| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 38.2 | Very low | 43 | Very low | 231 Ų | 231 | 132.9 Ų | 132.9 | 100% | 1.138 | 82% | 0.822 | S | S | * | * | 0 | 71.1 | 0 | -93.8 | 168.1 | 163.6 | 0 | 0 | 106.9 | |||||
| 2 | E | 39.7 | Very low | 43 | Very low | 182 Ų | 182 | 132.1 Ų | 132.1 | 85% | 0.85 | 82% | 0.82 | S | S | * | * | 75.5 | 102.9 | 88.1 | -74.5 | -179.6 | 135 | 0 | 0 | 111.1 | |||||
| 3 | A | 41 | Very low | 42.6 | Very low | 92 Ų | 92 | 134.1 Ų | 134.1 | 76% | 0.76 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -70 | 140.6 | 175 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||
| 4 | P | 44.9 | Very low | 42.1 | Very low | 127 Ų | 127 | 131.1 Ų | 131.1 | 83% | 0.825 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -81.6 | 131.4 | 172.2 | 0.2 | 17.9 | 0 | 0 | 0 | 110.6 | ||
| 5 | V | 44.4 | Very low | 41.7 | Very low | 128 Ų | 128 | 131.1 Ų | 131.1 | 78% | 0.776 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -66.2 | 119.3 | -179.7 | 177.4 | 0 | 0 | 0 | 0 | 110.7 | T7 | V5-T7 HydrophobicContact CG1-CG2 4.35Å; V5-T7 PolarHBondContact O-N 3.2Å |
| 6 | T | 42 | Very low | 41.5 | Very low | 141 Ų | 141 | 134.4 Ų | 134.4 | 87% | 0.865 | 81% | 0.809 | S | S | * | * | trans | -76.5 | 99 | 167.5 | -23.3 | 0 | 0 | 0 | 0 | 108.7 | A8 | T6-A8 PolarHBondContact O-N 2.98Š| ||
| 7 | T | 42.5 | Very low | 41.1 | Very low | 127 Ų | 127 | 132.8 Ų | 132.8 | 78% | 0.779 | 81% | 0.805 | S | S | * | * | trans | -72 | 114.4 | 171.8 | 42.2 | 0 | 0 | 0 | 0 | 110.1 | V5 | V5-T7 HydrophobicContact CG1-CG2 4.35Å; V5-T7 PolarHBondContact O-N 3.2Å | ||
| 8 | A | 42.1 | Very low | 41 | Very low | 98 Ų | 98 | 131.6 Ų | 131.6 | 81% | 0.81 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -62.7 | 133.2 | 170.2 | 0 | 0 | 0 | 0 | 0 | 110.8 | T6 | T6-A8 PolarHBondContact O-N 2.98Š|
| 9 | S | 42.5 | Very low | 40.7 | Very low | 108 Ų | 108 | 129.6 Ų | 129.6 | 76% | 0.755 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -67.4 | 140.8 | 169 | 42.3 | 0 | 0 | 0 | 0 | 110.6 | ||
| 10 | P | 47.9 | Very low | 40.8 | Very low | 120 Ų | 120 | 128.6 Ų | 128.6 | 78% | 0.779 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -75.2 | 142.2 | 178 | 29.8 | -31.4 | 0 | 0 | 0 | 110.5 | ||
| 11 | P | 48.2 | Very low | 40.9 | Very low | 108 Ų | 108 | 128.4 Ų | 128.4 | 70% | 0.701 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -69.9 | 149.9 | 171.2 | 29.2 | -32.5 | 0 | 0 | 0 | 110.6 | N13 | P11-N13 PolarHBondContact O-N 2.84Š|
| 12 | P | 42.2 | Very low | 40.7 | Very low | 123 Ų | 123 | 123.4 Ų | 123.4 | 80% | 0.799 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -67.3 | 122 | 178.3 | 26.5 | -31.9 | 0 | 0 | 0 | 110.6 | S14 | P12-S14 PolarHBondContact O-N 3.35Š|
