolarHBondContact O-CG 3.26Å; V204-L208 PolarHBondContact O-N 3.49Å |
| 205 | V | 94.4 | Very high | 92 | Very high | 83 Ų | 83 | 49.1 Ų | 49.1 | 50% | 0.503 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -62.2 | -49.1 | -178.9 | 168.3 | 0 | 0 | 0 | 0 | 111.1 | I200 L207 L208 G209 | I200-V205 HydrophobicContact CG2-CG2 3.81Å; I200-V205 WeakPolarHBondContact O-CB 3.49Å; I200-V205 PolarHBondContact O-N 3.04Å; V205-L207 PolarHBondContact O-N 3.39Å; V205-L208 PolarHBondContact O-N 2.95Å; V205-G209 PolarHBondContact O-N 3.35Å |
| 206 | P | 93.2 | Very high | 92 | Very high | 3 Ų | 3 | 49.6 Ų | 49.6 | 2% | 0.019 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -58.5 | -43.2 | 172.7 | -27.3 | 35.4 | 0 | 0 | 0 | 114 | I117 L201 F203 L208 G209 I210 | I117-P206 HydrophobicContact CD1-CB 3.59Å; I117-P206 HydrophobicContact CD1-CG 4.31Å; I117-P206 HydrophobicContact CG1-CB 3.32Å; I117-P206 HydrophobicContact CG1-CG 3.47Å; I117-P206 VanDerWaalsContact CG1-CG 3.47Å; I117-P206 HydrophobicContact CG2-CG 4.39Å; L201-P206 VanDerWaalsContact O-CD 3.3Å; L201-P206 WeakPolarHBondContact O-CD 3.08Å; L201-P206 WeakPolarHBondContact O-CG 3.32Å; F203-P206 WeakPolarHBondContact O-CD 3.26Å; P206-L208 PolarHBondContact O-N 2.7Å; P206-G209 PolarHBondContact O-N 3.48Å; P206-I210 HydrophobicContact CB-CD1 4.34Å; P206-I210 VanDerWaalsContact O-CB 3.25Å; P206-I210 WeakPolarHBondContact O-CB 3.42Å; P206-I210 WeakPolarHBondContact O-CD1 3.36Å; P206-I210 WeakPolarHBondContact O-CG1 3.4Å; P206-I210 PolarHBondContact O-N 2.81Å |
| 207 | L | 91.5 | Very high | 91.9 | Very high | 54 Ų | 54 | 45.8 Ų | 45.8 | 28% | 0.283 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -58.2 | -48.5 | 178.8 | 178.4 | 65.2 | 0 | 0 | 0 | 111.5 | F203 V204 V205 S211 F250 | F203-L207 HydrophobicContact CE1-CD2 3.83Å; F203-L207 HydrophobicContact CZ-CD2 4.17Å; F203-L207 WeakPolarHBondContact O-CB 3.39Å; F203-L207 PolarHBondContact O-N 3.47Å; V204-L207 PolarHBondContact O-N 2.8Å; V205-L207 PolarHBondContact O-N 3.39Å; L207-S211 WeakPolarHBondContact O-CB 3.19Å; L207-S211 PolarHBondContact O-N 2.81Å; L207-S211 PolarHBondContact O-OG 3.42Å; L207-F250 HydrophobicContact CB-CE1 3.61Å; L207-F250 HydrophobicContact CB-CZ 3.73Å; L207-F250 HydrophobicContact CD1-CD1 3.76Å; L207-F250 HydrophobicContact CD1-CD2 3.96Å; L207-F250 HydrophobicContact CD1-CE1 3.53Å; L207-F250 HydrophobicContact CD1-CE2 3.69Å; L207-F250 HydrophobicContact CD1-CG 4.02Å; L207-F250 HydrophobicContact CD1-CZ 3.52Å; L207-F250 HydrophobicContact CG-CE1 4.11Å; L207-F250 HydrophobicContact CG-CZ 4.24Å |
| 208 | L | 93 | Very high | 91.5 | Very high | 106 Ų | 106 | 44.7 Ų | 44.7 | 56% | 0.555 | 25% | 0.253 | S | S | * | . | H | α-helix | trans | -64.3 | -48.6 | 178 | -67.1 | 175.2 | 0 | 0 | 0 | 111 | V204 V205 P206 I210 S211 C212 | V204-L208 HydrophobicContact CG1-CD1 4.02Å; V204-L208 HydrophobicContact CG1-CG 4.49Å; V204-L208 WeakPolarHBondContact O-CG 3.26Å; V204-L208 PolarHBondContact O-N 3.49Å; V205-L208 PolarHBondContact O-N 2.95Å; P206-L208 PolarHBondContact O-N 2.7Å; L208-I210 PolarHBondContact O-N 2.98Å; L208-S211 PolarHBondContact O-N 3.31Å; L208-C212 WeakPolarHBondContact O-CB 3.03Å; L208-C212 PolarHBondContact O-N 3.32Å; L208-C212 PolarHBondContact O-SG 3.1Å |
| 209 | G | 93.8 | Very high | 91.3 | Very high | 30 Ų | 30 | 50.8 Ų | 50.8 | 31% | 0.309 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -59.5 | -47.4 | -179.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | V205 P206 C213 | V205-G209 PolarHBondContact O-N 3.35Å; P206-G209 PolarHBondContact O-N 3.48Å; G209-C213 PolarHBondContact O-N 2.86Å; G209-C213 PolarHBondContact O-SG 3.27Å |
| 210 | I | 92.8 | Very high | 91.1 | Very high | 2 Ų | 2 | 53 Ų | 53 | 1% | 0.01 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -66.1 | -45.9 | 178.1 | -65.8 | 166 | 0 | 0 | 0 | 110.4 | I117 I120 T121 P206 L208 C212 C213 Y214 V246 F250 | I117-I210 HydrophobicContact CD1-CD1 4Å; I120-I210 HydrophobicContact CG2-CD1 3.95Å; T121-I210 HydrophobicContact CG2-CG1 4.38Å; P206-I210 HydrophobicContact CB-CD1 4.34Å; P206-I210 VanDerWaalsContact O-CB 3.25Å; P206-I210 WeakPolarHBondContact O-CB 3.42Å; P206-I210 WeakPolarHBondContact O-CD1 3.36Å; P206-I210 WeakPolarHBondContact O-CG1 3.4Å; P206-I210 PolarHBondContact O-N 2.81Å; L208-I210 PolarHBondContact O-N 2.98Å; I210-C212 VanDerWaalsContact C-N 3.34Å; I210-C212 PolarHBondContact O-N 3.27Å; I210-C213 WeakPolarHBondContact O-CB 3.11Å; I210-C213 PolarHBondContact O-N 3.18Å; I210-C213 VanDerWaalsContact O-N 3.13Å; I210-Y214 HydrophobicContact CG2-CD2 3.68Å; I210-Y214 HydrophobicContact CG2-CE2 3.88Å; I210-Y214 WeakPolarHBondContact O-CD2 3.26Å; I210-Y214 PolarHBondContact O-N 3.3Å; I210-V246 HydrophobicContact CG2-CB 4.28Å; I210-V246 HydrophobicContact CG2-CG1 3.48Å; I210-V246 VanDerWaalsContact CG2-CG1 3.48Å; I210-V246 HydrophobicContact CG2-CG2 3.74Å; I210-F250 HydrophobicContact CD1-CE2 4.15Å; I210-F250 HydrophobicContact CD1-CZ 4.04Å; I210-F250 HydrophobicContact CG2-CE2 4.46Å |
| 211 | S | 90.8 | Very high | 90.6 | Very high | 60 Ų | 60 | 51.3 Ų | 51.3 | 42% | 0.42 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -60.1 | -43.4 | 178.5 | -61.1 | 0 | 0 | 0 | 0 | 111.7 | L207 L208 C213 Y214 W215 | L207-S211 WeakPolarHBondContact O-CB 3.19Å; L207-S211 PolarHBondContact O-N 2.81Å; L207-S211 PolarHBondContact O-OG 3.42Å; L208-S211 PolarHBondContact O-N 3.31Å; S211-C213 PolarHBondContact O-N 3.08Å; S211-Y214 PolarHBondContact O-N 3.36Å; S211-W215 WeakPolarHBondContact O-CB 3.37Å; S211-W215 PolarHBondContact O-N 3.18Å |
| 212 | C | 92.6 | Very high | 90.1 | Very high | 81 Ų | 81 | 54.5 Ų | 54.5 | 55% | 0.547 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -60.5 | -43.3 | 174.4 | -71.1 | 0 | 0 | 0 | 0 | 112 | L208 I210 A216 | L208-C212 WeakPolarHBondContact O-CB 3.03Å; L208-C212 PolarHBondContact O-N 3.32Å; L208-C212 PolarHBondContact O-SG 3.1Å; I210-C212 VanDerWaalsContact C-N 3.34Å; I210-C212 PolarHBondContact O-N 3.27Å; C212-A216 WeakPolarHBondContact O-CB 3.38Å; C212-A216 PolarHBondContact O-N 2.84Å |
| 213 | C | 92.3 | Very high | 89.7 | Confident | 15 Ų | 15 | 58 Ų | 58 | 10% | 0.101 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -58.6 | -51.5 | 176.1 | -70.4 | 0 | 0 | 0 | 0 | 111.3 | Y128 G209 I210 S211 A216 I217 | Y128-C213 HydrophobicContact CG-CB 4.5Å; G209-C213 PolarHBondContact O-N 2.86Å; G209-C213 PolarHBondContact O-SG 3.27Å; I210-C213 WeakPolarHBondContact O-CB 3.11Å; I210-C213 PolarHBondContact O-N 3.18Å; I210-C213 VanDerWaalsContact O-N 3.13Å; S211-C213 PolarHBondContact O-N 3.08Å; C213-A216 PolarHBondContact O-N 3.23Å; C213-I217 VanDerWaalsContact O-CG1 3.22Å; C213-I217 WeakPolarHBondContact O-CG1 3.37Å; C213-I217 PolarHBondContact O-N 3.49Å |
| 214 | Y | 88.9 | Confident | 88.8 | Confident | 48 Ų | 48 | 63.2 Ų | 63.2 | 19% | 0.188 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -69.6 | -36.2 | -177.6 | -86 | -83.6 | 0 | 0 | 0 | 113.4 | I210 S211 I217 G218 L239 V242 A243 V246 | I210-Y214 HydrophobicContact CG2-CD2 3.68Å; I210-Y214 HydrophobicContact CG2-CE2 3.88Å; I210-Y214 WeakPolarHBondContact O-CD2 3.26Å; I210-Y214 PolarHBondContact O-N 3.3Å; S211-Y214 PolarHBondContact O-N 3.36Å; Y214-I217 PolarHBondContact O-N 3.11Å; Y214-G218 PolarHBondContact O-N 3.08Å; Y214-L239 HydrophobicContact CD1-CD1 4.28Å; Y214-L239 HydrophobicContact CE1-CD1 3.6Å; Y214-L239 HydrophobicContact CE1-CG 4.5Å; Y214-V242 WeakPolarHBondContact OH-CB 3.38Å; Y214-V242 WeakPolarHBondContact OH-CG1 3.42Å; Y214-A243 HydrophobicContact CD1-CB 4.47Å; Y214-A243 HydrophobicContact CE1-CB 3.66Å; Y214-A243 WeakPolarHBondContact OH-CA 3.29Å; Y214-A243 PolarHBondContact OH-N 3.08Å; Y214-V246 HydrophobicContact CE2-CG2 3.98Å |
| 215 | W | 89.1 | Confident | 87.8 | Confident | 161 Ų | 161 | 66 Ų | 66 | 61% | 0.61 | 35% | 0.346 | S | S | * | . | H | α-helix | trans | -61 | -46.7 | 172.3 | 176.9 | 86.7 | 0 | 0 | 0 | 111.4 | S211 G218 R219 | S211-W215 WeakPolarHBondContact O-CB 3.37Å; S211-W215 PolarHBondContact O-N 3.18Å; W215-G218 PolarHBondContact O-N 3.49Å; W215-R219 HydrophobicContact CD2-CG 4.39Å; W215-R219 VanDerWaalsContact CZ2-CD 3.41Å; W215-R219 HydrophobicContact CZ2-CG 4.46Å; W215-R219 PolarHBondContact O-N 2.89Å |
| 216 | A | 90.6 | Very high | 86.2 | Confident | 21 Ų | 21 | 65.5 Ų | 65.5 | 17% | 0.174 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -65.8 | -40.4 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | Y128 C212 C213 G218 R219 H220 | Y128-A216 HydrophobicContact CD2-CB 3.96Å; Y128-A216 HydrophobicContact CE2-CB 3.54Å; C212-A216 WeakPolarHBondContact O-CB 3.38Å; C212-A216 PolarHBondContact O-N 2.84Å; C213-A216 PolarHBondContact O-N 3.23Å; A216-G218 VanDerWaalsContact C-N 3.34Å; A216-R219 PolarHBondContact O-N 3.35Å; A216-H220 WeakPolarHBondContact O-CB 3.48Å; A216-H220 PolarHBondContact O-N 2.02Å |
| 217 | I | 88.4 | Confident | 84.7 | Confident | 2 Ų | 2 | 69.1 Ų | 69.1 | 1% | 0.01 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -58.5 | -47.7 | 171.6 | -68.4 | 164.2 | 0 | 0 | 0 | 110.3 | R127 Y128 I131 V132 C213 Y214 R219 H220 L221 L239 | R127-I217 HydrophobicContact CB-CD1 4.37Å; Y128-I217 HydrophobicContact CD2-CG1 4.26Å; I131-I217 HydrophobicContact CD1-CG2 4.02Å; I131-I217 HydrophobicContact CG2-CG2 4.28Å; V132-I217 HydrophobicContact CG2-CG1 4.14Å; C213-I217 VanDerWaalsContact O-CG1 3.22Å; C213-I217 WeakPolarHBondContact O-CG1 3.37Å; C213-I217 PolarHBondContact O-N 3.49Å; Y214-I217 PolarHBondContact O-N 3.11Å; I217-R219 PolarHBondContact O-N 2.79Å; I217-H220 PolarHBondContact O-N 3.13Å; I217-L221 HydrophobicContact CG2-CD1 3.77Å; I217-L221 HydrophobicContact CG2-CG 4.25Å; I217-L221 WeakPolarHBondContact O-CB 3.4Å; I217-L221 VanDerWaalsContact O-CG 3.31Å; I217-L221 WeakPolarHBondContact O-CG 3.36Å; I217-L221 PolarHBondContact O-N 3Å; I217-L239 HydrophobicContact CD1-CD1 3.96Å; I217-L239 HydrophobicContact CG2-CD1 4.02Å; I217-L239 HydrophobicContact CG2-CD2 3.84Å |
| 218 | G | 86.3 | Confident | 83 | Confident | 28 Ų | 28 | 71.3 Ų | 71.3 | 29% | 0.289 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -58.6 | -48.4 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | Y214 W215 A216 H220 L221 L222 | Y214-G218 PolarHBondContact O-N 3.08Å; W215-G218 PolarHBondContact O-N 3.49Å; A216-G218 VanDerWaalsContact C-N 3.34Å; G218-H220 PolarHBondContact O-N 2.67Å; G218-L221 PolarHBondContact O-N 2.86Å; G218-L222 WeakPolarHBondContact O-CB 3.48Å; G218-L222 VanDerWaalsContact O-CG 3.28Å; G218-L222 WeakPolarHBondContact O-CG 3.31Å; G218-L222 PolarHBondContact O-N 2.91Å |
| 219 | R | 88.3 | Confident | 81.3 | Confident | 154 Ų | 154 | 76.9 Ų | 76.9 | 58% | 0.581 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -61.1 | -43.7 | 176.1 | -70.7 | -163.9 | 83.8 | 132.1 | 5.9 | 112.5 | W215 A216 I217 L222 A223 | W215-R219 HydrophobicContact CD2-CG 4.39Å; W215-R219 VanDerWaalsContact CZ2-CD 3.41Å; W215-R219 HydrophobicContact CZ2-CG 4.46Å; W215-R219 PolarHBondContact O-N 2.89Å; A216-R219 PolarHBondContact O-N 3.35Å; I217-R219 PolarHBondContact O-N 2.79Å; R219-L222 PolarHBondContact O-N 3.25Å; R219-A223 WeakPolarHBondContact O-CB 3.45Å; R219-A223 PolarHBondContact O-N 2.89Å |
| 220 | H | 86 | Confident | 79.4 | Confident | 57 Ų | 57 | 79.3 Ų | 79.3 | 26% | 0.264 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -61.7 | -46.5 | 178.1 | -175.9 | -91.4 | 0 | 0 | 0 | 111.3 | I131 V132 A216 I217 G218 L222 A223 Y224 | I131-H220 PolarHBondContact O-CE1 3.43Å; V132-H220 HydrophobicContact CG1-CB 4.48Å; V132-H220 HydrophobicContact CG2-CB 3.93Å; A216-H220 WeakPolarHBondContact O-CB 3.48Å; A216-H220 PolarHBondContact O-N 2.02Å; I217-H220 PolarHBondContact O-N 3.13Å; G218-H220 PolarHBondContact O-N 2.67Å; H220-L222 PolarHBondContact O-N 2.98Å; H220-A223 PolarHBondContact O-N 2.85Å; H220-Y224 WeakPolarHBondContact O-CB 3.3Å; H220-Y224 PolarHBondContact O-N 3.19Å |
| 221 | L | 83.5 | Confident | 77.6 | Confident | 39 Ų | 39 | 86.8 Ų | 86.8 | 20% | 0.204 | 46% | 0.462 | C | S | . | . | H | α-helix | trans | -63.8 | -38.2 | 178.1 | -70.2 | 174.9 | 0 | 0 | 0 | 112.6 | I131 I217 G218 R225 L239 | I131-L221 HydrophobicContact CG2-CD2 4.22Å; I131-L221 HydrophobicContact CG2-CG 4.5Å; I217-L221 HydrophobicContact CG2-CD1 3.77Å; I217-L221 HydrophobicContact CG2-CG 4.25Å; I217-L221 WeakPolarHBondContact O-CB 3.4Å; I217-L221 VanDerWaalsContact O-CG 3.31Å; I217-L221 WeakPolarHBondContact O-CG 3.36Å; I217-L221 PolarHBondContact O-N 3Å; G218-L221 PolarHBondContact O-N 2.86Å; L221-R225 WeakPolarHBondContact O-CB 3.35Å; L221-R225 VanDerWaalsContact O-CG 3.27Å; L221-R225 WeakPolarHBondContact O-CG 3.09Å; L221-R225 PolarHBondContact O-N 2.79Å; L221-L239 HydrophobicContact CD1-CD2 3.84Å |
| 222 | L | 82.9 | Confident | 75.8 | Confident | 124 Ų | 124 | 91.5 Ų | 91.5 | 65% | 0.649 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -66.9 | -45.2 | 176.1 | -71.8 | 170.7 | 0 | 0 | 0 | 111.8 | G218 R219 H220 Y224 R225 G226 | G218-L222 WeakPolarHBondContact O-CB 3.48Å; G218-L222 VanDerWaalsContact O-CG 3.28Å; G218-L222 WeakPolarHBondContact O-CG 3.31Å; G218-L222 PolarHBondContact O-N 2.91Å; R219-L222 PolarHBondContact O-N 3.25Å; H220-L222 PolarHBondContact O-N 2.98Å; L222-Y224 PolarHBondContact O-N 3.23Å; L222-R225 PolarHBondContact O-N 2.97Å; L222-G226 PolarHBondContact O-N 2.95Å; L222-G226 VanDerWaalsContact O-N 3.17Å |