| 13 | N | 38.3 | Very low | 40.7 | Very low | 158 Ų | 158 | 120.3 Ų | 120.3 | 85% | 0.845 | 77% | 0.771 | S | S | * | * | trans | -61.4 | 95.6 | 166.2 | -86.3 | -17.8 | 0 | 0 | 0 | 109.8 | P11 T15 | P11-N13 PolarHBondContact O-N 2.84Å; N13-T15 VanDerWaalsContact C-N 3.33Å; N13-T15 PolarHBondContact O-N 2.97Å | ||
| 14 | S | 36.1 | Very low | 40.4 | Very low | 93 Ų | 93 | 123.8 Ų | 123.8 | 65% | 0.65 | 78% | 0.776 | S | S | * | * | trans | -87.1 | 78.4 | 158.7 | 46.1 | 0 | 0 | 0 | 0 | 108.9 | P12 F16 | P12-S14 PolarHBondContact O-N 3.35Å; S14-F16 PolarHBondContact O-N 3.29Å | ||
| 15 | T | 35.8 | Very low | 39.8 | Very low | 130 Ų | 130 | 128.9 Ų | 128.9 | 80% | 0.798 | 78% | 0.778 | S | S | * | * | trans | -65.2 | 83 | 160 | 13.4 | 0 | 0 | 0 | 0 | 108.1 | N13 S17 | N13-T15 VanDerWaalsContact C-N 3.33Å; N13-T15 PolarHBondContact O-N 2.97Å; T15-S17 VanDerWaalsContact C-N 3.29Å; T15-S17 PolarHBondContact O-N 3.36Å | ||
| 16 | F | 38.1 | Very low | 39.3 | Very low | 185 Ų | 185 | 127.5 Ų | 127.5 | 81% | 0.811 | 77% | 0.772 | S | S | * | * | trans | -62.4 | 98.8 | 156.5 | -86.2 | -86.7 | 0 | 0 | 0 | 106.5 | S14 S18 | S14-F16 PolarHBondContact O-N 3.29Å; F16-S18 VanDerWaalsContact C-N 3.28Å; F16-S18 PolarHBondContact O-N 3.03Å | ||
| 17 | S | 35.4 | Very low | 39.1 | Very low | 106 Ų | 106 | 124.9 Ų | 124.9 | 74% | 0.741 | 77% | 0.765 | S | S | * | * | trans | -62.5 | 98.9 | 161.7 | 64.4 | 0 | 0 | 0 | 0 | 106.7 | T15 S19 | T15-S17 VanDerWaalsContact C-N 3.29Å; T15-S17 PolarHBondContact O-N 3.36Å; S17-S19 PolarHBondContact O-N 2.88Å | ||
| 18 | S | 38.7 | Very low | 38.9 | Very low | 111 Ų | 111 | 121.6 Ų | 121.6 | 78% | 0.776 | 74% | 0.744 | S | S | * | * | trans | -66.7 | 87.4 | 163.6 | 45 | 0 | 0 | 0 | 0 | 107.3 | F16 | F16-S18 VanDerWaalsContact C-N 3.28Å; F16-S18 PolarHBondContact O-N 3.03Å | ||
| 19 | S | 35.7 | Very low | 39 | Very low | 95 Ų | 95 | 119.7 Ų | 119.7 | 66% | 0.664 | 73% | 0.729 | S | S | * | * | P | Polyproline II helix | trans | -50.7 | 130.4 | 161.4 | 35.6 | 0 | 0 | 0 | 0 | 108 | S17 | S17-S19 PolarHBondContact O-N 2.88Š|
| 20 | P | 43.1 | Very low | 39.7 | Very low | 108 Ų | 108 | 119.4 Ų | 119.4 | 70% | 0.701 | 73% | 0.725 | S | S | * | * | P | Polyproline II helix | trans | -57 | 140.6 | 177.6 | 23.1 | -31.4 | 0 | 0 | 0 | 108.8 | T22 | P20-T22 PolarHBondContact O-N 2.92Š|
| 21 | P | 41.8 | Very low | 40.1 | Very low | 126 Ų | 126 | 117.3 Ų | 117.3 | 82% | 0.818 | 71% | 0.713 | S | S | * | * | P | Polyproline II helix | trans | -55.7 | 119 | -179.8 | 21.6 | -31 | 0 | 0 | 0 | 108.9 | ||