| 223 | A | 83.5 | Confident | 74.1 | Confident | 75 Ų | 75 | 90.2 Ų | 90.2 | 62% | 0.62 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -62.8 | -41.3 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112 | R219 H220 G226 | R219-A223 WeakPolarHBondContact O-CB 3.45Å; R219-A223 PolarHBondContact O-N 2.89Å; H220-A223 PolarHBondContact O-N 2.85Å; A223-G226 PolarHBondContact O-N 2.77Å |
| 224 | Y | 71.9 | Confident | 72.5 | Confident | 127 Ų | 127 | 94.5 Ų | 94.5 | 50% | 0.498 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -71.7 | -30.4 | 179.7 | -132.7 | -98.2 | 0 | 0 | 0 | 113.1 | H220 L222 S227 | H220-Y224 WeakPolarHBondContact O-CB 3.3Å; H220-Y224 PolarHBondContact O-N 3.19Å; L222-Y224 PolarHBondContact O-N 3.23Å; Y224-S227 PolarHBondContact O-N 3.16Å; Y224-S227 VanDerWaalsContact O-O 3.12Å |
| 225 | R | 69.4 | Low | 71.2 | Confident | 116 Ų | 116 | 93.4 Ų | 93.4 | 44% | 0.438 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -72.5 | -26.5 | 173.3 | -80.1 | 177.7 | 171.4 | -174.4 | -4.7 | 113.4 | L221 L222 S227 | L221-R225 WeakPolarHBondContact O-CB 3.35Å; L221-R225 VanDerWaalsContact O-CG 3.27Å; L221-R225 WeakPolarHBondContact O-CG 3.09Å; L221-R225 PolarHBondContact O-N 2.79Å; L222-R225 PolarHBondContact O-N 2.97Å; R225-S227 PolarHBondContact O-N 3.29Å |
| 226 | G | 62.8 | Low | 70.1 | Confident | 73 Ų | 73 | 88.7 Ų | 88.7 | 75% | 0.753 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -69 | -21.5 | 173.3 | 0 | 0 | 0 | 0 | 0 | 113.6 | L222 A223 | L222-G226 PolarHBondContact O-N 2.95Å; L222-G226 VanDerWaalsContact O-N 3.17Å; A223-G226 PolarHBondContact O-N 2.77Å |
| 227 | S | 60.3 | Low | 69 | Low | 79 Ų | 79 | 92.6 Ų | 92.6 | 55% | 0.552 | 51% | 0.506 | S | S | * | . | S | Bend | trans | -85.6 | 126.9 | 165.6 | -92.6 | 0 | 0 | 0 | 0 | 109.6 | Y224 R225 R229 | Y224-S227 PolarHBondContact O-N 3.16Å; Y224-S227 VanDerWaalsContact O-O 3.12Å; R225-S227 PolarHBondContact O-N 3.29Å; S227-R229 PolarHBondContact O-N 2.97Å |
| 228 | A | 55.8 | Low | 68 | Low | 99 Ų | 99 | 96.7 Ų | 96.7 | 82% | 0.818 | 53% | 0.527 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -53.9 | 1.6 | -172.6 | 0 | 0 | 0 | 0 | 0 | 117.5 | ||
| 229 | R | 56.8 | Low | 67.5 | Low | 223 Ų | 223 | 96 Ų | 96 | 84% | 0.842 | 52% | 0.516 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.8 | -14.7 | -172.6 | -109 | 176.5 | 174.9 | 173.7 | -1.6 | 115.6 | S227 | S227-R229 PolarHBondContact O-N 2.97Š|
| 230 | M | 54.5 | Low | 67 | Low | 82 Ų | 82 | 95.7 Ų | 95.7 | 40% | 0.404 | 52% | 0.515 | S | S | . | . | trans | -149.7 | 23 | -170.3 | -116.5 | 177.2 | 83.9 | 0 | 0 | 116.8 | N232 S233 | M230-N232 PolarHBondContact O-N 3.26Å; M230-S233 PolarHBondContact O-N 3.04Å; M230-S233 VanDerWaalsContact O-N 3.09Å | ||
| 231 | Q | 55.1 | Low | 66.2 | Low | 159 Ų | 159 | 93.6 Ų | 93.6 | 74% | 0.743 | 51% | 0.506 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.2 | -22.7 | -175.8 | -161.1 | 156.5 | 18 | 0 | 0 | 114.2 | ||
| 232 | N | 53.4 | Low | 65.8 | Low | 158 Ų | 158 | 92.1 Ų | 92.1 | 85% | 0.845 | 50% | 0.499 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -106.9 | 4.4 | -177.2 | -64.2 | -26 | 0 | 0 | 0 | 115.5 | M230 | M230-N232 PolarHBondContact O-N 3.26Š|
| 233 | S | 56.2 | Low | 65.7 | Low | 55 Ų | 55 | 87.3 Ų | 87.3 | 39% | 0.385 | 48% | 0.477 | S | S | . | . | P | Polyproline II helix | trans | -96.9 | 119.9 | 179.4 | -65 | 0 | 0 | 0 | 0 | 111.7 | M230 | M230-S233 PolarHBondContact O-N 3.04Å; M230-S233 VanDerWaalsContact O-N 3.09Å |
| 234 | P | 58.1 | Low | 65.7 | Low | 105 Ų | 105 | 85.1 Ų | 85.1 | 68% | 0.682 | 46% | 0.459 | S | S | * | . | P | Polyproline II helix | trans | -64.5 | 152.5 | 176.4 | 25.9 | -32.3 | 0 | 0 | 0 | 111 | ||
| 235 | P | 63.5 | Low | 66.1 | Low | 25 Ų | 25 | 79.1 Ų | 79.1 | 16% | 0.162 | 44% | 0.436 | C | S | . | . | P | Polyproline II helix | trans | -56.1 | 147.6 | 171.9 | -14.8 | 27.5 | 0 | 0 | 0 | 109.9 | Q237 L239 W240 | P235-Q237 PolarHBondContact O-N 3.09Å; P235-L239 HydrophobicContact CB-CD2 4.25Å; P235-W240 HydrophobicContact CG-CZ2 4.28Å |
| 236 | P | 65.8 | Low | 66.7 | Low | 62 Ų | 62 | 74.2 Ų | 74.2 | 40% | 0.403 | 42% | 0.418 | S | S | . | . | P | Polyproline II helix | trans | -57 | 127.1 | -179.7 | 21.7 | -31 | 0 | 0 | 0 | 109.9 | I131 I238 L239 | I131-P236 HydrophobicContact CD1-CG 4.14Å; P236-I238 PolarHBondContact O-N 3.4Å; P236-L239 HydrophobicContact CG-CB 4.31Å; P236-L239 WeakPolarHBondContact O-CB 3.49Å; P236-L239 PolarHBondContact O-N 3.37Å |
| 237 | Q | 67.5 | Low | 67.8 | Low | 102 Ų | 102 | 76.3 Ų | 76.3 | 48% | 0.477 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -53 | -33.7 | -173.3 | -70.7 | 167.1 | 3.2 | 0 | 0 | 113.5 | P235 L239 W240 T241 N307 | P235-Q237 PolarHBondContact O-N 3.09Å; Q237-L239 PolarHBondContact O-N 3.17Å; Q237-W240 WeakPolarHBondContact O-CB 3.24Å; Q237-W240 PolarHBondContact O-N 3.06Å; Q237-T241 PolarHBondContact O-N 2.82Å; Q237-T241 VanDerWaalsContact O-N 3.15Å; Q237-T241 PolarHBondContact O-OG1 3.11Å; Q237-N307 PolarHBondContact NE2-ND2 3.36Å |
| 238 | I | 67.3 | Low | 69.1 | Low | 88 Ų | 88 | 73.1 Ų | 73.1 | 45% | 0.451 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -58.4 | -33.6 | 176.7 | -54.2 | 173.2 | 0 | 0 | 0 | 111.3 | P236 W240 T241 V242 | P236-I238 PolarHBondContact O-N 3.4Å; I238-W240 VanDerWaalsContact C-N 3.34Å; I238-W240 PolarHBondContact O-N 3.47Å; I238-T241 PolarHBondContact O-N 2.85Å; I238-V242 HydrophobicContact CG2-CG2 4.42Å; I238-V242 WeakPolarHBondContact O-CG2 3.24Å; I238-V242 PolarHBondContact O-N 3.25Å |
| 239 | L | 75.1 | Confident | 70.4 | Confident | 14 Ų | 14 | 68.4 Ų | 68.4 | 7% | 0.073 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -61.7 | -42.4 | 175.6 | 178.9 | 64.5 | 0 | 0 | 0 | 111.6 | I131 Y214 I217 L221 P235 P236 Q237 V242 A243 | I131-L239 HydrophobicContact CD1-CB 4.44Å; I131-L239 HydrophobicContact CD1-CD1 4.05Å; I131-L239 HydrophobicContact CD1-CD2 4.14Å; I131-L239 HydrophobicContact CD1-CG 4.45Å; Y214-L239 HydrophobicContact CD1-CD1 4.28Å; Y214-L239 HydrophobicContact CE1-CD1 3.6Å; Y214-L239 HydrophobicContact CE1-CG 4.5Å; I217-L239 HydrophobicContact CD1-CD1 3.96Å; I217-L239 HydrophobicContact CG2-CD1 4.02Å; I217-L239 HydrophobicContact CG2-CD2 3.84Å; L221-L239 HydrophobicContact CD1-CD2 3.84Å; P235-L239 HydrophobicContact CB-CD2 4.25Å; P236-L239 HydrophobicContact CG-CB 4.31Å; P236-L239 WeakPolarHBondContact O-CB 3.49Å; P236-L239 PolarHBondContact O-N 3.37Å; Q237-L239 PolarHBondContact O-N 3.17Å; L239-V242 PolarHBondContact O-N 2.85Å; L239-A243 VanDerWaalsContact O-CB 3.26Å; L239-A243 WeakPolarHBondContact O-CB 3.32Å; L239-A243 PolarHBondContact O-N 3.42Å |
| 240 | W | 76.8 | Confident | 72 | Confident | 148 Ų | 148 | 59.1 Ų | 59.1 | 56% | 0.561 | 32% | 0.315 | S | S | * | . | H | α-helix | trans | -66.3 | -40.4 | 177.5 | -70.7 | 106.9 | 0 | 0 | 0 | 111.6 | P235 Q237 I238 A243 A244 V305 | P235-W240 HydrophobicContact CG-CZ2 4.28Å; Q237-W240 WeakPolarHBondContact O-CB 3.24Å; Q237-W240 PolarHBondContact O-N 3.06Å; I238-W240 VanDerWaalsContact C-N 3.34Å; I238-W240 PolarHBondContact O-N 3.47Å; W240-A243 PolarHBondContact O-N 3.35Å; W240-A244 VanDerWaalsContact O-CB 3.3Å; W240-A244 WeakPolarHBondContact O-CB 3.46Å; W240-A244 PolarHBondContact O-N 2.88Å; W240-V305 VanDerWaalsContact C-CG1 3.49Å; W240-V305 HydrophobicContact CB-CG1 3.84Å |
| 241 | T | 70.8 | Confident | 73.7 | Confident | 12 Ų | 12 | 60.2 Ų | 60.2 | 7% | 0.074 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -61.3 | -48.2 | 175.7 | -46.8 | 0 | 0 | 0 | 0 | 111.2 | Q237 I238 A243 A244 V245 Y302 V305 | Q237-T241 PolarHBondContact O-N 2.82Å; Q237-T241 VanDerWaalsContact O-N 3.15Å; Q237-T241 PolarHBondContact O-OG1 3.11Å; I238-T241 PolarHBondContact O-N 2.85Å; T241-A243 PolarHBondContact O-N 2.92Å; T241-A244 PolarHBondContact O-N 3.4Å; T241-V245 VanDerWaalsContact O-CG2 3.23Å; T241-V245 WeakPolarHBondContact O-CG2 3.47Å; T241-V245 PolarHBondContact O-N 3.06Å; T241-Y302 HydrophobicContact CG2-CD1 4.09Å; T241-V305 HydrophobicContact CG2-CB 4.35Å; T241-V305 PolarHBondContact OG1-O 3.2Å |
| 242 | V | 74.8 | Confident | 75.5 | Confident | 9 Ų | 9 | 52.8 Ų | 52.8 | 6% | 0.055 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -67 | -38.4 | 179 | -174.4 | 0 | 0 | 0 | 0 | 110.8 | M123 R127 Y214 I238 L239 A244 V245 V246 | M123-V242 HydrophobicContact CB-CG1 4.07Å; R127-V242 HydrophobicContact CG-CB 4.24Å; R127-V242 HydrophobicContact CG-CG1 4.35Å; R127-V242 HydrophobicContact CG-CG2 3.9Å; Y214-V242 WeakPolarHBondContact OH-CB 3.38Å; Y214-V242 WeakPolarHBondContact OH-CG1 3.42Å; I238-V242 HydrophobicContact CG2-CG2 4.42Å; I238-V242 WeakPolarHBondContact O-CG2 3.24Å; I238-V242 PolarHBondContact O-N 3.25Å; L239-V242 PolarHBondContact O-N 2.85Å; V242-A244 VanDerWaalsContact C-N 3.35Å; V242-A244 PolarHBondContact O-N 3.5Å; V242-V245 PolarHBondContact O-N 3.37Å; V242-V246 HydrophobicContact CG1-CG2 4.46Å; V242-V246 WeakPolarHBondContact O-CB 3.41Å; V242-V246 VanDerWaalsContact O-CG2 3.27Å; V242-V246 WeakPolarHBondContact O-CG2 3.46Å; V242-V246 PolarHBondContact O-N 2.88Å |
| 243 | A | 81.2 | Confident | 77.4 | Confident | 23 Ų | 23 | 45.4 Ų | 45.4 | 19% | 0.19 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -63 | -41.5 | 177 | 0 | 0 | 0 | 0 | 0 | 111.9 | Y214 L239 W240 T241 V246 M247 | Y214-A243 HydrophobicContact CD1-CB 4.47Å; Y214-A243 HydrophobicContact CE1-CB 3.66Å; Y214-A243 WeakPolarHBondContact OH-CA 3.29Å; Y214-A243 PolarHBondContact OH-N 3.08Å; L239-A243 VanDerWaalsContact O-CB 3.26Å; L239-A243 WeakPolarHBondContact O-CB 3.32Å; L239-A243 PolarHBondContact O-N 3.42Å; W240-A243 PolarHBondContact O-N 3.35Å; T241-A243 PolarHBondContact O-N 2.92Å; A243-V246 PolarHBondContact O-N 2.92Å; A243-M247 WeakPolarHBondContact O-CB 3.46Å; A243-M247 WeakPolarHBondContact O-CG 3.46Å; A243-M247 PolarHBondContact O-N 3.27Å |
| 244 | A | 82.4 | Confident | 79.1 | Confident | 28 Ų | 28 | 47.9 Ų | 47.9 | 23% | 0.231 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -65.2 | -41.4 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | W240 T241 V242 M247 A248 L301 V305 | W240-A244 VanDerWaalsContact O-CB 3.3Å; W240-A244 WeakPolarHBondContact O-CB 3.46Å; W240-A244 PolarHBondContact O-N 2.88Å; T241-A244 PolarHBondContact O-N 3.4Å; V242-A244 VanDerWaalsContact C-N 3.35Å; V242-A244 PolarHBondContact O-N 3.5Å; A244-M247 PolarHBondContact O-N 3.31Å; A244-A248 WeakPolarHBondContact O-CB 3.38Å; A244-A248 PolarHBondContact O-N 3.49Å; A244-L301 HydrophobicContact CB-CD2 4.14Å; A244-V305 HydrophobicContact CB-CG2 4.11Å |
| 245 | V | 79.8 | Confident | 80.8 | Confident | 2 Ų | 2 | 44.7 Ų | 44.7 | 1% | 0.012 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -63.6 | -42.4 | 175.5 | 172.3 | 0 | 0 | 0 | 0 | 111.2 | I120 T241 V242 A248 F249 L301 Y302 | I120-V245 HydrophobicContact CD1-CG1 4.06Å; I120-V245 HydrophobicContact CG1-CG1 4.02Å; T241-V245 VanDerWaalsContact O-CG2 3.23Å; T241-V245 WeakPolarHBondContact O-CG2 3.47Å; T241-V245 PolarHBondContact O-N 3.06Å; V242-V245 PolarHBondContact O-N 3.37Å; V245-A248 PolarHBondContact O-N 3.34Å; V245-F249 WeakPolarHBondContact O-CB 3.14Å; V245-F249 PolarHBondContact O-N 2.93Å; V245-L301 HydrophobicContact CB-CD1 4.41Å; V245-L301 HydrophobicContact CG2-CB 3.97Å; V245-L301 HydrophobicContact CG2-CD1 3.95Å; V245-Y302 HydrophobicContact CG2-CD1 4.24Å; V245-Y302 HydrophobicContact CG2-CE1 3.68Å |
| 246 | V | 83.4 | Confident | 82.2 | Confident | 12 Ų | 12 | 43.9 Ų | 43.9 | 7% | 0.073 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -59.8 | -48.8 | 174.3 | 163.2 | 0 | 0 | 0 | 0 | 111.4 | I120 I210 Y214 V242 A243 A248 F249 F250 | I120-V246 HydrophobicContact CG2-CG2 3.63Å; I210-V246 HydrophobicContact CG2-CB 4.28Å; I210-V246 HydrophobicContact CG2-CG1 3.48Å; I210-V246 VanDerWaalsContact CG2-CG1 3.48Å; I210-V246 HydrophobicContact CG2-CG2 3.74Å; Y214-V246 HydrophobicContact CE2-CG2 3.98Å; V242-V246 HydrophobicContact CG1-CG2 4.46Å; V242-V246 WeakPolarHBondContact O-CB 3.41Å; V242-V246 VanDerWaalsContact O-CG2 3.27Å; V242-V246 WeakPolarHBondContact O-CG2 3.46Å; V242-V246 PolarHBondContact O-N 2.88Å; A243-V246 PolarHBondContact O-N 2.92Å; V246-A248 PolarHBondContact O-N 2.98Å; V246-F249 PolarHBondContact O-N 2.99Å; V246-F250 HydrophobicContact CG1-CD2 3.85Å; V246-F250 HydrophobicContact CG1-CE2 3.76Å; V246-F250 WeakPolarHBondContact O-CD2 2.94Å; V246-F250 PolarHBondContact O-N 3.5Å; V246-F250 VanDerWaalsContact O-N 3.09Å |
| 247 | M | 86.5 | Confident | 83.5 | Confident | 117 Ų | 117 | 41.1 Ų | 41.1 | 58% | 0.576 | 21% | 0.207 | S | C | * | . | H | α-helix | trans | -61.4 | -45.1 | 178.5 | -76.1 | -70.1 | -65.5 | 0 | 0 | 111.5 | A243 A244 F249 F250 I251 | A243-M247 WeakPolarHBondContact O-CB 3.46Å; A243-M247 WeakPolarHBondContact O-CG 3.46Å; A243-M247 PolarHBondContact O-N 3.27Å; A244-M247 PolarHBondContact O-N 3.31Å; M247-F249 VanDerWaalsContact C-N 3.34Å; M247-F249 PolarHBondContact O-N 3.46Å; M247-F250 PolarHBondContact O-N 3.48Å; M247-I251 HydrophobicContact CE-CD1 4.32Å; M247-I251 WeakPolarHBondContact O-CB 3.32Å; M247-I251 VanDerWaalsContact O-CG1 3.22Å; M247-I251 WeakPolarHBondContact O-CG1 3.49Å; M247-I251 PolarHBondContact O-N 3.04Å |
| 248 | A | 86.1 | Confident | 84.7 | Confident | 13 Ų | 13 | 38.4 Ų | 38.4 | 11% | 0.107 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -61.8 | -42.3 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112 | A244 V245 V246 F250 I251 C252 I297 L301 | A244-A248 WeakPolarHBondContact O-CB 3.38Å; A244-A248 PolarHBondContact O-N 3.49Å; V245-A248 PolarHBondContact O-N 3.34Å; V246-A248 PolarHBondContact O-N 2.98Å; A248-F250 PolarHBondContact O-N 3.07Å; A248-I251 PolarHBondContact O-N 3.29Å; A248-C252 VanDerWaalsContact O-CB 3.24Å; A248-C252 WeakPolarHBondContact O-CB 3.39Å; A248-C252 PolarHBondContact O-N 3.39Å; A248-C252 PolarHBondContact O-SG 3.34Å; A248-I297 HydrophobicContact CB-CG2 3.9Å; A248-L301 HydrophobicContact CB-CD1 3.55Å |
| 249 | F | 84.1 | Confident | 85.9 | Confident | 0 Ų | 0 | 34.6 Ų | 34.6 | 0% | 0 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -57.2 | -51.7 | 175.6 | -177.7 | -84.7 | 0 | 0 | 0 | 111.4 | L113 I117 I120 V245 V246 M247 C252 W253 N294 | L113-F249 HydrophobicContact CD1-CZ 4.48Å; I117-F249 HydrophobicContact CB-CE1 4.12Å; I117-F249 HydrophobicContact CB-CE2 3.82Å; I117-F249 HydrophobicContact CB-CZ 3.48Å; I117-F249 VanDerWaalsContact CB-CZ 3.48Å; I117-F249 HydrophobicContact CD1-CD1 3.57Å; I117-F249 HydrophobicContact CD1-CD2 4.35Å; I117-F249 HydrophobicContact CD1-CE1 3.29Å; I117-F249 HydrophobicContact CD1-CE2 4.09Å; I117-F249 HydrophobicContact CD1-CG 4.13Å; I117-F249 HydrophobicContact CD1-CZ 3.59Å; I117-F249 HydrophobicContact CG1-CD1 4.49Å; I117-F249 HydrophobicContact CG1-CE1 3.74Å; I117-F249 HydrophobicContact CG1-CE2 4.32Å; I117-F249 HydrophobicContact CG1-CZ 3.65Å; I120-F249 HydrophobicContact CD1-CB 3.9Å; I120-F249 HydrophobicContact CD1-CD2 3.53Å; I120-F249 HydrophobicContact CD1-CE2 4.38Å; I120-F249 HydrophobicContact CD1-CG 3.89Å; V245-F249 WeakPolarHBondContact O-CB 3.14Å; V245-F249 PolarHBondContact O-N 2.93Å; V246-F249 PolarHBondContact O-N 2.99Å; M247-F249 VanDerWaalsContact C-N 3.34Å; M247-F249 PolarHBondContact O-N 3.46Å; F249-C252 PolarHBondContact O-N 3.26Å; F249-W253 AromaticContact CD2-CD1 3.48Å; F249-W253 VanDerWaalsContact CD2-CD1 3.48Å; F249-W253 AromaticContact CD2-NE1 3.79Å; F249-W253 HydrophobicContact CE1-CB 4.14Å; F249-W253 AromaticContact CE1-CD1 3.98Å; F249-W253 HydrophobicContact CE1-CG 4.19Å; F249-W253 AromaticContact CE2-CD1 3.3Å; F249-W253 HydrophobicContact CE2-CG 4.05Å; F249-W253 AromaticContact CE2-NE1 3.46Å; F249-W253 AromaticContact CG-CD1 3.9Å; F249-W253 HydrophobicContact CZ-CB 4.26Å; F249-W253 AromaticContact CZ-CD1 3.54Å; F249-W253 AromaticContact CZ-CG 3.85Å; F249-W253 HydrophobicContact CZ-CG 3.85Å; F249-W253 WeakPolarHBondContact O-CB 3.4Å; F249-W253 VanDerWaalsContact O-CD1 3.31Å; F249-W253 PolarHBondContact O-N 2.86Å; F249-N294 VanDerWaalsContact CA-OD1 3.28Å; F249-N294 WeakPolarHBondContact CA-OD1 3.41Å; F249-N294 PolarHBondContact N-OD1 3.49Å |
| 250 | F | 89 | Confident | 86.6 | Confident | 27 Ų | 27 | 35 Ų | 35 | 12% | 0.118 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -66.9 | -41.2 | -178.7 | -72.4 | -58.9 | 0 | 0 | 0 | 112.5 | F203 L207 I210 V246 M247 A248 C252 W253 F254 | F203-F250 HydrophobicContact CD2-CD1 4.17Å; F203-F250 HydrophobicContact CD2-CE1 4.24Å; F203-F250 AromaticContact CE2-CD1 3.52Å; F203-F250 HydrophobicContact CE2-CD1 3.52Å; F203-F250 HydrophobicContact CE2-CE1 4Å; F203-F250 AromaticContact CZ-CD1 3.94Å; F203-F250 HydrophobicContact CZ-CD1 3.94Å; F203-F250 HydrophobicContact CZ-CE1 4.41Å; L207-F250 HydrophobicContact CB-CE1 3.61Å; L207-F250 HydrophobicContact CB-CZ 3.73Å; L207-F250 HydrophobicContact CD1-CD1 3.76Å; L207-F250 HydrophobicContact CD1-CD2 3.96Å; L207-F250 HydrophobicContact CD1-CE1 3.53Å; L207-F250 HydrophobicContact CD1-CE2 3.69Å; L207-F250 HydrophobicContact CD1-CG 4.02Å; L207-F250 HydrophobicContact CD1-CZ 3.52Å; L207-F250 HydrophobicContact CG-CE1 4.11Å; L207-F250 HydrophobicContact CG-CZ 4.24Å; I210-F250 HydrophobicContact CD1-CE2 4.15Å; I210-F250 HydrophobicContact CD1-CZ 4.04Å; I210-F250 HydrophobicContact CG2-CE2 4.46Å; V246-F250 HydrophobicContact CG1-CD2 3.85Å; V246-F250 HydrophobicContact CG1-CE2 3.76Å; V246-F250 WeakPolarHBondContact O-CD2 2.94Å; V246-F250 PolarHBondContact O-N 3.5Å; V246-F250 VanDerWaalsContact O-N 3.09Å; M247-F250 PolarHBondContact O-N 3.48Å; A248-F250 PolarHBondContact O-N 3.07Å; F250-C252 VanDerWaalsContact C-N 3.27Å; F250-C252 PolarHBondContact O-N 2.89Å; F250-W253 PolarHBondContact O-N 2.96Å; F250-F254 WeakPolarHBondContact O-CA 3.26Å; F250-F254 WeakPolarHBondContact O-CB 3.38Å; F250-F254 PolarHBondContact O-N 3.34Å |
| 251 | I | 91.6 | Very high | 87.3 | Confident | 105 Ų | 105 | 31.8 Ų | 31.8 | 54% | 0.538 | 17% | 0.172 | S | C | . | . | H | α-helix | trans | -60.5 | -40.7 | 175.3 | -69 | 167.6 | 0 | 0 | 0 | 110.7 | M247 A248 P255 | M247-I251 HydrophobicContact CE-CD1 4.32Å; M247-I251 WeakPolarHBondContact O-CB 3.32Å; M247-I251 VanDerWaalsContact O-CG1 3.22Å; M247-I251 WeakPolarHBondContact O-CG1 3.49Å; M247-I251 PolarHBondContact O-N 3.04Å; A248-I251 PolarHBondContact O-N 3.29Å; I251-P255 VanDerWaalsContact O-CD 3.29Å; I251-P255 WeakPolarHBondContact O-CD 3.44Å |
| 252 | C | 92.5 | Very high | 88.2 | Confident | 4 Ų | 4 | 33.2 Ų | 33.2 | 3% | 0.027 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -72.9 | -43.6 | -177.8 | -68.3 | 0 | 0 | 0 | 0 | 112.7 | A248 F249 F250 L290 G291 N294 | A248-C252 VanDerWaalsContact O-CB 3.24Å; A248-C252 WeakPolarHBondContact O-CB 3.39Å; A248-C252 PolarHBondContact O-N 3.39Å; A248-C252 PolarHBondContact O-SG 3.34Å; F249-C252 PolarHBondContact O-N 3.26Å; F250-C252 VanDerWaalsContact C-N 3.27Å; F250-C252 PolarHBondContact O-N 2.89Å; C252-L290 WeakPolarHBondContact CB-O 3.32Å; C252-L290 CarbonylContact O-C 3.58Å; C252-G291 WeakPolarHBondContact O-CA 3.28Å; C252-G291 PolarHBondContact O-N 3.02Å; C252-N294 HydrophobicContact CB-CB 3.89Å |
| 253 | W | 92.3 | Very high | 88.9 | Confident | 2 Ų | 2 | 34.8 Ų | 34.8 | 1% | 0.008 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -94.4 | -24.4 | -171.2 | -73.5 | 99.1 | 0 | 0 | 0 | 114.4 | L113 F249 F250 F256 H257 G291 F292 | L113-W253 HydrophobicContact CB-CH2 4.16Å; L113-W253 HydrophobicContact CD1-CD2 3.84Å; L113-W253 HydrophobicContact CD1-CE3 3.66Å; L113-W253 HydrophobicContact CD1-CH2 3.74Å; L113-W253 HydrophobicContact CD1-CZ2 3.9Å; L113-W253 HydrophobicContact CD1-CZ3 3.63Å; L113-W253 HydrophobicContact CD2-CZ3 4.35Å; L113-W253 HydrophobicContact CG-CH2 4.4Å; L113-W253 HydrophobicContact CG-CZ3 4.41Å; F249-W253 AromaticContact CD2-CD1 3.48Å; F249-W253 VanDerWaalsContact CD2-CD1 3.48Å; F249-W253 AromaticContact CD2-NE1 3.79Å; F249-W253 HydrophobicContact CE1-CB 4.14Å; F249-W253 AromaticContact CE1-CD1 3.98Å; F249-W253 HydrophobicContact CE1-CG 4.19Å; F249-W253 AromaticContact CE2-CD1 3.3Å; F249-W253 HydrophobicContact CE2-CG 4.05Å; F249-W253 AromaticContact CE2-NE1 3.46Å; F249-W253 AromaticContact CG-CD1 3.9Å; F249-W253 HydrophobicContact CZ-CB 4.26Å; F249-W253 AromaticContact CZ-CD1 3.54Å; F249-W253 AromaticContact CZ-CG 3.85Å; F249-W253 HydrophobicContact CZ-CG 3.85Å; F249-W253 WeakPolarHBondContact O-CB 3.4Å; F249-W253 VanDerWaalsContact O-CD1 3.31Å; F249-W253 PolarHBondContact O-N 2.86Å; F250-W253 PolarHBondContact O-N 2.96Å; W253-F256 HydrophobicContact CE3-CD1 4.02Å; W253-F256 HydrophobicContact CZ3-CD1 4.14Å; W253-F256 PolarHBondContact O-N 2.95Å; W253-H257 PolarHBondContact O-CD2 3.06Å; W253-H257 PolarHBondContact O-N 2.97Å; W253-G291 PolarHBondContact NE1-O 3Å; W253-F292 HydrophobicContact CH2-CD1 4.19Å; W253-F292 HydrophobicContact CH2-CE1 4.28Å |
| 254 | F | 92.9 | Very high | 89.2 | Confident | 108 Ų | 108 | 33.8 Ų | 33.8 | 47% | 0.474 | 18% | 0.179 | S | C | . | . | H | α-helix | trans | -55.6 | -47.6 | -178.5 | 174.1 | -112.3 | 0 | 0 | 0 | 113.1 | F203 F250 F256 H257 C258 | F203-F254 AromaticContact CE1-CD2 3.87Å; F203-F254 HydrophobicContact CE1-CD2 3.87Å; F203-F254 HydrophobicContact CE1-CE2 4.43Å; F203-F254 HydrophobicContact CE2-CB 3.92Å; F203-F254 HydrophobicContact CE2-CD2 4.15Å; F203-F254 HydrophobicContact CZ-CB 3.92Å; F203-F254 AromaticContact CZ-CD2 3.36Å; F203-F254 HydrophobicContact CZ-CD2 3.36Å; F203-F254 HydrophobicContact CZ-CE2 4.27Å; F203-F254 HydrophobicContact CZ-CG 4.1Å; F250-F254 WeakPolarHBondContact O-CA 3.26Å; F250-F254 WeakPolarHBondContact O-CB 3.38Å; F250-F254 PolarHBondContact O-N 3.34Å; F254-F256 VanDerWaalsContact C-N 3.26Å; F254-F256 PolarHBondContact O-N 3.43Å; F254-H257 PolarHBondContact O-N 3.25Å; F254-H257 VanDerWaalsContact O-N 3.11Å; F254-C258 WeakPolarHBondContact CE2-SG 3.25Å; F254-C258 WeakPolarHBondContact CZ-SG 3.22Å; F254-C258 PolarHBondContact O-N 2.81Å; F254-C258 PolarHBondContact O-SG 3.47Å; F254-C258 VanDerWaalsContact O-SG 3.34Å |
| 255 | P | 94.2 | Very high | 89.5 | Confident | 37 Ų | 37 | 34 Ų | 34 | 24% | 0.24 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -59.4 | -38.8 | -179.7 | -27.9 | 40.1 | 0 | 0 | 0 | 112.7 | I251 C258 V259 T287 L290 | I251-P255 VanDerWaalsContact O-CD 3.29Å; I251-P255 WeakPolarHBondContact O-CD 3.44Å; P255-C258 PolarHBondContact O-N 3.18Å; P255-V259 WeakPolarHBondContact O-CG2 3.41Å; P255-V259 PolarHBondContact O-N 2.84Å; P255-V259 VanDerWaalsContact O-N 3.07Å; P255-T287 HydrophobicContact CB-CG2 3.63Å; P255-L290 HydrophobicContact CB-CD2 4.38Å; P255-L290 HydrophobicContact CG-CD2 3.78Å |
| 256 | F | 93.2 | Very high | 89.9 | Confident | 8 Ų | 8 | 35 Ų | 35 | 4% | 0.035 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -66.3 | -42.3 | 177.2 | 172.4 | -100.3 | 0 | 0 | 0 | 111.9 | W253 F254 V259 T260 T284 L288 | W253-F256 HydrophobicContact CE3-CD1 4.02Å; W253-F256 HydrophobicContact CZ3-CD1 4.14Å; W253-F256 PolarHBondContact O-N 2.95Å; F254-F256 VanDerWaalsContact C-N 3.26Å; F254-F256 PolarHBondContact O-N 3.43Å; F256-V259 PolarHBondContact O-N 3.33Å; F256-T260 WeakPolarHBondContact CZ-OG1 3.26Å; F256-T260 WeakPolarHBondContact O-CB 3.38Å; F256-T260 PolarHBondContact O-N 3.37Å; F256-T260 PolarHBondContact O-OG1 2.87Å; F256-T284 HydrophobicContact CE2-CG2 4.29Å; F256-L288 HydrophobicContact CD2-CD2 3.53Å; F256-L288 HydrophobicContact CD2-CG 3.59Å; F256-L288 HydrophobicContact CE1-CD2 4.44Å; F256-L288 HydrophobicContact CE2-CD1 4.2Å; F256-L288 HydrophobicContact CE2-CD2 3.33Å; F256-L288 HydrophobicContact CE2-CG 3.55Å; F256-L288 HydrophobicContact CG-CD2 4.18Å; F256-L288 HydrophobicContact CZ-CD2 3.84Å |
| 257 | H | 92.2 | Very high | 89.8 | Confident | 5 Ų | 5 | 41.1 Ų | 41.1 | 2% | 0.023 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -67.5 | -34.5 | 176.3 | -73.5 | -65.7 | 0 | 0 | 0 | 112.7 | F203 W253 F254 T260 F261 | F203-H257 HydrophobicContact CB-CB 4.4Å; F203-H257 HydrophobicContact CD1-CB 4.42Å; F203-H257 HydrophobicContact CD2-CB 4.2Å; F203-H257 AromaticContact CD2-CD2 3.23Å; F203-H257 WeakPolarHBondContact CD2-CD2 3.37Å; F203-H257 AromaticContact CD2-CG 3.83Å; F203-H257 AromaticContact CD2-NE2 3.93Å; F203-H257 HydrophobicContact CG-CB 4.08Å; F203-H257 AromaticContact CG-CD2 3.64Å; F203-H257 AromaticContact CG-CG 3.81Å; W253-H257 PolarHBondContact O-CD2 3.06Å; W253-H257 PolarHBondContact O-N 2.97Å; F254-H257 PolarHBondContact O-N 3.25Å; F254-H257 VanDerWaalsContact O-N 3.11Å; H257-T260 PolarHBondContact O-N 3.41Å; H257-F261 VanDerWaalsContact O-CB 3.24Å; H257-F261 WeakPolarHBondContact O-CB 3.5Å; H257-F261 PolarHBondContact O-N 2.9Å |
| 258 | C | 92.8 | Very high | 89.6 | Confident | 44 Ų | 44 | 38.3 Ų | 38.3 | 30% | 0.297 | 20% | 0.196 | S | C | . | . | H | α-helix | trans | -61.8 | -48.5 | 172.2 | -69.7 | 0 | 0 | 0 | 0 | 111.8 | F254 P255 T260 F261 L262 | F254-C258 WeakPolarHBondContact CE2-SG 3.25Å; F254-C258 WeakPolarHBondContact CZ-SG 3.22Å; F254-C258 PolarHBondContact O-N 2.81Å; F254-C258 PolarHBondContact O-SG 3.47Å; F254-C258 VanDerWaalsContact O-SG 3.34Å; P255-C258 PolarHBondContact O-N 3.18Å; C258-T260 VanDerWaalsContact C-N 3.35Å; C258-T260 PolarHBondContact O-N 3.3Å; C258-F261 PolarHBondContact O-N 3.26Å; C258-L262 WeakPolarHBondContact O-CG 3.18Å; C258-L262 PolarHBondContact O-N 3.34Å |
| 259 | V | 92.9 | Very high | 89.4 | Confident | 8 Ų | 8 | 40.7 Ų | 40.7 | 5% | 0.048 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -64.7 | -40.8 | 178.6 | 176.9 | 0 | 0 | 0 | 0 | 111.2 | P255 F256 F261 L262 D263 V280 L283 T284 T287 | P255-V259 WeakPolarHBondContact O-CG2 3.41Å; P255-V259 PolarHBondContact O-N 2.84Å; P255-V259 VanDerWaalsContact O-N 3.07Å; F256-V259 PolarHBondContact O-N 3.33Å; V259-F261 VanDerWaalsContact C-N 3.33Å; V259-F261 PolarHBondContact O-N 2.84Å; V259-L262 PolarHBondContact O-N 3.11Å; V259-D263 PolarHBondContact O-N 3.14Å; V259-V280 HydrophobicContact CG1-CB 4.38Å; V259-V280 HydrophobicContact CG1-CG2 4.21Å; V259-L283 HydrophobicContact CG2-CB 4.02Å; V259-T284 VanDerWaalsContact CG1-OG1 3.26Å; V259-T284 WeakPolarHBondContact CG1-OG1 3.44Å; V259-T287 HydrophobicContact CG2-CG2 4.16Å |