| 22 | T | 35.1 | Very low | 40.8 | Very low | 125 Ų | 125 | 115.3 Ų | 115.3 | 77% | 0.767 | 70% | 0.698 | S | S | * | * | P | Polyproline II helix | trans | -54.2 | 127.1 | 176.2 | -32.5 | 0 | 0 | 0 | 0 | 108.2 | P20 L24 | P20-T22 PolarHBondContact O-N 2.92Å; T22-L24 PolarHBondContact O-N 2.79Å; T22-L24 VanDerWaalsContact O-N 3.07Å |
| 23 | P | 38.2 | Very low | 41.7 | Very low | 117 Ų | 117 | 113.4 Ų | 113.4 | 76% | 0.76 | 68% | 0.679 | S | S | * | * | P | Polyproline II helix | trans | -59.6 | 119.9 | 178 | 21.5 | -30.2 | 0 | 0 | 0 | 108.9 | R25 | P23-R25 PolarHBondContact O-N 3.03Å; P23-R25 VanDerWaalsContact O-N 3.11Å |
| 24 | L | 35.7 | Very low | 43.2 | Very low | 166 Ų | 166 | 110.3 Ų | 110.3 | 87% | 0.869 | 66% | 0.662 | S | S | * | * | trans | -53.7 | 116 | -180 | -74 | 156.4 | 0 | 0 | 0 | 109 | T22 | T22-L24 PolarHBondContact O-N 2.79Å; T22-L24 VanDerWaalsContact O-N 3.07Å | ||
| 25 | R | 31.3 | Very low | 45 | Very low | 233 Ų | 233 | 107.8 Ų | 107.8 | 88% | 0.879 | 65% | 0.65 | S | S | * | * | trans | -66.2 | 140.3 | 171.5 | -104.8 | 178.8 | 164.2 | 176.8 | -4.7 | 109.1 | P23 | P23-R25 PolarHBondContact O-N 3.03Å; P23-R25 VanDerWaalsContact O-N 3.11Å | ||
| 26 | P | 34.8 | Very low | 46.8 | Very low | 99 Ų | 99 | 105.1 Ų | 105.1 | 64% | 0.643 | 63% | 0.628 | S | S | * | * | trans | -61.3 | 140.4 | 172.7 | -15.6 | 28.6 | 0 | 0 | 0 | 110.6 | ||||
| 27 | A | 38 | Very low | 48.6 | Very low | 86 Ų | 86 | 96.6 Ų | 96.6 | 71% | 0.711 | 59% | 0.591 | S | S | * | * | S | Bend | trans | -89.5 | -0 | -172.3 | 0 | 0 | 0 | 0 | 0 | 114.4 | D281 | A27-D281 WeakPolarHBondContact CB-OD2 3.34Š|
| 28 | V | 38 | Very low | 50.8 | Low | 58 Ų | 58 | 93.7 Ų | 93.7 | 35% | 0.352 | 57% | 0.573 | S | S | . | * | S | Bend | trans | -124.5 | 151.4 | 165.2 | 168.5 | 0 | 0 | 0 | 0 | 111 | V32 D281 | V28-V32 HydrophobicContact CG1-CB 3.79Å; V28-V32 HydrophobicContact CG1-CG2 3.8Å; V28-D281 HydrophobicContact CB-CB 3.88Å; V28-D281 WeakPolarHBondContact CB-OD1 3.34Å; V28-D281 HydrophobicContact CG2-CB 3.45Å; V28-D281 VanDerWaalsContact CG2-CB 3.45Å; V28-D281 WeakPolarHBondContact CG2-OD2 3.21Å; V28-D281 PolarHBondContact N-OD1 3.11Å; V28-D281 PolarHBondContact N-OD2 3.07Å; V28-D281 VanDerWaalsContact N-OD2 3.08Å |
| 29 | A | 44.5 | Very low | 53.1 | Low | 59 Ų | 59 | 92.5 Ų | 92.5 | 49% | 0.488 | 56% | 0.558 | S | S | . | * | trans | -54.6 | 128 | 173.2 | 0 | 0 | 0 | 0 | 0 | 110.1 | S31 V32 | A29-S31 WeakPolarHBondContact CB-OG 3.38Å; A29-S31 PolarHBondContact O-N 2.93Å; A29-V32 PolarHBondContact O-N 3.08Å | ||
| 30 | P | 57.2 | Low | 55.3 | Low | 102 Ų | 102 | 88.6 Ų | 88.6 | 66% | 0.662 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -48.6 | -22.4 | 178.8 | -28.5 | 32.9 | 0 | 0 | 0 | 114.3 | V32 L34 | P30-V32 PolarHBondContact O-N 3.29Å; P30-L34 WeakPolarHBondContact O-CB 3.41Å; P30-L34 PolarHBondContact O-N 3.48Å |