| 260 | T | 90.1 | Very high | 89.4 | Confident | 22 Ų | 22 | 50.2 Ų | 50.2 | 14% | 0.135 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -61.9 | -41.4 | 174.7 | -56.1 | 0 | 0 | 0 | 0 | 111.6 | V199 F256 H257 C258 D263 L264 | V199-T260 HydrophobicContact CG2-CG2 4.21Å; F256-T260 WeakPolarHBondContact CZ-OG1 3.26Å; F256-T260 WeakPolarHBondContact O-CB 3.38Å; F256-T260 PolarHBondContact O-N 3.37Å; F256-T260 PolarHBondContact O-OG1 2.87Å; H257-T260 PolarHBondContact O-N 3.41Å; C258-T260 VanDerWaalsContact C-N 3.35Å; C258-T260 PolarHBondContact O-N 3.3Å; T260-D263 PolarHBondContact O-N 2.65Å; T260-L264 WeakPolarHBondContact O-CG 3.26Å; T260-L264 PolarHBondContact O-N 3.33Å |
| 261 | F | 90.5 | Very high | 89.2 | Confident | 81 Ų | 81 | 51.6 Ų | 51.6 | 36% | 0.355 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -65.7 | -39.9 | 177.1 | 179.4 | -101.8 | 0 | 0 | 0 | 112 | W196 H257 C258 V259 L264 L265 | W196-F261 AromaticContact CH2-CD2 3.96Å; W196-F261 HydrophobicContact CH2-CD2 3.96Å; W196-F261 AromaticContact CH2-CE2 3.48Å; W196-F261 HydrophobicContact CH2-CE2 3.48Å; W196-F261 VanDerWaalsContact CH2-CE2 3.48Å; W196-F261 HydrophobicContact CH2-CZ 4.49Å; W196-F261 AromaticContact CZ3-CD2 3.93Å; W196-F261 HydrophobicContact CZ3-CD2 3.93Å; W196-F261 AromaticContact CZ3-CE2 3.66Å; W196-F261 HydrophobicContact CZ3-CE2 3.66Å; H257-F261 VanDerWaalsContact O-CB 3.24Å; H257-F261 WeakPolarHBondContact O-CB 3.5Å; H257-F261 PolarHBondContact O-N 2.9Å; C258-F261 PolarHBondContact O-N 3.26Å; V259-F261 VanDerWaalsContact C-N 3.33Å; V259-F261 PolarHBondContact O-N 2.84Å; F261-L264 PolarHBondContact O-N 2.94Å; F261-L265 HydrophobicContact CD1-CD1 3.97Å; F261-L265 HydrophobicContact CD1-CG 4.37Å; F261-L265 HydrophobicContact CE1-CD1 3.44Å; F261-L265 VanDerWaalsContact CE1-CD1 3.44Å; F261-L265 HydrophobicContact CE1-CG 4.02Å; F261-L265 HydrophobicContact CZ-CD1 3.94Å; F261-L265 HydrophobicContact CZ-CD2 4.26Å; F261-L265 HydrophobicContact CZ-CG 4.16Å; F261-L265 WeakPolarHBondContact O-CG 3.39Å; F261-L265 PolarHBondContact O-N 2.88Å |
| 262 | L | 90.8 | Very high | 88.4 | Confident | 43 Ų | 43 | 53 Ų | 53 | 23% | 0.225 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -61.5 | -42 | 173.2 | -72.6 | 171.2 | 0 | 0 | 0 | 112.1 | C258 V259 L264 L265 S266 L271 | C258-L262 WeakPolarHBondContact O-CG 3.18Å; C258-L262 PolarHBondContact O-N 3.34Å; V259-L262 PolarHBondContact O-N 3.11Å; L262-L264 VanDerWaalsContact C-N 3.35Å; L262-L264 PolarHBondContact O-N 3.08Å; L262-L265 PolarHBondContact O-N 3.23Å; L262-S266 WeakPolarHBondContact O-CB 3.34Å; L262-S266 PolarHBondContact O-N 3.18Å; L262-L271 HydrophobicContact CD2-CD1 4.12Å |
| 263 | D | 88.8 | Confident | 87.9 | Confident | 42 Ų | 42 | 55 Ų | 55 | 23% | 0.225 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -61.1 | -42.8 | 175.4 | -170.1 | 27.1 | 0 | 0 | 0 | 111.4 | F191 V259 T260 S266 K267 V280 | F191-D263 WeakPolarHBondContact CZ-OD2 3.21Å; V259-D263 PolarHBondContact O-N 3.14Å; T260-D263 PolarHBondContact O-N 2.65Å; D263-S266 PolarHBondContact O-N 3.19Å; D263-K267 WeakPolarHBondContact O-CB 3.24Å; D263-K267 VanDerWaalsContact O-CG 3.32Å; D263-K267 WeakPolarHBondContact O-CG 3.33Å; D263-K267 PolarHBondContact O-N 2.87Å; D263-V280 HydrophobicContact CB-CG1 3.89Å; D263-V280 HydrophobicContact CB-CG2 3.93Å |
| 264 | L | 87.9 | Confident | 87.5 | Confident | 1 Ų | 1 | 56.8 Ų | 56.8 | 1% | 0.005 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -63.5 | -42.4 | 175.6 | -68.9 | 171.2 | 0 | 0 | 0 | 113.1 | F191 L192 W196 V199 T260 F261 L262 S266 K267 N268 | F191-L264 HydrophobicContact CD1-CD2 4.36Å; F191-L264 HydrophobicContact CE1-CD2 3.83Å; F191-L264 HydrophobicContact CZ-CD2 4.43Å; L192-L264 HydrophobicContact CD2-CD2 3.86Å; W196-L264 HydrophobicContact CD2-CD1 4.14Å; W196-L264 HydrophobicContact CE3-CD1 4.49Å; W196-L264 HydrophobicContact CG-CD1 4.36Å; V199-L264 HydrophobicContact CG2-CD1 4.16Å; T260-L264 WeakPolarHBondContact O-CG 3.26Å; T260-L264 PolarHBondContact O-N 3.33Å; F261-L264 PolarHBondContact O-N 2.94Å; L262-L264 VanDerWaalsContact C-N 3.35Å; L262-L264 PolarHBondContact O-N 3.08Å; L264-S266 VanDerWaalsContact C-N 3.31Å; L264-K267 PolarHBondContact O-N 3.15Å; L264-N268 WeakPolarHBondContact O-CB 3.16Å; L264-N268 PolarHBondContact O-N 3.19Å |
| 265 | L | 88.1 | Confident | 87.1 | Confident | 32 Ų | 32 | 57.4 Ų | 57.4 | 17% | 0.168 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -64 | -39.4 | 175.7 | -72.7 | -178.2 | 0 | 0 | 0 | 111.5 | F261 L262 N268 W270 L271 | F261-L265 HydrophobicContact CD1-CD1 3.97Å; F261-L265 HydrophobicContact CD1-CG 4.37Å; F261-L265 HydrophobicContact CE1-CD1 3.44Å; F261-L265 VanDerWaalsContact CE1-CD1 3.44Å; F261-L265 HydrophobicContact CE1-CG 4.02Å; F261-L265 HydrophobicContact CZ-CD1 3.94Å; F261-L265 HydrophobicContact CZ-CD2 4.26Å; F261-L265 HydrophobicContact CZ-CG 4.16Å; F261-L265 WeakPolarHBondContact O-CG 3.39Å; F261-L265 PolarHBondContact O-N 2.88Å; L262-L265 PolarHBondContact O-N 3.23Å; L265-N268 PolarHBondContact O-N 3.36Å; L265-W270 HydrophobicContact CB-CB 4.5Å; L265-W270 HydrophobicContact CD2-CB 4.4Å; L265-W270 WeakPolarHBondContact O-CB 3.28Å; L265-W270 PolarHBondContact O-N 3.33Å; L265-L271 HydrophobicContact CB-CD1 3.76Å; L265-L271 HydrophobicContact CB-CG 4.16Å; L265-L271 HydrophobicContact CD1-CD1 3.75Å; L265-L271 HydrophobicContact CG-CD1 4.44Å; L265-L271 PolarHBondContact O-N 2.82Å |
| 266 | S | 87.3 | Confident | 86.7 | Confident | 24 Ų | 24 | 55.7 Ų | 55.7 | 17% | 0.168 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -66 | -46 | 178.1 | -171.5 | 0 | 0 | 0 | 0 | 112.1 | L262 D263 L264 N268 G269 L271 | L262-S266 WeakPolarHBondContact O-CB 3.34Å; L262-S266 PolarHBondContact O-N 3.18Å; D263-S266 PolarHBondContact O-N 3.19Å; L264-S266 VanDerWaalsContact C-N 3.31Å; S266-N268 VanDerWaalsContact C-N 3.29Å; S266-N268 PolarHBondContact O-N 2.94Å; S266-G269 PolarHBondContact O-N 2.98Å; S266-L271 WeakPolarHBondContact CA-O 3.48Å; S266-L271 WeakPolarHBondContact CB-O 3.47Å; S266-L271 PolarHBondContact OG-O 3.02Å |
| 267 | K | 82.3 | Confident | 86.2 | Confident | 140 Ų | 140 | 58.8 Ų | 58.8 | 61% | 0.609 | 31% | 0.309 | S | S | * | . | H | α-helix | trans | -65.6 | -29.1 | 177.9 | -70.1 | -69.8 | -177.3 | -177.1 | 0 | 114 | F191 L192 D263 L264 G269 | F191-K267 HydrophobicContact CD1-CG 4.49Å; F191-K267 HydrophobicContact CE1-CB 4.02Å; F191-K267 HydrophobicContact CE1-CG 3.72Å; F191-K267 HydrophobicContact CZ-CG 4.26Å; L192-K267 HydrophobicContact CD2-CB 4.38Å; D263-K267 WeakPolarHBondContact O-CB 3.24Å; D263-K267 VanDerWaalsContact O-CG 3.32Å; D263-K267 WeakPolarHBondContact O-CG 3.33Å; D263-K267 PolarHBondContact O-N 2.87Å; L264-K267 PolarHBondContact O-N 3.15Å; K267-G269 PolarHBondContact O-N 3.41Å |
| 268 | N | 82.7 | Confident | 86 | Confident | 59 Ų | 59 | 62.1 Ų | 62.1 | 32% | 0.316 | 32% | 0.321 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -76.1 | -1.9 | 172.3 | -79.7 | -11.5 | 0 | 0 | 0 | 113.6 | L192 L264 L265 S266 W270 | L192-N268 WeakPolarHBondContact CD1-OD1 3.32Å; L192-N268 WeakPolarHBondContact CD2-OD1 3.32Å; L264-N268 WeakPolarHBondContact O-CB 3.16Å; L264-N268 PolarHBondContact O-N 3.19Å; L265-N268 PolarHBondContact O-N 3.36Å; S266-N268 VanDerWaalsContact C-N 3.29Å; S266-N268 PolarHBondContact O-N 2.94Å; N268-W270 VanDerWaalsContact C-N 3.31Å; N268-W270 HydrophobicContact CB-CG 4.43Å; N268-W270 VanDerWaalsContact O-CD1 3.29Å; N268-W270 PolarHBondContact O-N 2.81Å |
| 269 | G | 81.4 | Confident | 85.7 | Confident | 62 Ų | 62 | 61.2 Ų | 61.2 | 64% | 0.639 | 31% | 0.314 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 76.8 | 13.5 | -177.2 | 0 | 0 | 0 | 0 | 0 | 114.4 | S266 K267 | S266-G269 PolarHBondContact O-N 2.98Å; K267-G269 PolarHBondContact O-N 3.41Å |
| 270 | W | 84.4 | Confident | 85.5 | Confident | 200 Ų | 200 | 61.5 Ų | 61.5 | 76% | 0.758 | 32% | 0.316 | S | S | * | . | S | Bend | trans | -82.3 | -26.6 | 178.7 | -68.1 | 56.3 | 0 | 0 | 0 | 111.8 | L265 N268 | L265-W270 HydrophobicContact CB-CB 4.5Å; L265-W270 HydrophobicContact CD2-CB 4.4Å; L265-W270 WeakPolarHBondContact O-CB 3.28Å; L265-W270 PolarHBondContact O-N 3.33Å; N268-W270 VanDerWaalsContact C-N 3.31Å; N268-W270 HydrophobicContact CB-CG 4.43Å; N268-W270 VanDerWaalsContact O-CD1 3.29Å; N268-W270 PolarHBondContact O-N 2.81Å |
| 271 | L | 83.6 | Confident | 85.2 | Confident | 56 Ų | 56 | 64 Ų | 64 | 29% | 0.293 | 33% | 0.332 | S | S | . | . | trans | -136 | 110.6 | 179.5 | -66.4 | 175.7 | 0 | 0 | 0 | 109.6 | L262 L265 S266 | L262-L271 HydrophobicContact CD2-CD1 4.12Å; L265-L271 HydrophobicContact CB-CD1 3.76Å; L265-L271 HydrophobicContact CB-CG 4.16Å; L265-L271 HydrophobicContact CD1-CD1 3.75Å; L265-L271 HydrophobicContact CG-CD1 4.44Å; L265-L271 PolarHBondContact O-N 2.82Å; S266-L271 WeakPolarHBondContact CA-O 3.48Å; S266-L271 WeakPolarHBondContact CB-O 3.47Å; S266-L271 PolarHBondContact OG-O 3.02Å | ||
| 272 | D | 75.3 | Confident | 85 | Confident | 134 Ų | 134 | 60.6 Ų | 60.6 | 72% | 0.717 | 32% | 0.317 | S | S | * | . | trans | -122.6 | 109.2 | 174.1 | -165.3 | 3.9 | 0 | 0 | 0 | 109.9 | ||||
| 273 | S | 82.4 | Confident | 85 | Confident | 48 Ų | 48 | 61.7 Ų | 61.7 | 34% | 0.336 | 32% | 0.323 | S | S | . | . | trans | -164.7 | 142.2 | -179.7 | -65.6 | 0 | 0 | 0 | 0 | 111.6 | W275 V276 T277 | S273-W275 PolarHBondContact O-N 3.41Å; S273-W275 VanDerWaalsContact O-N 3.17Å; S273-W275 PolarHBondContact OG-NE1 3.01Å; S273-V276 WeakPolarHBondContact O-CB 3.48Å; S273-V276 PolarHBondContact O-N 3.33Å; S273-T277 PolarHBondContact O-N 3.22Å | ||
| 274 | C | 83.6 | Confident | 85 | Confident | 39 Ų | 39 | 61.5 Ų | 61.5 | 26% | 0.264 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -53.2 | -37.8 | 176.5 | -71 | 0 | 0 | 0 | 0 | 113.8 | C19 V276 T277 W278 | C19-C274 HydrophobicContact CB-CB 3.73Å; C19-C274 WeakPolarHBondContact CB-SG 3.47Å; C19-C274 WeakPolarHBondContact SG-CA 3.17Å; C19-C274 WeakPolarHBondContact SG-CB 3.4Å; C19-C274 CovalentContact SG-SG 2.03Å; C19-C274 PolarHBondContact SG-SG 3.24Å; C274-V276 VanDerWaalsContact C-N 3.3Å; C274-V276 PolarHBondContact O-N 3.35Å; C274-T277 PolarHBondContact O-N 3.12Å; C274-W278 WeakPolarHBondContact O-CB 3.31Å; C274-W278 PolarHBondContact O-N 3.05Å |
| 275 | W | 84.5 | Confident | 85.1 | Confident | 121 Ų | 121 | 62.3 Ų | 62.3 | 46% | 0.458 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -65.2 | -32.6 | 179.5 | 72 | -97 | 0 | 0 | 0 | 112.3 | W22 S273 T279 | W22-W275 HydrophobicContact CH2-CB 4.47Å; W22-W275 HydrophobicContact CZ2-CB 4.38Å; S273-W275 PolarHBondContact O-N 3.41Å; S273-W275 VanDerWaalsContact O-N 3.17Å; S273-W275 PolarHBondContact OG-NE1 3.01Å; W275-T279 WeakPolarHBondContact O-CB 3.4Å; W275-T279 PolarHBondContact O-N 3.37Å; W275-T279 PolarHBondContact O-OG1 3.16Å |
| 276 | V | 86 | Confident | 85.2 | Confident | 1 Ų | 1 | 63.6 Ų | 63.6 | 1% | 0.006 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -68.4 | -51.7 | 177.4 | 179.5 | 0 | 0 | 0 | 0 | 109.4 | S273 C274 W278 T279 V280 | S273-V276 WeakPolarHBondContact O-CB 3.48Å; S273-V276 PolarHBondContact O-N 3.33Å; C274-V276 VanDerWaalsContact C-N 3.3Å; C274-V276 PolarHBondContact O-N 3.35Å; V276-W278 VanDerWaalsContact C-N 3.31Å; V276-W278 PolarHBondContact O-N 3.43Å; V276-T279 WeakPolarHBondContact O-CB 3.29Å; V276-T279 PolarHBondContact O-N 2.91Å; V276-T279 VanDerWaalsContact O-N 3.14Å; V276-V280 HydrophobicContact CG1-CG2 4.37Å; V276-V280 WeakPolarHBondContact O-CG2 3.37Å; V276-V280 PolarHBondContact O-N 2.82Å |
| 277 | T | 83.7 | Confident | 85.6 | Confident | 72 Ų | 72 | 63.1 Ų | 63.1 | 44% | 0.442 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -58.8 | -43.1 | 178.7 | -54.1 | 0 | 0 | 0 | 0 | 111.8 | S273 C274 T281 | S273-T277 PolarHBondContact O-N 3.22Å; C274-T277 PolarHBondContact O-N 3.12Å; T277-T281 WeakPolarHBondContact O-CB 3.38Å; T277-T281 PolarHBondContact O-N 2.6Å; T277-T281 PolarHBondContact O-OG1 3.05Å |
| 278 | W | 87 | Confident | 86.1 | Confident | 76 Ų | 76 | 57.7 Ų | 57.7 | 29% | 0.288 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -64.7 | -43.2 | 176.3 | -177.2 | 89 | 0 | 0 | 0 | 112 | W22 V23 C274 V276 T281 N282 | W22-W278 HydrophobicContact CB-CB 4.07Å; W22-W278 HydrophobicContact CB-CG 4.02Å; W22-W278 HydrophobicContact CD2-CB 4.09Å; W22-W278 HydrophobicContact CD2-CG 4.01Å; W22-W278 HydrophobicContact CE3-CB 3.7Å; W22-W278 AromaticContact CE3-CD1 3.58Å; W22-W278 AromaticContact CE3-CD2 3.36Å; W22-W278 HydrophobicContact CE3-CD2 3.36Å; W22-W278 AromaticContact CE3-CE2 3.76Å; W22-W278 AromaticContact CE3-CE3 3.93Å; W22-W278 HydrophobicContact CE3-CE3 3.93Å; W22-W278 AromaticContact CE3-CG 3.24Å; W22-W278 HydrophobicContact CE3-CG 3.24Å; W22-W278 AromaticContact CE3-NE1 3.82Å; W22-W278 HydrophobicContact CG-CB 4.3Å; W22-W278 HydrophobicContact CG-CG 4.36Å; W22-W278 HydrophobicContact CZ3-CB 4.41Å; W22-W278 AromaticContact CZ3-CD2 3.64Å; W22-W278 HydrophobicContact CZ3-CD2 3.64Å; W22-W278 AromaticContact CZ3-CE3 3.7Å; W22-W278 HydrophobicContact CZ3-CE3 3.7Å; W22-W278 AromaticContact CZ3-CG 3.98Å; W22-W278 HydrophobicContact CZ3-CG 3.98Å; W22-W278 HydrophobicContact CZ3-CZ3 4.23Å; V23-W278 PolarHBondContact O-NE1 2.9Å; C274-W278 WeakPolarHBondContact O-CB 3.31Å; C274-W278 PolarHBondContact O-N 3.05Å; V276-W278 VanDerWaalsContact C-N 3.31Å; V276-W278 PolarHBondContact O-N 3.43Å; W278-T281 PolarHBondContact O-N 3.16Å; W278-N282 HydrophobicContact CZ2-CB 4.36Å; W278-N282 PolarHBondContact NE1-ND2 3.22Å; W278-N282 VanDerWaalsContact NE1-ND2 3.13Å; W278-N282 WeakPolarHBondContact O-CB 3.11Å; W278-N282 PolarHBondContact O-N 3.48Å; W278-N282 PolarHBondContact O-ND2 3.23Å |
| 279 | T | 87.3 | Confident | 86.6 | Confident | 24 Ų | 24 | 55 Ų | 55 | 15% | 0.147 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -61.5 | -47.9 | 178.5 | -65.7 | 0 | 0 | 0 | 0 | 110.6 | W275 V276 T281 L283 | W275-T279 WeakPolarHBondContact O-CB 3.4Å; W275-T279 PolarHBondContact O-N 3.37Å; W275-T279 PolarHBondContact O-OG1 3.16Å; V276-T279 WeakPolarHBondContact O-CB 3.29Å; V276-T279 PolarHBondContact O-N 2.91Å; V276-T279 VanDerWaalsContact O-N 3.14Å; T279-T281 PolarHBondContact O-N 3.41Å; T279-L283 HydrophobicContact CG2-CD1 3.75Å; T279-L283 HydrophobicContact CG2-CG 4.24Å; T279-L283 WeakPolarHBondContact O-CA 3.26Å; T279-L283 WeakPolarHBondContact O-CB 3.27Å; T279-L283 WeakPolarHBondContact O-CG 3.46Å; T279-L283 PolarHBondContact O-N 2.77Å |
| 280 | V | 87.2 | Confident | 87.3 | Confident | 15 Ų | 15 | 55.3 Ų | 55.3 | 9% | 0.091 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -60 | -48.1 | 176.4 | 172.5 | 0 | 0 | 0 | 0 | 110.5 | V259 D263 V276 N282 T284 | V259-V280 HydrophobicContact CG1-CB 4.38Å; V259-V280 HydrophobicContact CG1-CG2 4.21Å; D263-V280 HydrophobicContact CB-CG1 3.89Å; D263-V280 HydrophobicContact CB-CG2 3.93Å; V276-V280 HydrophobicContact CG1-CG2 4.37Å; V276-V280 WeakPolarHBondContact O-CG2 3.37Å; V276-V280 PolarHBondContact O-N 2.82Å; V280-N282 PolarHBondContact O-N 3.1Å; V280-T284 WeakPolarHBondContact O-CB 3.47Å; V280-T284 PolarHBondContact O-N 3.04Å; V280-T284 VanDerWaalsContact O-N 3.16Å; V280-T284 PolarHBondContact O-OG1 3.47Å |
| 281 | T | 84.5 | Confident | 87.7 | Confident | 75 Ų | 75 | 45.8 Ų | 45.8 | 46% | 0.46 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -65 | -42.5 | -176 | -55.6 | 0 | 0 | 0 | 0 | 112.6 | P24 T277 W278 T279 P285 | P24-T281 HydrophobicContact CB-CG2 4.39Å; T277-T281 WeakPolarHBondContact O-CB 3.38Å; T277-T281 PolarHBondContact O-N 2.6Å; T277-T281 PolarHBondContact O-OG1 3.05Å; W278-T281 PolarHBondContact O-N 3.16Å; T279-T281 PolarHBondContact O-N 3.41Å; T281-P285 WeakPolarHBondContact O-CD 3.28Å |
| 282 | N | 86.3 | Confident | 88.2 | Confident | 8 Ų | 8 | 43.2 Ų | 43.2 | 4% | 0.043 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -91.3 | -35.1 | -173.4 | -67.9 | -86.4 | 0 | 0 | 0 | 113.3 | V25 W278 V280 P285 | V25-N282 PolarHBondContact N-OD1 3.08Å; W278-N282 HydrophobicContact CZ2-CB 4.36Å; W278-N282 PolarHBondContact NE1-ND2 3.22Å; W278-N282 VanDerWaalsContact NE1-ND2 3.13Å; W278-N282 WeakPolarHBondContact O-CB 3.11Å; W278-N282 PolarHBondContact O-N 3.48Å; W278-N282 PolarHBondContact O-ND2 3.23Å; V280-N282 PolarHBondContact O-N 3.1Å; N282-P285 WeakPolarHBondContact O-CG 3.46Å |
| 283 | L | 90.4 | Very high | 89.1 | Confident | 66 Ų | 66 | 38.1 Ų | 38.1 | 35% | 0.346 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -86.1 | -25.4 | -178.6 | -60 | -168.9 | 0 | 0 | 0 | 113.2 | V259 T279 L286 T287 | V259-L283 HydrophobicContact CG2-CB 4.02Å; T279-L283 HydrophobicContact CG2-CD1 3.75Å; T279-L283 HydrophobicContact CG2-CG 4.24Å; T279-L283 WeakPolarHBondContact O-CA 3.26Å; T279-L283 WeakPolarHBondContact O-CB 3.27Å; T279-L283 WeakPolarHBondContact O-CG 3.46Å; T279-L283 PolarHBondContact O-N 2.77Å; L283-L286 HydrophobicContact CD2-CD1 4.3Å; L283-L286 PolarHBondContact O-N 2.79Å; L283-T287 HydrophobicContact CB-CG2 4.35Å; L283-T287 WeakPolarHBondContact O-CB 3.34Å; L283-T287 VanDerWaalsContact O-CG2 3.27Å; L283-T287 WeakPolarHBondContact O-CG2 3.37Å; L283-T287 PolarHBondContact O-N 2.85Å; L283-T287 PolarHBondContact O-OG1 3.14Å |
| 284 | T | 90.4 | Very high | 89.6 | Confident | 39 Ų | 39 | 35.9 Ų | 35.9 | 24% | 0.239 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -52.2 | -52.8 | 176.9 | -66.6 | 0 | 0 | 0 | 0 | 112.9 | F256 V259 V280 L286 T287 L288 | F256-T284 HydrophobicContact CE2-CG2 4.29Å; V259-T284 VanDerWaalsContact CG1-OG1 3.26Å; V259-T284 WeakPolarHBondContact CG1-OG1 3.44Å; V280-T284 WeakPolarHBondContact O-CB 3.47Å; V280-T284 PolarHBondContact O-N 3.04Å; V280-T284 VanDerWaalsContact O-N 3.16Å; V280-T284 PolarHBondContact O-OG1 3.47Å; T284-L286 VanDerWaalsContact C-N 3.34Å; T284-L286 PolarHBondContact O-N 3.37Å; T284-T287 PolarHBondContact O-N 2.91Å; T284-T287 PolarHBondContact O-OG1 3.35Å; T284-T287 VanDerWaalsContact O-OG1 3.05Å; T284-L288 HydrophobicContact CG2-CD1 4.04Å; T284-L288 WeakPolarHBondContact O-CB 3.34Å; T284-L288 VanDerWaalsContact O-CG 3.31Å; T284-L288 WeakPolarHBondContact O-CG 3.47Å; T284-L288 PolarHBondContact O-N 3.06Å |
| 285 | P | 88.8 | Confident | 90 | Very high | 17 Ų | 17 | 34 Ų | 34 | 11% | 0.11 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -64.7 | -37 | 179.9 | 22.7 | -32.7 | 0 | 0 | 0 | 113.2 | I31 T281 N282 L288 C289 | I31-P285 HydrophobicContact CD1-CB 3.52Å; I31-P285 HydrophobicContact CD1-CG 4.32Å; I31-P285 HydrophobicContact CG1-CB 4.5Å; T281-P285 WeakPolarHBondContact O-CD 3.28Å; N282-P285 WeakPolarHBondContact O-CG 3.46Å; P285-L288 WeakPolarHBondContact O-CB 3.48Å; P285-L288 PolarHBondContact O-N 2.86Å; P285-C289 PolarHBondContact O-N 3.36Å; P285-C289 PolarHBondContact O-SG 3.27Å |
| 286 | L | 91.3 | Very high | 90.4 | Very high | 60 Ų | 60 | 28.9 Ų | 28.9 | 31% | 0.314 | 16% | 0.162 | S | C | . | . | H | α-helix | trans | -70.2 | -42.1 | 179.5 | -63.7 | 177.8 | 0 | 0 | 0 | 112.1 | M27 L283 T284 L288 C289 L290 | M27-L286 HydrophobicContact CE-CD1 4.25Å; M27-L286 HydrophobicContact CE-CD2 4.48Å; L283-L286 HydrophobicContact CD2-CD1 4.3Å; L283-L286 PolarHBondContact O-N 2.79Å; T284-L286 VanDerWaalsContact C-N 3.34Å; T284-L286 PolarHBondContact O-N 3.37Å; L286-L288 VanDerWaalsContact C-N 3.31Å; L286-C289 WeakPolarHBondContact O-CB 3.48Å; L286-C289 PolarHBondContact O-N 3.22Å; L286-L290 PolarHBondContact O-N 2.86Å; L286-L290 VanDerWaalsContact O-N 3.1Å |
| 287 | T | 94.2 | Very high | 90.5 | Very high | 14 Ų | 14 | 31.5 Ų | 31.5 | 9% | 0.086 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -69.7 | -30.3 | 175.6 | 56.9 | 0 | 0 | 0 | 0 | 111.7 | P255 V259 L283 T284 L290 G291 | P255-T287 HydrophobicContact CB-CG2 3.63Å; V259-T287 HydrophobicContact CG2-CG2 4.16Å; L283-T287 HydrophobicContact CB-CG2 4.35Å; L283-T287 WeakPolarHBondContact O-CB 3.34Å; L283-T287 VanDerWaalsContact O-CG2 3.27Å; L283-T287 WeakPolarHBondContact O-CG2 3.37Å; L283-T287 PolarHBondContact O-N 2.85Å; L283-T287 PolarHBondContact O-OG1 3.14Å; T284-T287 PolarHBondContact O-N 2.91Å; T284-T287 PolarHBondContact O-OG1 3.35Å; T284-T287 VanDerWaalsContact O-OG1 3.05Å; T287-L290 PolarHBondContact O-N 2.89Å; T287-G291 PolarHBondContact O-N 3.3Å |
| 288 | L | 92.8 | Very high | 90.5 | Very high | 25 Ų | 25 | 28.1 Ų | 28.1 | 13% | 0.131 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -63.7 | -44 | 167.4 | -80.8 | 171.6 | 0 | 0 | 0 | 112.1 | F256 T284 P285 L286 L290 G291 F292 | F256-L288 HydrophobicContact CD2-CD2 3.53Å; F256-L288 HydrophobicContact CD2-CG 3.59Å; F256-L288 HydrophobicContact CE1-CD2 4.44Å; F256-L288 HydrophobicContact CE2-CD1 4.2Å; F256-L288 HydrophobicContact CE2-CD2 3.33Å; F256-L288 HydrophobicContact CE2-CG 3.55Å; F256-L288 HydrophobicContact CG-CD2 4.18Å; F256-L288 HydrophobicContact CZ-CD2 3.84Å; T284-L288 HydrophobicContact CG2-CD1 4.04Å; T284-L288 WeakPolarHBondContact O-CB 3.34Å; T284-L288 VanDerWaalsContact O-CG 3.31Å; T284-L288 WeakPolarHBondContact O-CG 3.47Å; T284-L288 PolarHBondContact O-N 3.06Å; P285-L288 WeakPolarHBondContact O-CB 3.48Å; P285-L288 PolarHBondContact O-N 2.86Å; L286-L288 VanDerWaalsContact C-N 3.31Å; L288-L290 PolarHBondContact O-N 3.12Å; L288-G291 PolarHBondContact O-N 3.12Å; L288-G291 VanDerWaalsContact O-N 3.16Å; L288-F292 HydrophobicContact CB-CZ 4.36Å; L288-F292 HydrophobicContact CD2-CE1 4.05Å; L288-F292 HydrophobicContact CD2-CZ 4.05Å; L288-F292 WeakPolarHBondContact O-CB 3.48Å; L288-F292 WeakPolarHBondContact O-CD1 3.5Å; L288-F292 WeakPolarHBondContact O-CG 3.45Å; L288-F292 PolarHBondContact O-N 3.44Å |
| 289 | C | 94.3 | Very high | 90.1 | Very high | 4 Ų | 4 | 24.8 Ų | 24.8 | 3% | 0.027 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -55.7 | -42.8 | 173.6 | -69.2 | 0 | 0 | 0 | 0 | 111.8 | I34 Y35 I38 P285 L286 F292 S293 | I34-C289 HydrophobicContact CD1-CB 4.38Å; I34-C289 HydrophobicContact CG2-CB 3.85Å; Y35-C289 HydrophobicContact CE1-CB 4.32Å; Y35-C289 WeakPolarHBondContact CE1-SG 3.47Å; I38-C289 WeakPolarHBondContact CD1-O 3.41Å; P285-C289 PolarHBondContact O-N 3.36Å; P285-C289 PolarHBondContact O-SG 3.27Å; L286-C289 WeakPolarHBondContact O-CB 3.48Å; L286-C289 PolarHBondContact O-N 3.22Å; C289-F292 PolarHBondContact O-N 2.85Å; C289-S293 PolarHBondContact O-N 3.37Å; C289-S293 PolarHBondContact O-OG 2.98Å |
| 290 | L | 94.9 | Very high | 89.5 | Confident | 67 Ų | 67 | 27.2 Ų | 27.2 | 35% | 0.351 | 16% | 0.157 | S | C | . | . | H | α-helix | trans | -65.2 | -45.2 | 175.8 | -177.3 | 61.4 | 0 | 0 | 0 | 111.6 | C252 P255 L286 T287 L288 F292 S293 | C252-L290 WeakPolarHBondContact CB-O 3.32Å; C252-L290 CarbonylContact O-C 3.58Å; P255-L290 HydrophobicContact CB-CD2 4.38Å; P255-L290 HydrophobicContact CG-CD2 3.78Å; L286-L290 PolarHBondContact O-N 2.86Å; L286-L290 VanDerWaalsContact O-N 3.1Å; T287-L290 PolarHBondContact O-N 2.89Å; L288-L290 PolarHBondContact O-N 3.12Å; L290-F292 VanDerWaalsContact C-N 3.34Å; L290-F292 PolarHBondContact O-N 2.72Å; L290-S293 VanDerWaalsContact O-CB 3.28Å; L290-S293 WeakPolarHBondContact O-CB 3.49Å; L290-S293 PolarHBondContact O-N 3.24Å; L290-S293 VanDerWaalsContact O-N 3.12Å |
| 291 | G | 93.5 | Very high | 88.9 | Confident | 0 Ų | 0 | 27.9 Ų | 27.9 | 0% | 0 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -56.7 | -45.1 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | C252 W253 T287 L288 S293 N294 | C252-G291 WeakPolarHBondContact O-CA 3.28Å; C252-G291 PolarHBondContact O-N 3.02Å; W253-G291 PolarHBondContact NE1-O 3Å; T287-G291 PolarHBondContact O-N 3.3Å; L288-G291 PolarHBondContact O-N 3.12Å; L288-G291 VanDerWaalsContact O-N 3.16Å; G291-S293 VanDerWaalsContact C-N 3.27Å; G291-S293 PolarHBondContact O-N 2.82Å; G291-N294 WeakPolarHBondContact O-CB 3.44Å; G291-N294 PolarHBondContact O-N 3.49Å |
| 292 | F | 94.3 | Very high | 88.3 | Confident | 3 Ų | 3 | 24.4 Ų | 24.4 | 1% | 0.013 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -67.4 | -26.8 | 177.9 | -63.9 | -11.3 | 0 | 0 | 0 | 113.4 | Y35 I38 F78 L82 L109 W253 L288 C289 L290 N294 S295 | Y35-F292 HydrophobicContact CD1-CD2 4.17Å; Y35-F292 AromaticContact CE1-CD2 3.47Å; Y35-F292 HydrophobicContact CE1-CD2 3.47Å; Y35-F292 VanDerWaalsContact CE1-CD2 3.47Å; Y35-F292 AromaticContact CE1-CE2 3.82Å; Y35-F292 HydrophobicContact CE1-CE2 3.82Å; Y35-F292 HydrophobicContact CE2-CE2 4.3Å; Y35-F292 AromaticContact CZ-CD2 3.74Å; Y35-F292 AromaticContact CZ-CE2 3.56Å; Y35-F292 WeakPolarHBondContact OH-CE2 3.38Å; I38-F292 HydrophobicContact CD1-CB 4.07Å; F78-F292 HydrophobicContact CE1-CB 4.09Å; F78-F292 HydrophobicContact CE1-CD1 4.31Å; F78-F292 HydrophobicContact CE1-CG 4.21Å; F78-F292 HydrophobicContact CE2-CD1 4.02Å; F78-F292 HydrophobicContact CE2-CD2 4.32Å; F78-F292 HydrophobicContact CE2-CE1 4.06Å; F78-F292 HydrophobicContact CE2-CE2 4.35Å; F78-F292 HydrophobicContact CE2-CG 4.19Å; F78-F292 HydrophobicContact CE2-CZ 4.25Å; F78-F292 HydrophobicContact CZ-CB 3.72Å; F78-F292 AromaticContact CZ-CD1 3.5Å; F78-F292 HydrophobicContact CZ-CD1 3.5Å; F78-F292 AromaticContact CZ-CD2 3.76Å; F78-F292 HydrophobicContact CZ-CD2 3.76Å; F78-F292 HydrophobicContact CZ-CE1 4.02Å; F78-F292 HydrophobicContact CZ-CE2 4.23Å; F78-F292 AromaticContact CZ-CG 3.39Å; F78-F292 HydrophobicContact CZ-CG 3.39Å; F78-F292 HydrophobicContact CZ-CZ 4.38Å; L82-F292 HydrophobicContact CD2-CD2 3.83Å; L82-F292 HydrophobicContact CD2-CE2 4.21Å; L109-F292 HydrophobicContact CD1-CE1 4.08Å; L109-F292 HydrophobicContact CD1-CE2 4.42Å; L109-F292 HydrophobicContact CD1-CZ 3.5Å; L109-F292 VanDerWaalsContact CD1-CZ 3.5Å; L109-F292 HydrophobicContact CD2-CE1 4.19Å; L109-F292 HydrophobicContact CD2-CZ 4.37Å; L109-F292 HydrophobicContact CG-CE1 3.88Å; L109-F292 HydrophobicContact CG-CZ 3.83Å; W253-F292 HydrophobicContact CH2-CD1 4.19Å; W253-F292 HydrophobicContact CH2-CE1 4.28Å; L288-F292 HydrophobicContact CB-CZ 4.36Å; L288-F292 HydrophobicContact CD2-CE1 4.05Å; L288-F292 HydrophobicContact CD2-CZ 4.05Å; L288-F292 WeakPolarHBondContact O-CB 3.48Å; L288-F292 WeakPolarHBondContact O-CD1 3.5Å; L288-F292 WeakPolarHBondContact O-CG 3.45Å; L288-F292 PolarHBondContact O-N 3.44Å; C289-F292 PolarHBondContact O-N 2.85Å; L290-F292 VanDerWaalsContact C-N 3.34Å; L290-F292 PolarHBondContact O-N 2.72Å; F292-N294 PolarHBondContact O-N 3.04Å; F292-S295 PolarHBondContact O-N 3.39Å |