| 31 | S | 56.5 | Low | 57.4 | Low | 76 Ų | 76 | 85.5 Ų | 85.5 | 53% | 0.531 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -59.6 | -34.9 | 176.6 | 55.3 | 0 | 0 | 0 | 0 | 115.2 | A29 G35 | A29-S31 WeakPolarHBondContact CB-OG 3.38Å; A29-S31 PolarHBondContact O-N 2.93Å; S31-G35 PolarHBondContact O-N 3.42Å |
| 32 | V | 61.5 | Low | 59.8 | Low | 65 Ų | 65 | 82 Ų | 82 | 39% | 0.394 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -75.4 | -47.9 | -176.8 | 179.1 | 0 | 0 | 0 | 0 | 110.6 | V28 A29 P30 L34 G35 F36 | V28-V32 HydrophobicContact CG1-CB 3.79Å; V28-V32 HydrophobicContact CG1-CG2 3.8Å; A29-V32 PolarHBondContact O-N 3.08Å; P30-V32 PolarHBondContact O-N 3.29Å; V32-L34 VanDerWaalsContact C-N 3.28Å; V32-L34 PolarHBondContact O-N 3.18Å; V32-G35 PolarHBondContact O-N 3.06Å; V32-F36 HydrophobicContact CG1-CD2 3.92Å; V32-F36 HydrophobicContact CG1-CE2 3.97Å; V32-F36 WeakPolarHBondContact O-CD2 3.15Å; V32-F36 PolarHBondContact O-N 3.17Å |
| 33 | Q | 62.6 | Low | 62.4 | Low | 84 Ų | 84 | 79 Ų | 79 | 39% | 0.393 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -59.3 | -42.7 | 174.1 | -174.4 | 179 | -2 | 0 | 0 | 110.9 | G35 F36 T37 Y284 | Q33-G35 PolarHBondContact O-N 3.44Å; Q33-F36 PolarHBondContact O-N 3.35Å; Q33-T37 PolarHBondContact O-N 2.9Å; Q33-T37 PolarHBondContact O-OG1 3.16Å; Q33-Y284 HydrophobicContact CG-CD1 4.09Å; Q33-Y284 HydrophobicContact CG-CE1 3.94Å; Q33-Y284 HydrophobicContact CG-CE2 4.47Å; Q33-Y284 HydrophobicContact CG-CG 4.44Å |
| 34 | L | 68.8 | Low | 64.9 | Low | 93 Ų | 93 | 73.5 Ų | 73.5 | 49% | 0.487 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -59.5 | -45.2 | 174.8 | -164.6 | 94.6 | 0 | 0 | 0 | 111.9 | P30 V32 T37 A38 F91 | P30-L34 WeakPolarHBondContact O-CB 3.41Å; P30-L34 PolarHBondContact O-N 3.48Å; V32-L34 VanDerWaalsContact C-N 3.28Å; V32-L34 PolarHBondContact O-N 3.18Å; L34-T37 PolarHBondContact O-N 3.44Å; L34-A38 VanDerWaalsContact O-CB 3.23Å; L34-A38 WeakPolarHBondContact O-CB 3.36Å; L34-A38 PolarHBondContact O-N 2.93Å; L34-F91 HydrophobicContact CD1-CD2 4.15Å; L34-F91 HydrophobicContact CD1-CE2 3.47Å; L34-F91 VanDerWaalsContact CD1-CE2 3.47Å; L34-F91 HydrophobicContact CD1-CZ 3.85Å; L34-F91 HydrophobicContact CG-CE2 3.73Å; L34-F91 HydrophobicContact CG-CZ 4.32Å |
| 35 | G | 75.1 | Confident | 67.5 | Low | 40 Ų | 40 | 66.7 Ų | 66.7 | 41% | 0.412 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -62.5 | -42.1 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | S31 V32 Q33 L39 | S31-G35 PolarHBondContact O-N 3.42Å; V32-G35 PolarHBondContact O-N 3.06Å; Q33-G35 PolarHBondContact O-N 3.44Å; G35-L39 WeakPolarHBondContact O-CB 3.39Å; G35-L39 PolarHBondContact O-N 3.47Å |