| 293 | S | 94.3 | Very high | 87.2 | Confident | 27 Ų | 27 | 25.4 Ų | 25.4 | 19% | 0.189 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -61.8 | -23.8 | 175.4 | -59.1 | 0 | 0 | 0 | 0 | 111.9 | I38 C289 L290 G291 S295 A296 I297 | I38-S293 WeakPolarHBondContact CD1-OG 3.39Å; C289-S293 PolarHBondContact O-N 3.37Å; C289-S293 PolarHBondContact O-OG 2.98Å; L290-S293 VanDerWaalsContact O-CB 3.28Å; L290-S293 WeakPolarHBondContact O-CB 3.49Å; L290-S293 PolarHBondContact O-N 3.24Å; L290-S293 VanDerWaalsContact O-N 3.12Å; G291-S293 VanDerWaalsContact C-N 3.27Å; G291-S293 PolarHBondContact O-N 2.82Å; S293-S295 VanDerWaalsContact C-N 3.26Å; S293-S295 PolarHBondContact O-N 3.4Å; S293-A296 PolarHBondContact O-N 2.72Å; S293-I297 VanDerWaalsContact O-CG1 3.3Å; S293-I297 WeakPolarHBondContact O-CG1 2.99Å; S293-I297 PolarHBondContact O-N 3.31Å |
| 294 | N | 92.7 | Very high | 85.7 | Confident | 0 Ų | 0 | 30.5 Ų | 30.5 | 0% | 0 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -51 | -44.5 | 174.1 | -176.7 | 68.7 | 0 | 0 | 0 | 112.5 | F249 C252 G291 F292 A296 I297 N298 | F249-N294 VanDerWaalsContact CA-OD1 3.28Å; F249-N294 WeakPolarHBondContact CA-OD1 3.41Å; F249-N294 PolarHBondContact N-OD1 3.49Å; C252-N294 HydrophobicContact CB-CB 3.89Å; G291-N294 WeakPolarHBondContact O-CB 3.44Å; G291-N294 PolarHBondContact O-N 3.49Å; F292-N294 PolarHBondContact O-N 3.04Å; N294-A296 PolarHBondContact O-N 2.91Å; N294-I297 PolarHBondContact O-N 3.36Å; N294-I297 VanDerWaalsContact O-N 3.16Å; N294-N298 VanDerWaalsContact O-CG 3.27Å; N294-N298 PolarHBondContact O-N 3.47Å; N294-N298 VanDerWaalsContact O-N 3.09Å; N294-N298 PolarHBondContact O-ND2 3.17Å; N294-N298 PolarHBondContact O-OD1 2.92Å |
| 295 | S | 92.4 | Very high | 84 | Confident | 0 Ų | 0 | 30.8 Ų | 30.8 | 0% | 0 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -64.3 | -28.1 | 179.3 | -62.5 | 0 | 0 | 0 | 0 | 112.8 | N46 D75 F292 S293 | N46-S295 PolarHBondContact ND2-O 3.49Å; D75-S295 WeakPolarHBondContact OD1-CB 3.12Å; D75-S295 PolarHBondContact OD1-OG 3.42Å; F292-S295 PolarHBondContact O-N 3.39Å; S293-S295 VanDerWaalsContact C-N 3.26Å; S293-S295 PolarHBondContact O-N 3.4Å |
| 296 | A | 91.6 | Very high | 82.4 | Confident | 14 Ų | 14 | 30.5 Ų | 30.5 | 12% | 0.116 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -85.3 | -26 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | I38 L41 S293 N294 | I38-A296 HydrophobicContact CG2-CB 4.17Å; L41-A296 HydrophobicContact CB-CB 4.42Å; S293-A296 PolarHBondContact O-N 2.72Å; N294-A296 PolarHBondContact O-N 2.91Å |
| 297 | I | 88.6 | Confident | 80.6 | Confident | 56 Ų | 56 | 31.5 Ų | 31.5 | 29% | 0.287 | 17% | 0.173 | S | C | . | . | H | α-helix | trans | -77.7 | -34 | -180 | -68.3 | 162.7 | 0 | 0 | 0 | 111.5 | A248 S293 N294 V300 L301 | A248-I297 HydrophobicContact CB-CG2 3.9Å; S293-I297 VanDerWaalsContact O-CG1 3.3Å; S293-I297 WeakPolarHBondContact O-CG1 2.99Å; S293-I297 PolarHBondContact O-N 3.31Å; N294-I297 PolarHBondContact O-N 3.36Å; N294-I297 VanDerWaalsContact O-N 3.16Å; I297-V300 WeakPolarHBondContact O-CB 3.38Å; I297-V300 PolarHBondContact O-N 3.06Å; I297-L301 HydrophobicContact CG2-CD1 3.62Å; I297-L301 HydrophobicContact CG2-CD2 4.37Å; I297-L301 HydrophobicContact CG2-CG 3.79Å; I297-L301 WeakPolarHBondContact O-CG 3.28Å; I297-L301 PolarHBondContact O-N 3.48Å |
| 298 | N | 84.9 | Confident | 78.7 | Confident | 0 Ų | 0 | 36 Ų | 36 | 0% | 0 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -48.7 | -52.1 | -177.4 | -74.5 | -21.4 | 0 | 0 | 0 | 113.8 | D75 N294 V300 L301 Y302 | D75-N298 PolarHBondContact OD2-ND2 2.89Å; N294-N298 VanDerWaalsContact O-CG 3.27Å; N294-N298 PolarHBondContact O-N 3.47Å; N294-N298 VanDerWaalsContact O-N 3.09Å; N294-N298 PolarHBondContact O-ND2 3.17Å; N294-N298 PolarHBondContact O-OD1 2.92Å; N298-V300 PolarHBondContact O-N 3.06Å; N298-L301 PolarHBondContact O-N 3.22Å; N298-Y302 HydrophobicContact CB-CE2 4.06Å; N298-Y302 WeakPolarHBondContact O-CD1 3.43Å; N298-Y302 VanDerWaalsContact O-CD2 3.28Å; N298-Y302 WeakPolarHBondContact O-CD2 3.42Å; N298-Y302 WeakPolarHBondContact O-CE2 3.48Å; N298-Y302 VanDerWaalsContact O-CG 3.24Å; N298-Y302 PolarHBondContact O-N 3.3Å; N298-Y302 VanDerWaalsContact O-N 3.08Å |
| 299 | P | 76.8 | Confident | 76.9 | Confident | 7 Ų | 7 | 35.6 Ų | 35.6 | 5% | 0.045 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -62.6 | -35.6 | 177.5 | -24.2 | 35.4 | 0 | 0 | 0 | 114.8 | G45 N46 L301 Y302 C303 | G45-P299 VanDerWaalsContact C-CB 3.45Å; N46-P299 HydrophobicContact CB-CG 4.31Å; P299-L301 VanDerWaalsContact C-N 3.32Å; P299-Y302 PolarHBondContact O-N 2.75Å; P299-C303 WeakPolarHBondContact O-CB 3.41Å; P299-C303 PolarHBondContact O-N 3.5Å; P299-C303 PolarHBondContact O-SG 2.94Å; P299-C303 VanDerWaalsContact O-SG 3.36Å |
| 300 | V | 74.8 | Confident | 75.2 | Confident | 75 Ų | 75 | 43.6 Ų | 43.6 | 46% | 0.455 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -61.2 | -46.2 | 175.9 | 176.6 | 0 | 0 | 0 | 0 | 108.8 | I297 N298 Y302 C303 F304 | I297-V300 WeakPolarHBondContact O-CB 3.38Å; I297-V300 PolarHBondContact O-N 3.06Å; N298-V300 PolarHBondContact O-N 3.06Å; V300-Y302 VanDerWaalsContact C-N 3.33Å; V300-Y302 PolarHBondContact O-N 3.34Å; V300-C303 PolarHBondContact O-N 2.87Å; V300-F304 HydrophobicContact CB-CD2 4.38Å; V300-F304 HydrophobicContact CG1-CD2 3.46Å; V300-F304 VanDerWaalsContact CG1-CD2 3.46Å; V300-F304 HydrophobicContact CG1-CE2 3.78Å; V300-F304 WeakPolarHBondContact O-CB 3.43Å; V300-F304 VanDerWaalsContact O-CD2 3.24Å; V300-F304 WeakPolarHBondContact O-CD2 3.49Å; V300-F304 PolarHBondContact O-N 3.28Å |
| 301 | L | 75.6 | Confident | 73.5 | Confident | 29 Ų | 29 | 43 Ų | 43 | 15% | 0.152 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -65.1 | -36 | 178.7 | -60 | 173.8 | 0 | 0 | 0 | 112.4 | A244 V245 A248 I297 N298 P299 V305 | A244-L301 HydrophobicContact CB-CD2 4.14Å; V245-L301 HydrophobicContact CB-CD1 4.41Å; V245-L301 HydrophobicContact CG2-CB 3.97Å; V245-L301 HydrophobicContact CG2-CD1 3.95Å; A248-L301 HydrophobicContact CB-CD1 3.55Å; I297-L301 HydrophobicContact CG2-CD1 3.62Å; I297-L301 HydrophobicContact CG2-CD2 4.37Å; I297-L301 HydrophobicContact CG2-CG 3.79Å; I297-L301 WeakPolarHBondContact O-CG 3.28Å; I297-L301 PolarHBondContact O-N 3.48Å; N298-L301 PolarHBondContact O-N 3.22Å; P299-L301 VanDerWaalsContact C-N 3.32Å; L301-V305 HydrophobicContact CD2-CG2 4.45Å; L301-V305 WeakPolarHBondContact O-CB 3.33Å; L301-V305 WeakPolarHBondContact O-CG2 3.38Å; L301-V305 PolarHBondContact O-N 3.26Å |
| 302 | Y | 71.1 | Confident | 71.9 | Confident | 2 Ų | 2 | 46.1 Ų | 46.1 | 1% | 0.008 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -63.8 | -42.6 | 174 | -54.2 | -31.8 | 0 | 0 | 0 | 112.2 | A49 M68 L71 T241 V245 N298 P299 V300 G306 | A49-Y302 HydrophobicContact CB-CD2 4.44Å; M68-Y302 HydrophobicContact CE-CD1 3.62Å; M68-Y302 HydrophobicContact CE-CE1 3.69Å; M68-Y302 HydrophobicContact CE-CG 4.2Å; M68-Y302 HydrophobicContact CG-CD2 4.3Å; M68-Y302 HydrophobicContact CG-CE1 4.11Å; M68-Y302 HydrophobicContact CG-CE2 3.86Å; M68-Y302 HydrophobicContact SD-CD1 3.97Å; M68-Y302 HydrophobicContact SD-CD2 4.05Å; M68-Y302 HydrophobicContact SD-CE1 4.11Å; M68-Y302 HydrophobicContact SD-CE2 4.2Å; M68-Y302 HydrophobicContact SD-CG 3.97Å; L71-Y302 WeakPolarHBondContact CD2-OH 3.38Å; T241-Y302 HydrophobicContact CG2-CD1 4.09Å; V245-Y302 HydrophobicContact CG2-CD1 4.24Å; V245-Y302 HydrophobicContact CG2-CE1 3.68Å; N298-Y302 HydrophobicContact CB-CE2 4.06Å; N298-Y302 WeakPolarHBondContact O-CD1 3.43Å; N298-Y302 VanDerWaalsContact O-CD2 3.28Å; N298-Y302 WeakPolarHBondContact O-CD2 3.42Å; N298-Y302 WeakPolarHBondContact O-CE2 3.48Å; N298-Y302 VanDerWaalsContact O-CG 3.24Å; N298-Y302 PolarHBondContact O-N 3.3Å; N298-Y302 VanDerWaalsContact O-N 3.08Å; P299-Y302 PolarHBondContact O-N 2.75Å; V300-Y302 VanDerWaalsContact C-N 3.33Å; V300-Y302 PolarHBondContact O-N 3.34Å; Y302-G306 WeakPolarHBondContact O-CA 3.33Å; Y302-G306 PolarHBondContact O-N 2.95Å |
| 303 | C | 64.1 | Low | 70.3 | Confident | 28 Ų | 28 | 48.6 Ų | 48.6 | 19% | 0.189 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -74.9 | -41.3 | -177.6 | -71.9 | 0 | 0 | 0 | 0 | 113.7 | P299 V300 | P299-C303 WeakPolarHBondContact O-CB 3.41Å; P299-C303 PolarHBondContact O-N 3.5Å; P299-C303 PolarHBondContact O-SG 2.94Å; P299-C303 VanDerWaalsContact O-SG 3.36Å; V300-C303 PolarHBondContact O-N 2.87Å |
| 304 | F | 57.9 | Low | 68.7 | Low | 173 Ų | 173 | 48.9 Ų | 48.9 | 76% | 0.759 | 26% | 0.261 | S | S | * | . | H | α-helix | trans | -88.8 | -28.9 | -174.5 | -74.5 | -77.7 | 0 | 0 | 0 | 113.5 | V300 | V300-F304 HydrophobicContact CB-CD2 4.38Å; V300-F304 HydrophobicContact CG1-CD2 3.46Å; V300-F304 VanDerWaalsContact CG1-CD2 3.46Å; V300-F304 HydrophobicContact CG1-CE2 3.78Å; V300-F304 WeakPolarHBondContact O-CB 3.43Å; V300-F304 VanDerWaalsContact O-CD2 3.24Å; V300-F304 WeakPolarHBondContact O-CD2 3.49Å; V300-F304 PolarHBondContact O-N 3.28Å |
| 305 | V | 54.5 | Low | 67.2 | Low | 46 Ų | 46 | 50.2 Ų | 50.2 | 28% | 0.279 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -98.6 | -21.2 | -178.2 | -166.1 | 0 | 0 | 0 | 0 | 111.9 | W240 T241 A244 L301 | W240-V305 VanDerWaalsContact C-CG1 3.49Å; W240-V305 HydrophobicContact CB-CG1 3.84Å; T241-V305 HydrophobicContact CG2-CB 4.35Å; T241-V305 PolarHBondContact OG1-O 3.2Å; A244-V305 HydrophobicContact CB-CG2 4.11Å; L301-V305 HydrophobicContact CD2-CG2 4.45Å; L301-V305 WeakPolarHBondContact O-CB 3.33Å; L301-V305 WeakPolarHBondContact O-CG2 3.38Å; L301-V305 PolarHBondContact O-N 3.26Å |
| 306 | G | 56.2 | Low | 65.8 | Low | 11 Ų | 11 | 52.5 Ų | 52.5 | 11% | 0.113 | 29% | 0.287 | C | S | . | . | trans | -102.1 | 103 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | Y302 H308 F309 R310 | Y302-G306 WeakPolarHBondContact O-CA 3.33Å; Y302-G306 PolarHBondContact O-N 2.95Å; G306-H308 PolarHBondContact O-N 2.95Å; G306-H308 VanDerWaalsContact O-N 3.09Å; G306-F309 PolarHBondContact O-N 2.96Å; G306-R310 PolarHBondContact O-N 2.9Å | ||
| 307 | N | 53.4 | Low | 64.5 | Low | 80 Ų | 80 | 55.3 Ų | 55.3 | 43% | 0.428 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -58.3 | -25.4 | 175.4 | -80.9 | -19.1 | 0 | 0 | 0 | 113.7 | Q237 R310 G311 | Q237-N307 PolarHBondContact NE2-ND2 3.36Å; N307-R310 PolarHBondContact O-N 3.37Å; N307-G311 PolarHBondContact O-N 3.17Å; N307-G311 VanDerWaalsContact O-N 3.08Å |
| 308 | H | 54.1 | Low | 63.4 | Low | 110 Ų | 110 | 60.2 Ų | 60.2 | 51% | 0.509 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -66.2 | -37.6 | 176.4 | -176.6 | -91.4 | 0 | 0 | 0 | 112.6 | G306 R312 | G306-H308 PolarHBondContact O-N 2.95Å; G306-H308 VanDerWaalsContact O-N 3.09Å; H308-R312 PolarHBondContact O-N 2.86Å |
| 309 | F | 54.2 | Low | 62.5 | Low | 16 Ų | 16 | 65.1 Ų | 65.1 | 7% | 0.07 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -71.1 | -40.4 | 174.4 | -109 | -90.2 | 0 | 0 | 0 | 111 | A49 V52 L53 M68 G306 G311 R312 L313 | A49-F309 HydrophobicContact CB-CE1 4.5Å; A49-F309 HydrophobicContact CB-CZ 4.47Å; V52-F309 HydrophobicContact CB-CD1 4.41Å; V52-F309 HydrophobicContact CB-CE1 3.65Å; V52-F309 HydrophobicContact CB-CZ 4.13Å; V52-F309 HydrophobicContact CG1-CD1 3.96Å; V52-F309 HydrophobicContact CG1-CE1 3.51Å; V52-F309 HydrophobicContact CG1-CZ 3.88Å; V52-F309 HydrophobicContact CG2-CE1 4.14Å; L53-F309 HydrophobicContact CD1-CZ 4.38Å; L53-F309 HydrophobicContact CD2-CE2 3.91Å; L53-F309 HydrophobicContact CD2-CZ 3.96Å; L53-F309 HydrophobicContact CG-CE2 4.34Å; L53-F309 HydrophobicContact CG-CZ 3.88Å; M68-F309 HydrophobicContact SD-CE2 4.02Å; G306-F309 PolarHBondContact O-N 2.96Å; F309-G311 VanDerWaalsContact C-N 3.34Å; F309-G311 PolarHBondContact O-N 3.4Å; F309-R312 PolarHBondContact O-N 3.06Å; F309-L313 VanDerWaalsContact O-CB 3.27Å; F309-L313 WeakPolarHBondContact O-CB 3.33Å; F309-L313 PolarHBondContact O-N 3.43Å |
| 310 | R | 58.5 | Low | 61.8 | Low | 172 Ų | 172 | 70 Ų | 70 | 65% | 0.649 | 38% | 0.376 | S | S | * | . | H | α-helix | trans | -60.1 | -41.1 | 178.1 | -155.8 | 175.8 | 86.7 | 171.3 | 6.8 | 112.9 | G306 N307 G314 | G306-R310 PolarHBondContact O-N 2.9Å; N307-R310 PolarHBondContact O-N 3.37Å; R310-G314 PolarHBondContact O-N 3Å |
| 311 | G | 59.1 | Low | 61.4 | Low | 54 Ų | 54 | 69.4 Ų | 69.4 | 56% | 0.557 | 37% | 0.374 | S | S | * | . | H | α-helix | trans | -63.7 | -43 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | N307 F309 G315 | N307-G311 PolarHBondContact O-N 3.17Å; N307-G311 VanDerWaalsContact O-N 3.08Å; F309-G311 VanDerWaalsContact C-N 3.34Å; F309-G311 PolarHBondContact O-N 3.4Å; G311-G315 PolarHBondContact O-N 3.4Å |
| 312 | R | 61.5 | Low | 60.9 | Low | 65 Ų | 65 | 70.5 Ų | 70.5 | 25% | 0.245 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -75.9 | -36.6 | -179.9 | -64.4 | -175 | 74.9 | -150.2 | -6.6 | 112.8 | V52 H308 F309 G315 L316 | V52-R312 HydrophobicContact CG1-CB 4.45Å; V52-R312 PolarHBondContact O-NH1 3.5Å; V52-R312 PolarHBondContact O-NH2 2.9Å; H308-R312 PolarHBondContact O-N 2.86Å; F309-R312 PolarHBondContact O-N 3.06Å; R312-G315 PolarHBondContact O-N 2.65Å; R312-L316 WeakPolarHBondContact O-CB 3.49Å; R312-L316 PolarHBondContact O-N 3.02Å |
| 313 | L | 59.3 | Low | 60.4 | Low | 56 Ų | 56 | 74.4 Ų | 74.4 | 29% | 0.293 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -66.8 | -39.4 | 173.1 | -170.1 | 67.5 | 0 | 0 | 0 | 111.1 | L48 F309 G315 L316 C317 | L48-L313 HydrophobicContact CD1-CD1 4.01Å; L48-L313 HydrophobicContact CD2-CD1 3.7Å; L48-L313 HydrophobicContact CG-CD1 4.26Å; F309-L313 VanDerWaalsContact O-CB 3.27Å; F309-L313 WeakPolarHBondContact O-CB 3.33Å; F309-L313 PolarHBondContact O-N 3.43Å; L313-G315 VanDerWaalsContact C-N 3.33Å; L313-L316 PolarHBondContact O-N 3.35Å; L313-C317 WeakPolarHBondContact O-CB 3.16Å; L313-C317 PolarHBondContact O-N 3.48Å |
| 314 | G | 60.9 | Low | 60.4 | Low | 32 Ų | 32 | 78.2 Ų | 78.2 | 33% | 0.33 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -62.5 | -38.9 | 172 | 0 | 0 | 0 | 0 | 0 | 112.6 | R310 K318 | R310-G314 PolarHBondContact O-N 3Å; G314-K318 WeakPolarHBondContact O-CB 3.49Å; G314-K318 VanDerWaalsContact O-CG 3.26Å; G314-K318 WeakPolarHBondContact O-CG 3.18Å; G314-K318 PolarHBondContact O-N 2.95Å |
| 315 | G | 61.6 | Low | 60.8 | Low | 28 Ų | 28 | 76.2 Ų | 76.2 | 29% | 0.289 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -61.9 | -53 | 170.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | G311 R312 L313 C317 K318 D319 | G311-G315 PolarHBondContact O-N 3.4Å; R312-G315 PolarHBondContact O-N 2.65Å; L313-G315 VanDerWaalsContact C-N 3.33Å; G315-C317 VanDerWaalsContact C-N 3.33Å; G315-C317 PolarHBondContact O-N 3.45Å; G315-K318 CarbonylContact O-C 3.56Å; G315-K318 WeakPolarHBondContact O-CB 3.5Å; G315-K318 PolarHBondContact O-N 2.9Å; G315-K318 VanDerWaalsContact O-N 3.11Å; G315-D319 PolarHBondContact O-N 3.46Å |
| 316 | L | 62.3 | Low | 61.3 | Low | 48 Ų | 48 | 76.5 Ų | 76.5 | 25% | 0.251 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -59 | -40.2 | 176.9 | -96.9 | 153.4 | 0 | 0 | 0 | 113.3 | Y51 V52 R312 L313 D319 L320 | Y51-L316 HydrophobicContact CD1-CD1 4.25Å; Y51-L316 HydrophobicContact CE1-CD1 3.82Å; Y51-L316 HydrophobicContact CE1-CD2 3.69Å; Y51-L316 HydrophobicContact CE1-CG 4.4Å; V52-L316 HydrophobicContact CG2-CD1 3.97Å; R312-L316 WeakPolarHBondContact O-CB 3.49Å; R312-L316 PolarHBondContact O-N 3.02Å; L313-L316 PolarHBondContact O-N 3.35Å; L316-D319 PolarHBondContact O-N 2.86Å; L316-L320 WeakPolarHBondContact O-CB 3.31Å; L316-L320 PolarHBondContact O-N 3.35Å |
| 317 | C | 64.4 | Low | 61.4 | Low | 74 Ų | 74 | 85.2 Ų | 85.2 | 50% | 0.5 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -68.2 | -38 | 177.6 | -159 | 0 | 0 | 0 | 0 | 110.7 | L313 G315 C321 | L313-C317 WeakPolarHBondContact O-CB 3.16Å; L313-C317 PolarHBondContact O-N 3.48Å; G315-C317 VanDerWaalsContact C-N 3.33Å; G315-C317 PolarHBondContact O-N 3.45Å; C317-C321 VanDerWaalsContact O-CB 3.26Å; C317-C321 WeakPolarHBondContact O-CB 3.4Å; C317-C321 PolarHBondContact O-N 2.85Å; C317-C321 PolarHBondContact O-SG 3.33Å; C317-C321 VanDerWaalsContact O-SG 3.33Å |
| 318 | K | 66.9 | Low | 61.9 | Low | 159 Ų | 159 | 84.1 Ų | 84.1 | 69% | 0.691 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -65.4 | -43.3 | 171.5 | -77.2 | 178.1 | 178.7 | -172 | 0 | 112.2 | G314 G315 L320 C321 A322 | G314-K318 WeakPolarHBondContact O-CB 3.49Å; G314-K318 VanDerWaalsContact O-CG 3.26Å; G314-K318 WeakPolarHBondContact O-CG 3.18Å; G314-K318 PolarHBondContact O-N 2.95Å; G315-K318 CarbonylContact O-C 3.56Å; G315-K318 WeakPolarHBondContact O-CB 3.5Å; G315-K318 PolarHBondContact O-N 2.9Å; G315-K318 VanDerWaalsContact O-N 3.11Å; K318-L320 VanDerWaalsContact C-N 3.35Å; K318-C321 PolarHBondContact O-N 3.22Å; K318-A322 VanDerWaalsContact O-CB 3.26Å; K318-A322 WeakPolarHBondContact O-CB 3.48Å; K318-A322 PolarHBondContact O-N 3.13Å |
| 319 | D | 64.8 | Low | 62.3 | Low | 103 Ų | 103 | 84.2 Ų | 84.2 | 55% | 0.551 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -67.3 | -38 | 178.8 | -64.1 | -22.5 | 0 | 0 | 0 | 111.2 | G315 L316 A322 C323 | G315-D319 PolarHBondContact O-N 3.46Å; L316-D319 PolarHBondContact O-N 2.86Å; D319-A322 PolarHBondContact O-N 3.43Å; D319-C323 WeakPolarHBondContact O-CB 3.49Å; D319-C323 PolarHBondContact O-N 2.91Å; D319-C323 PolarHBondContact O-SG 3.28Å |
| 320 | L | 63.5 | Low | 62.6 | Low | 109 Ų | 109 | 89.4 Ų | 89.4 | 57% | 0.571 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -70 | -43.2 | 175.5 | -157.6 | 82 | 0 | 0 | 0 | 111.1 | L316 K318 C323 L324 | L316-L320 WeakPolarHBondContact O-CB 3.31Å; L316-L320 PolarHBondContact O-N 3.35Å; K318-L320 VanDerWaalsContact C-N 3.35Å; L320-C323 PolarHBondContact O-N 3.2Å; L320-L324 HydrophobicContact CG-CD1 4.44Å; L320-L324 WeakPolarHBondContact O-CB 3.47Å; L320-L324 VanDerWaalsContact O-CG 3.22Å; L320-L324 WeakPolarHBondContact O-CG 3.29Å; L320-L324 PolarHBondContact O-N 3.43Å |
| 321 | C | 64.8 | Low | 62.4 | Low | 62 Ų | 62 | 87.7 Ų | 87.7 | 42% | 0.419 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -59.7 | -46.2 | 171.7 | -79.9 | 0 | 0 | 0 | 0 | 111.1 | C317 K318 C323 L324 E325 | C317-C321 VanDerWaalsContact O-CB 3.26Å; C317-C321 WeakPolarHBondContact O-CB 3.4Å; C317-C321 PolarHBondContact O-N 2.85Å; C317-C321 PolarHBondContact O-SG 3.33Å; C317-C321 VanDerWaalsContact O-SG 3.33Å; K318-C321 PolarHBondContact O-N 3.22Å; C321-C323 VanDerWaalsContact C-N 3.33Å; C321-C323 PolarHBondContact O-N 3.4Å; C321-L324 PolarHBondContact O-N 3.29Å; C321-E325 WeakPolarHBondContact O-CB 3.45Å; C321-E325 WeakPolarHBondContact O-CG 3.49Å; C321-E325 PolarHBondContact O-N 2.89Å |
| 322 | A | 65.5 | Low | 62.5 | Low | 52 Ų | 52 | 89.1 Ų | 89.1 | 43% | 0.43 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -62.4 | -38.3 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | K318 D319 A326 | K318-A322 VanDerWaalsContact O-CB 3.26Å; K318-A322 WeakPolarHBondContact O-CB 3.48Å; K318-A322 PolarHBondContact O-N 3.13Å; D319-A322 PolarHBondContact O-N 3.43Å; A322-A326 VanDerWaalsContact O-CB 3.25Å; A322-A326 WeakPolarHBondContact O-CB 3.21Å; A322-A326 PolarHBondContact O-N 3.14Å |
| 323 | C | 61.1 | Low | 62.4 | Low | 85 Ų | 85 | 93.1 Ų | 93.1 | 57% | 0.574 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -68.4 | -37.7 | 174 | -74.3 | 0 | 0 | 0 | 0 | 112.7 | D319 L320 C321 R327 | D319-C323 WeakPolarHBondContact O-CB 3.49Å; D319-C323 PolarHBondContact O-N 2.91Å; D319-C323 PolarHBondContact O-SG 3.28Å; L320-C323 PolarHBondContact O-N 3.2Å; C321-C323 VanDerWaalsContact C-N 3.33Å; C321-C323 PolarHBondContact O-N 3.4Å; C323-R327 VanDerWaalsContact O-CB 3.26Å; C323-R327 WeakPolarHBondContact O-CB 3.3Å; C323-R327 PolarHBondContact O-N 3.29Å |
| 324 | L | 63.7 | Low | 62.3 | Low | 107 Ų | 107 | 97.7 Ų | 97.7 | 56% | 0.56 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -69.8 | -40.9 | 176.9 | -73 | 171 | 0 | 0 | 0 | 111.2 | L320 C321 R327 A328 | L320-L324 HydrophobicContact CG-CD1 4.44Å; L320-L324 WeakPolarHBondContact O-CB 3.47Å; L320-L324 VanDerWaalsContact O-CG 3.22Å; L320-L324 WeakPolarHBondContact O-CG 3.29Å; L320-L324 PolarHBondContact O-N 3.43Å; C321-L324 PolarHBondContact O-N 3.29Å; L324-R327 PolarHBondContact O-N 2.93Å; L324-A328 WeakPolarHBondContact O-CB 3.44Å; L324-A328 PolarHBondContact O-N 3.14Å |
| 325 | E | 66.6 | Low | 62.1 | Low | 131 Ų | 131 | 105.5 Ų | 105.5 | 61% | 0.612 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -61.8 | -49.6 | 171.9 | -75.8 | 175.3 | 176.1 | 0 | 0 | 110.8 | C321 R327 A328 D329 | C321-E325 WeakPolarHBondContact O-CB 3.45Å; C321-E325 WeakPolarHBondContact O-CG 3.49Å; C321-E325 PolarHBondContact O-N 2.89Å; E325-R327 VanDerWaalsContact C-N 3.27Å; E325-R327 PolarHBondContact O-N 2.92Å; E325-A328 WeakPolarHBondContact O-CB 3.36Å; E325-A328 PolarHBondContact O-N 3.22Å; E325-A328 VanDerWaalsContact O-N 3.12Å; E325-D329 PolarHBondContact O-N 3.34Å |
| 326 | A | 63.9 | Low | 61.9 | Low | 53 Ų | 53 | 105.9 Ų | 105.9 | 44% | 0.438 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -59.8 | -36 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | A322 Q330 | A322-A326 VanDerWaalsContact O-CB 3.25Å; A322-A326 WeakPolarHBondContact O-CB 3.21Å; A322-A326 PolarHBondContact O-N 3.14Å; A326-Q330 WeakPolarHBondContact O-CG 3.23Å; A326-Q330 PolarHBondContact O-N 3.33Å |
| 327 | R | 59.5 | Low | 61.7 | Low | 193 Ų | 193 | 106.3 Ų | 106.3 | 73% | 0.728 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -74.9 | -34.6 | 177 | -164.9 | 172 | -175.3 | 171 | 0.9 | 112.1 | C323 L324 E325 H331 | C323-R327 VanDerWaalsContact O-CB 3.26Å; C323-R327 WeakPolarHBondContact O-CB 3.3Å; C323-R327 PolarHBondContact O-N 3.29Å; L324-R327 PolarHBondContact O-N 2.93Å; E325-R327 VanDerWaalsContact C-N 3.27Å; E325-R327 PolarHBondContact O-N 2.92Å; R327-H331 WeakPolarHBondContact O-CB 3.39Å; R327-H331 PolarHBondContact O-N 3.35Å; R327-H331 VanDerWaalsContact O-N 3.12Å |
| 328 | A | 62.8 | Low | 61.3 | Low | 58 Ų | 58 | 109.4 Ų | 109.4 | 48% | 0.479 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -66.4 | -42.2 | 172.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | L324 E325 H331 S332 | L324-A328 WeakPolarHBondContact O-CB 3.44Å; L324-A328 PolarHBondContact O-N 3.14Å; E325-A328 WeakPolarHBondContact O-CB 3.36Å; E325-A328 PolarHBondContact O-N 3.22Å; E325-A328 VanDerWaalsContact O-N 3.12Å; A328-H331 PolarHBondContact O-N 3.36Å; A328-S332 WeakPolarHBondContact O-CB 3.42Å; A328-S332 PolarHBondContact O-N 3.27Å |
| 329 | D | 63.8 | Low | 60.8 | Low | 111 Ų | 111 | 105.5 Ų | 105.5 | 59% | 0.594 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -64.3 | -43.6 | 176.1 | -77.8 | -17.9 | 0 | 0 | 0 | 112 | E325 H331 S332 Q333 | E325-D329 PolarHBondContact O-N 3.34Å; D329-H331 VanDerWaalsContact C-N 3.29Å; D329-H331 PolarHBondContact O-N 3.36Å; D329-S332 PolarHBondContact O-N 2.71Å; D329-Q333 WeakPolarHBondContact O-CB 3.41Å; D329-Q333 PolarHBondContact O-N 3.35Å |
| 330 | Q | 59.5 | Low | 60.7 | Low | 125 Ų | 125 | 104.8 Ų | 104.8 | 58% | 0.584 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -61.3 | -36.7 | 173.6 | -78.4 | -168.3 | -0.1 | 0 | 0 | 112.9 | A326 K334 | A326-Q330 WeakPolarHBondContact O-CG 3.23Å; A326-Q330 PolarHBondContact O-N 3.33Å; Q330-K334 WeakPolarHBondContact O-CB 3.44Å; Q330-K334 WeakPolarHBondContact O-CG 3.45Å; Q330-K334 PolarHBondContact O-N 3.24Å |
| 331 | H | 55.3 | Low | 60.5 | Low | 137 Ų | 137 | 107.9 Ų | 107.9 | 63% | 0.634 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -72.2 | -37.7 | 178.1 | -156.4 | -89.7 | 0 | 0 | 0 | 111.7 | R327 A328 D329 R335 | R327-H331 WeakPolarHBondContact O-CB 3.39Å; R327-H331 PolarHBondContact O-N 3.35Å; R327-H331 VanDerWaalsContact O-N 3.12Å; A328-H331 PolarHBondContact O-N 3.36Å; D329-H331 VanDerWaalsContact C-N 3.29Å; D329-H331 PolarHBondContact O-N 3.36Å; H331-R335 WeakPolarHBondContact O-CB 3.43Å; H331-R335 PolarHBondContact O-N 3.13Å; H331-R335 VanDerWaalsContact O-N 3.13Å |
| 332 | S | 60.4 | Low | 60.2 | Low | 83 Ų | 83 | 110 Ų | 110 | 58% | 0.58 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -63.5 | -45.7 | 172.8 | -171.1 | 0 | 0 | 0 | 0 | 111.6 | A328 D329 K334 R335 G336 | A328-S332 WeakPolarHBondContact O-CB 3.42Å; A328-S332 PolarHBondContact O-N 3.27Å; D329-S332 PolarHBondContact O-N 2.71Å; S332-K334 PolarHBondContact O-N 3.01Å; S332-R335 PolarHBondContact O-N 3.47Å; S332-G336 PolarHBondContact O-N 3Å |
| 333 | Q | 59.4 | Low | 60.1 | Low | 149 Ų | 149 | 109.6 Ų | 109.6 | 70% | 0.696 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -66.7 | -37 | -179.8 | -157 | 173.6 | 17.9 | 0 | 0 | 112.5 | D329 S337 | D329-Q333 WeakPolarHBondContact O-CB 3.41Å; D329-Q333 PolarHBondContact O-N 3.35Å; Q333-S337 WeakPolarHBondContact O-CB 3.08Å; Q333-S337 PolarHBondContact O-N 3.06Å |
| 334 | K | 57 | Low | 60.2 | Low | 152 Ų | 152 | 108.4 Ų | 108.4 | 66% | 0.661 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -65.4 | -40.5 | 172 | -81.7 | -179.4 | 177.4 | 177.6 | 0 | 112.6 | Q330 S332 S337 F338 | Q330-K334 WeakPolarHBondContact O-CB 3.44Å; Q330-K334 WeakPolarHBondContact O-CG 3.45Å; Q330-K334 PolarHBondContact O-N 3.24Å; S332-K334 PolarHBondContact O-N 3.01Å; K334-S337 PolarHBondContact O-N 3.4Å; K334-F338 WeakPolarHBondContact O-CB 3.36Å; K334-F338 PolarHBondContact O-N 2.03Å |
| 335 | R | 56.8 | Low | 60.3 | Low | 197 Ų | 197 | 109.7 Ų | 109.7 | 74% | 0.743 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -68.3 | -39 | 177.8 | -160 | 175.8 | -174.4 | -179.1 | 1.4 | 111.7 | H331 S332 S339 | H331-R335 WeakPolarHBondContact O-CB 3.43Å; H331-R335 PolarHBondContact O-N 3.13Å; H331-R335 VanDerWaalsContact O-N 3.13Å; S332-R335 PolarHBondContact O-N 3.47Å; R335-S339 WeakPolarHBondContact O-CB 3Å; R335-S339 PolarHBondContact O-N 2.89Å; R335-S339 VanDerWaalsContact O-N 3.08Å |