| 36 | F | 72.9 | Confident | 70.4 | Confident | 74 Ų | 74 | 59.1 Ų | 59.1 | 33% | 0.325 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -68.4 | -45 | 176.2 | -88.2 | -81.5 | 0 | 0 | 0 | 112.5 | V32 Q33 A38 L39 Y40 Y284 L285 | V32-F36 HydrophobicContact CG1-CD2 3.92Å; V32-F36 HydrophobicContact CG1-CE2 3.97Å; V32-F36 WeakPolarHBondContact O-CD2 3.15Å; V32-F36 PolarHBondContact O-N 3.17Å; Q33-F36 PolarHBondContact O-N 3.35Å; F36-A38 VanDerWaalsContact C-N 3.31Å; F36-A38 PolarHBondContact O-N 3.5Å; F36-L39 WeakPolarHBondContact O-CB 3.35Å; F36-L39 PolarHBondContact O-N 3.48Å; F36-Y40 HydrophobicContact CD1-CE2 4.37Å; F36-Y40 WeakPolarHBondContact O-CD2 3.47Å; F36-Y40 PolarHBondContact O-N 2.95Å; F36-Y284 HydrophobicContact CB-CE1 4.02Å; F36-L285 HydrophobicContact CD1-CD2 4.35Å; F36-L285 HydrophobicContact CD2-CD2 3.72Å; F36-L285 HydrophobicContact CE1-CD2 4.01Å; F36-L285 HydrophobicContact CE2-CD2 3.33Å; F36-L285 HydrophobicContact CG-CD2 4.22Å; F36-L285 HydrophobicContact CZ-CD2 3.49Å; F36-L285 VanDerWaalsContact CZ-CD2 3.49Å |
| 37 | T | 75.5 | Confident | 73 | Confident | 6 Ų | 6 | 55.6 Ų | 55.6 | 4% | 0.037 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -58.8 | -45.6 | 174.7 | -51.1 | 0 | 0 | 0 | 0 | 110.7 | Q33 L34 L39 Y40 I41 F87 F91 Y284 | Q33-T37 PolarHBondContact O-N 2.9Å; Q33-T37 PolarHBondContact O-OG1 3.16Å; L34-T37 PolarHBondContact O-N 3.44Å; T37-L39 VanDerWaalsContact C-N 3.33Å; T37-L39 PolarHBondContact O-N 3.34Å; T37-Y40 PolarHBondContact O-N 2.89Å; T37-I41 HydrophobicContact CG2-CD1 4.01Å; T37-I41 VanDerWaalsContact O-CG1 3.29Å; T37-I41 WeakPolarHBondContact O-CG1 3.29Å; T37-I41 PolarHBondContact O-N 3.2Å; T37-F87 HydrophobicContact CG2-CB 4.44Å; T37-F87 WeakPolarHBondContact CG2-O 3.14Å; T37-F91 HydrophobicContact CG2-CB 3.89Å; T37-F91 HydrophobicContact CG2-CD2 4.06Å; T37-Y284 PolarHBondContact OG1-OH 3.34Å |
| 38 | A | 82.2 | Confident | 75.6 | Confident | 44 Ų | 44 | 55.2 Ų | 55.2 | 36% | 0.364 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -61.6 | -40.7 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112 | L34 F36 I41 A42 | L34-A38 VanDerWaalsContact O-CB 3.23Å; L34-A38 WeakPolarHBondContact O-CB 3.36Å; L34-A38 PolarHBondContact O-N 2.93Å; F36-A38 VanDerWaalsContact C-N 3.31Å; F36-A38 PolarHBondContact O-N 3.5Å; A38-I41 PolarHBondContact O-N 3.47Å; A38-A42 WeakPolarHBondContact O-CB 3.48Å; A38-A42 PolarHBondContact O-N 3.25Å |