| 336 | G | 57.5 | Low | 60.2 | Low | 36 Ų | 36 | 107.2 Ų | 107.2 | 37% | 0.371 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -60.5 | -51.2 | 171.1 | 0 | 0 | 0 | 0 | 0 | 112 | S332 F338 S339 T340 | S332-G336 PolarHBondContact O-N 3Å; G336-F338 VanDerWaalsContact C-N 3.33Å; G336-F338 PolarHBondContact O-N 3.35Å; G336-S339 WeakPolarHBondContact O-CB 3.42Å; G336-S339 PolarHBondContact O-N 2.73Å; G336-S339 VanDerWaalsContact O-N 3.16Å; G336-T340 PolarHBondContact O-N 2.88Å; G336-T340 PolarHBondContact O-OG1 3.4Å |
| 337 | S | 58 | Low | 60.4 | Low | 57 Ų | 57 | 112.2 Ų | 112.2 | 40% | 0.399 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -60.2 | -39.3 | 179.4 | -170.2 | 0 | 0 | 0 | 0 | 113.1 | Q333 K334 T340 R341 | Q333-S337 WeakPolarHBondContact O-CB 3.08Å; Q333-S337 PolarHBondContact O-N 3.06Å; K334-S337 PolarHBondContact O-N 3.4Å; S337-T340 PolarHBondContact O-N 2.98Å; S337-R341 WeakPolarHBondContact O-CB 3.42Å; S337-R341 VanDerWaalsContact O-CG 3.31Å; S337-R341 WeakPolarHBondContact O-CG 3.49Å; S337-R341 PolarHBondContact O-N 3.25Å |
| 338 | F | 55.5 | Low | 60.8 | Low | 139 Ų | 139 | 109.9 Ų | 109.9 | 61% | 0.61 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -67 | -41.1 | 175.9 | -165.6 | -99.8 | 0 | 0 | 0 | 112.1 | K334 G336 R341 L342 | K334-F338 WeakPolarHBondContact O-CB 3.36Å; K334-F338 PolarHBondContact O-N 2.03Å; G336-F338 VanDerWaalsContact C-N 3.33Å; G336-F338 PolarHBondContact O-N 3.35Å; F338-R341 PolarHBondContact O-N 2.97Å; F338-L342 HydrophobicContact CE1-CD1 4.47Å; F338-L342 WeakPolarHBondContact O-CB 3.44Å; F338-L342 PolarHBondContact O-N 2.98Å |
| 339 | S | 58.2 | Low | 60.9 | Low | 76 Ų | 76 | 112.2 Ų | 112.2 | 53% | 0.531 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -64.3 | -40.4 | 175 | -174.6 | 0 | 0 | 0 | 0 | 112.5 | R335 G336 L342 S343 | R335-S339 WeakPolarHBondContact O-CB 3Å; R335-S339 PolarHBondContact O-N 2.89Å; R335-S339 VanDerWaalsContact O-N 3.08Å; G336-S339 WeakPolarHBondContact O-CB 3.42Å; G336-S339 PolarHBondContact O-N 2.73Å; G336-S339 VanDerWaalsContact O-N 3.16Å; S339-L342 PolarHBondContact O-N 3.49Å; S339-S343 WeakPolarHBondContact O-CB 3.46Å; S339-S343 PolarHBondContact O-N 3.34Å; S339-S343 PolarHBondContact O-OG 3.08Å |
| 340 | T | 60.9 | Low | 61 | Low | 89 Ų | 89 | 109.4 Ų | 109.4 | 55% | 0.546 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -65.7 | -39.8 | 175.4 | -40.3 | 0 | 0 | 0 | 0 | 111.5 | G336 S337 S343 S344 | G336-T340 PolarHBondContact O-N 2.88Å; G336-T340 PolarHBondContact O-OG1 3.4Å; S337-T340 PolarHBondContact O-N 2.98Å; T340-S343 WeakPolarHBondContact CA-OG 3.49Å; T340-S343 PolarHBondContact O-OG 3.16Å; T340-S344 WeakPolarHBondContact O-CB 3.45Å; T340-S344 PolarHBondContact O-N 2.88Å |
| 341 | R | 60.7 | Low | 61.6 | Low | 174 Ų | 174 | 107.9 Ų | 107.9 | 66% | 0.657 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -66 | -43.9 | 175 | -73.8 | 177.7 | -176.8 | -159.1 | 0.3 | 111.9 | S337 F338 S343 S344 F345 | S337-R341 WeakPolarHBondContact O-CB 3.42Å; S337-R341 VanDerWaalsContact O-CG 3.31Å; S337-R341 WeakPolarHBondContact O-CG 3.49Å; S337-R341 PolarHBondContact O-N 3.25Å; F338-R341 PolarHBondContact O-N 2.97Å; R341-S343 PolarHBondContact O-N 2.97Å; R341-S344 PolarHBondContact O-N 2.91Å; R341-S344 PolarHBondContact O-OG 3.48Å; R341-F345 WeakPolarHBondContact O-CB 3.44Å; R341-F345 PolarHBondContact O-N 3.16Å |
| 342 | L | 58.8 | Low | 62.1 | Low | 105 Ų | 105 | 106.8 Ų | 106.8 | 55% | 0.55 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -65.1 | -39.6 | 178.9 | -153.7 | 78.6 | 0 | 0 | 0 | 111.9 | F338 S339 F345 S346 | F338-L342 HydrophobicContact CE1-CD1 4.47Å; F338-L342 WeakPolarHBondContact O-CB 3.44Å; F338-L342 PolarHBondContact O-N 2.98Å; S339-L342 PolarHBondContact O-N 3.49Å; L342-F345 PolarHBondContact O-N 2.99Å; L342-S346 WeakPolarHBondContact O-CB 3.38Å; L342-S346 PolarHBondContact O-N 3.32Å |
| 343 | S | 63.2 | Low | 62.2 | Low | 44 Ų | 44 | 109.6 Ų | 109.6 | 31% | 0.308 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -71.2 | -30 | 175 | 61.1 | 0 | 0 | 0 | 0 | 113.3 | S339 T340 R341 R347 | S339-S343 WeakPolarHBondContact O-CB 3.46Å; S339-S343 PolarHBondContact O-N 3.34Å; S339-S343 PolarHBondContact O-OG 3.08Å; T340-S343 WeakPolarHBondContact CA-OG 3.49Å; T340-S343 PolarHBondContact O-OG 3.16Å; R341-S343 PolarHBondContact O-N 2.97Å; S343-R347 PolarHBondContact O-N 3.18Å; S343-R347 VanDerWaalsContact O-N 3.15Å; S343-R347 PolarHBondContact O-NE 3Å |
| 344 | S | 62.9 | Low | 62.5 | Low | 60 Ų | 60 | 107 Ų | 107 | 42% | 0.42 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -71.2 | -36.5 | 170.9 | 78.1 | 0 | 0 | 0 | 0 | 112.3 | T340 R341 K348 | T340-S344 WeakPolarHBondContact O-CB 3.45Å; T340-S344 PolarHBondContact O-N 2.88Å; R341-S344 PolarHBondContact O-N 2.91Å; R341-S344 PolarHBondContact O-OG 3.48Å; S344-K348 PolarHBondContact O-N 3.5Å; S344-K348 VanDerWaalsContact O-N 3.09Å |
| 345 | F | 64.8 | Low | 62.7 | Low | 135 Ų | 135 | 105.5 Ų | 105.5 | 59% | 0.592 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -70.9 | -42.2 | 177.1 | -170.3 | -99.5 | 0 | 0 | 0 | 111.2 | R341 L342 R347 K348 L349 | R341-F345 WeakPolarHBondContact O-CB 3.44Å; R341-F345 PolarHBondContact O-N 3.16Å; L342-F345 PolarHBondContact O-N 2.99Å; F345-R347 PolarHBondContact O-N 3.3Å; F345-K348 PolarHBondContact O-N 3.15Å; F345-L349 PolarHBondContact O-N 2.76Å |
| 346 | S | 65.8 | Low | 62.6 | Low | 79 Ų | 79 | 98.9 Ų | 98.9 | 55% | 0.552 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -59.8 | -44.5 | 174.1 | -174.9 | 0 | 0 | 0 | 0 | 112.2 | L342 L349 S350 | L342-S346 WeakPolarHBondContact O-CB 3.38Å; L342-S346 PolarHBondContact O-N 3.32Å; S346-L349 WeakPolarHBondContact O-CB 3.41Å; S346-L349 PolarHBondContact O-N 3.36Å; S346-L349 VanDerWaalsContact O-N 3.16Å; S346-S350 PolarHBondContact O-N 3.09Å |
| 347 | R | 66.8 | Low | 62.5 | Low | 158 Ų | 158 | 101.5 Ų | 101.5 | 60% | 0.596 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -61.6 | -43.5 | 174.5 | -87.5 | -178.3 | -88.9 | -178.1 | -9.5 | 113.1 | S343 F345 L349 S350 D351 | S343-R347 PolarHBondContact O-N 3.18Å; S343-R347 VanDerWaalsContact O-N 3.15Å; S343-R347 PolarHBondContact O-NE 3Å; F345-R347 PolarHBondContact O-N 3.3Å; R347-L349 PolarHBondContact O-N 2.91Å; R347-S350 WeakPolarHBondContact CA-OG 3.34Å; R347-S350 PolarHBondContact O-N 3.08Å; R347-S350 PolarHBondContact O-OG 3.09Å; R347-D351 PolarHBondContact O-N 3.05Å |
| 348 | K | 68.5 | Low | 62.3 | Low | 144 Ų | 144 | 103.8 Ų | 103.8 | 63% | 0.626 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -62.8 | -32.6 | 174.5 | -77.3 | -174.1 | 173.2 | -170.7 | 0 | 112.9 | S344 F345 L352 | S344-K348 PolarHBondContact O-N 3.5Å; S344-K348 VanDerWaalsContact O-N 3.09Å; F345-K348 PolarHBondContact O-N 3.15Å; K348-L352 WeakPolarHBondContact O-CG 3.46Å; K348-L352 PolarHBondContact O-N 2.86Å |
| 349 | L | 63.9 | Low | 62.1 | Low | 107 Ų | 107 | 104 Ų | 104 | 56% | 0.56 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -73.5 | -35 | 177.6 | -154.9 | 77.5 | 0 | 0 | 0 | 112 | F345 S346 R347 K353 | F345-L349 PolarHBondContact O-N 2.76Å; S346-L349 WeakPolarHBondContact O-CB 3.41Å; S346-L349 PolarHBondContact O-N 3.36Å; S346-L349 VanDerWaalsContact O-N 3.16Å; R347-L349 PolarHBondContact O-N 2.91Å; L349-K353 WeakPolarHBondContact O-CB 3.5Å; L349-K353 PolarHBondContact O-N 3.47Å; L349-K353 VanDerWaalsContact O-N 3.15Å |
| 350 | S | 66.4 | Low | 61.8 | Low | 51 Ų | 51 | 105.5 Ų | 105.5 | 36% | 0.357 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -67.4 | -43.5 | 172.2 | 55 | 0 | 0 | 0 | 0 | 111.8 | S346 R347 L352 K353 D354 | S346-S350 PolarHBondContact O-N 3.09Å; R347-S350 WeakPolarHBondContact CA-OG 3.34Å; R347-S350 PolarHBondContact O-N 3.08Å; R347-S350 PolarHBondContact O-OG 3.09Å; S350-L352 VanDerWaalsContact C-N 3.31Å; S350-L352 PolarHBondContact O-N 2.98Å; S350-K353 WeakPolarHBondContact O-CB 3.44Å; S350-K353 PolarHBondContact O-N 3.01Å; S350-D354 PolarHBondContact O-N 3.15Å |
| 351 | D | 72.4 | Confident | 61.3 | Low | 94 Ų | 94 | 106 Ų | 106 | 50% | 0.503 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -62.6 | -38.2 | 179.6 | -61.1 | -16.2 | 0 | 0 | 0 | 111.7 | R347 D354 L355 | R347-D351 PolarHBondContact O-N 3.05Å; D351-D354 PolarHBondContact O-N 3.35Å; D351-L355 WeakPolarHBondContact O-CG 3.43Å; D351-L355 PolarHBondContact O-N 3.37Å; D351-L355 VanDerWaalsContact O-N 3.08Å |
| 352 | L | 65.6 | Low | 60.9 | Low | 114 Ų | 114 | 100.8 Ų | 100.8 | 60% | 0.597 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -67.3 | -35.1 | 173.8 | -81.2 | 166.4 | 0 | 0 | 0 | 112.9 | K348 S350 A356 | K348-L352 WeakPolarHBondContact O-CG 3.46Å; K348-L352 PolarHBondContact O-N 2.86Å; S350-L352 VanDerWaalsContact C-N 3.31Å; S350-L352 PolarHBondContact O-N 2.98Å; L352-A356 WeakPolarHBondContact O-CB 3.49Å; L352-A356 PolarHBondContact O-N 3.25Å; L352-A356 VanDerWaalsContact O-N 3.09Å |
| 353 | K | 62.5 | Low | 60 | Low | 142 Ų | 142 | 105.2 Ų | 105.2 | 62% | 0.617 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -69.1 | -39.7 | 176.8 | -171.1 | 179.4 | 177 | -174.8 | 0 | 111 | L349 S350 A356 I357 | L349-K353 WeakPolarHBondContact O-CB 3.5Å; L349-K353 PolarHBondContact O-N 3.47Å; L349-K353 VanDerWaalsContact O-N 3.15Å; S350-K353 WeakPolarHBondContact O-CB 3.44Å; S350-K353 PolarHBondContact O-N 3.01Å; K353-A356 PolarHBondContact O-N 2.94Å; K353-I357 HydrophobicContact CG-CD1 4.12Å; K353-I357 WeakPolarHBondContact O-CD1 3.42Å; K353-I357 VanDerWaalsContact O-CG1 3.24Å; K353-I357 WeakPolarHBondContact O-CG1 3.39Å; K353-I357 PolarHBondContact O-N 3.3Å; K353-I357 VanDerWaalsContact O-N 3.11Å |
| 354 | D | 65.8 | Low | 59.9 | Low | 95 Ų | 95 | 108.3 Ų | 108.3 | 51% | 0.508 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -68.2 | -37.7 | 177.5 | -67.7 | -23.6 | 0 | 0 | 0 | 111.6 | S350 D351 I357 V358 | S350-D354 PolarHBondContact O-N 3.15Å; D351-D354 PolarHBondContact O-N 3.35Å; D354-I357 PolarHBondContact O-N 3.11Å; D354-V358 WeakPolarHBondContact O-CG2 3.24Å; D354-V358 PolarHBondContact O-N 3.36Å |
| 355 | L | 60.8 | Low | 59.7 | Low | 119 Ų | 119 | 110.8 Ų | 110.8 | 62% | 0.623 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -64 | -39.5 | 172.5 | -78.7 | 161.2 | 0 | 0 | 0 | 113 | D351 I357 V358 D359 | D351-L355 WeakPolarHBondContact O-CG 3.43Å; D351-L355 PolarHBondContact O-N 3.37Å; D351-L355 VanDerWaalsContact O-N 3.08Å; L355-I357 VanDerWaalsContact C-N 3.33Å; L355-I357 PolarHBondContact O-N 3.25Å; L355-V358 PolarHBondContact O-N 3.43Å; L355-D359 PolarHBondContact O-N 3.35Å |
| 356 | A | 54.7 | Low | 59.4 | Low | 59 Ų | 59 | 109.4 Ų | 109.4 | 49% | 0.488 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -69.4 | -29.5 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113 | L352 K353 T360 | L352-A356 WeakPolarHBondContact O-CB 3.49Å; L352-A356 PolarHBondContact O-N 3.25Å; L352-A356 VanDerWaalsContact O-N 3.09Å; K353-A356 PolarHBondContact O-N 2.94Å; A356-T360 PolarHBondContact O-OG1 3.5Å |
| 357 | I | 55.4 | Low | 59.1 | Low | 90 Ų | 90 | 111.2 Ų | 111.2 | 46% | 0.462 | 62% | 0.622 | S | S | . | * | H | α-helix | trans | -73.8 | -33.7 | 177.3 | -68.5 | 164.4 | 0 | 0 | 0 | 111.2 | K353 D354 L355 T360 | K353-I357 HydrophobicContact CG-CD1 4.12Å; K353-I357 WeakPolarHBondContact O-CD1 3.42Å; K353-I357 VanDerWaalsContact O-CG1 3.24Å; K353-I357 WeakPolarHBondContact O-CG1 3.39Å; K353-I357 PolarHBondContact O-N 3.3Å; K353-I357 VanDerWaalsContact O-N 3.11Å; D354-I357 PolarHBondContact O-N 3.11Å; L355-I357 VanDerWaalsContact C-N 3.33Å; L355-I357 PolarHBondContact O-N 3.25Å; I357-T360 PolarHBondContact O-N 2.97Å; I357-T360 PolarHBondContact O-OG1 3.45Å |
| 358 | V | 55.2 | Low | 58.6 | Low | 105 Ų | 105 | 108.3 Ų | 108.3 | 64% | 0.636 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -69 | -32.8 | 176.4 | 173 | 0 | 0 | 0 | 0 | 112.2 | D354 L355 S361 | D354-V358 WeakPolarHBondContact O-CG2 3.24Å; D354-V358 PolarHBondContact O-N 3.36Å; L355-V358 PolarHBondContact O-N 3.43Å; V358-S361 PolarHBondContact O-OG 3.22Å |
| 359 | D | 51.5 | Low | 57.9 | Low | 143 Ų | 143 | 105.9 Ų | 105.9 | 77% | 0.765 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -74.2 | -25.5 | 177.7 | -118.5 | -5.9 | 0 | 0 | 0 | 112.9 | L355 | L355-D359 PolarHBondContact O-N 3.35Å |
| 360 | T | 51.6 | Low | 57.5 | Low | 109 Ų | 109 | 105.9 Ų | 105.9 | 67% | 0.669 | 63% | 0.628 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.5 | -9.9 | 179 | 45.3 | 0 | 0 | 0 | 0 | 115.2 | A356 I357 | A356-T360 PolarHBondContact O-OG1 3.5Å; I357-T360 PolarHBondContact O-N 2.97Å; I357-T360 PolarHBondContact O-OG1 3.45Å |
| 361 | S | 50.6 | Low | 56.8 | Low | 99 Ų | 99 | 110.1 Ų | 110.1 | 69% | 0.692 | 65% | 0.649 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.7 | 5.6 | 178.5 | 57.5 | 0 | 0 | 0 | 0 | 113.9 | V358 | V358-S361 PolarHBondContact O-OG 3.22Š|
| 362 | G | 52.6 | Low | 55.5 | Low | 64 Ų | 64 | 111.4 Ų | 111.4 | 66% | 0.66 | 66% | 0.661 | S | S | * | * | trans | -113.3 | 30.2 | -175.9 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 363 | T | 39.9 | Very low | 54.6 | Low | 198 Ų | 198 | 111.2 Ų | 111.2 | 100% | 1.215 | 67% | 0.667 | S | S | * | * | trans | -131.3 | 0 | 168.7 | 53.5 | 0 | 0 | 0 | 0 | 112.1 |
Retrieved 363 of 363 residues in 221.8 ms
(Link to these results)