| 39 | L | 86 | Confident | 78.2 | Confident | 87 Ų | 87 | 57.6 Ų | 57.6 | 46% | 0.455 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -60.1 | -46.3 | 174.1 | 178.5 | 65.5 | 0 | 0 | 0 | 111.5 | G35 F36 T37 A42 L43 | G35-L39 WeakPolarHBondContact O-CB 3.39Å; G35-L39 PolarHBondContact O-N 3.47Å; F36-L39 WeakPolarHBondContact O-CB 3.35Å; F36-L39 PolarHBondContact O-N 3.48Å; T37-L39 VanDerWaalsContact C-N 3.33Å; T37-L39 PolarHBondContact O-N 3.34Å; L39-A42 PolarHBondContact O-N 2.9Å; L39-L43 HydrophobicContact CD1-CD1 4.16Å; L39-L43 HydrophobicContact CD1-CG 4.22Å; L39-L43 HydrophobicContact CG-CD1 3.94Å; L39-L43 HydrophobicContact CG-CG 4.4Å; L39-L43 WeakPolarHBondContact O-CB 3.43Å; L39-L43 VanDerWaalsContact O-CG 3.27Å; L39-L43 WeakPolarHBondContact O-CG 3.15Å; L39-L43 PolarHBondContact O-N 3.47Å |
| 40 | Y | 83.2 | Confident | 80.4 | Confident | 13 Ų | 13 | 57.8 Ų | 57.8 | 5% | 0.051 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -65.8 | -43.3 | 177.8 | -79.5 | -67.9 | 0 | 0 | 0 | 112.5 | F36 T37 A42 L43 Y44 F87 G288 | F36-Y40 HydrophobicContact CD1-CE2 4.37Å; F36-Y40 WeakPolarHBondContact O-CD2 3.47Å; F36-Y40 PolarHBondContact O-N 2.95Å; T37-Y40 PolarHBondContact O-N 2.89Å; Y40-A42 PolarHBondContact O-N 2.95Å; Y40-L43 PolarHBondContact O-N 2.98Å; Y40-Y44 HydrophobicContact CD1-CD2 4.18Å; Y40-Y44 AromaticContact CD1-CE2 3.59Å; Y40-Y44 HydrophobicContact CD1-CE2 3.59Å; Y40-Y44 HydrophobicContact CE1-CE2 4.42Å; Y40-Y44 HydrophobicContact CG-CE2 4.35Å; Y40-Y44 WeakPolarHBondContact O-CD2 3.23Å; Y40-Y44 PolarHBondContact O-N 2.95Å; Y40-F87 HydrophobicContact CD1-CE2 4.48Å; Y40-F87 HydrophobicContact CD1-CZ 4.3Å; Y40-F87 HydrophobicContact CD2-CE1 4.23Å; Y40-F87 HydrophobicContact CD2-CZ 4.45Å; Y40-F87 HydrophobicContact CG-CE1 4.13Å; Y40-F87 HydrophobicContact CG-CE2 4.35Å; Y40-F87 HydrophobicContact CG-CZ 4.03Å; Y40-G288 WeakPolarHBondContact OH-CA 3.46Å; Y40-G288 PolarHBondContact OH-O 3.44Å |
| 41 | I | 87.3 | Confident | 82 | Confident | 43 Ų | 43 | 52.9 Ų | 52.9 | 22% | 0.221 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -55.5 | -45.4 | 173.1 | -67.7 | 168.1 | 0 | 0 | 0 | 109.8 | T37 A38 G45 F87 F91 | T37-I41 HydrophobicContact CG2-CD1 4.01Å; T37-I41 VanDerWaalsContact O-CG1 3.29Å; T37-I41 WeakPolarHBondContact O-CG1 3.29Å; T37-I41 PolarHBondContact O-N 3.2Å; A38-I41 PolarHBondContact O-N 3.47Å; I41-G45 WeakPolarHBondContact O-CA 3.19Å; I41-G45 PolarHBondContact O-N 3.42Å; I41-F87 HydrophobicContact CD1-CB 4.46Å; I41-F87 HydrophobicContact CG1-CB 3.66Å; I41-F91 HydrophobicContact CD1-CB 3.92Å; I41-F91 HydrophobicContact CD1-CD2 4.29Å; I41-F91 HydrophobicContact CD1-CG 4.22Å |
| 42 | A | 90.8 | Very high | 83.6 | Confident | 53 Ų | 53 | 55 Ų | 55 | 44% | 0.438 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -64.8 | -43.8 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | A38 L39 Y40 S46 | A38-A42 WeakPolarHBondContact O-CB 3.48Å; A38-A42 PolarHBondContact O-N 3.25Å; L39-A42 PolarHBondContact O-N 2.9Å; Y40-A42 PolarHBondContact O-N 2.95Å; A42-S46 WeakPolarHBondContact O-CB 3.33Å; A42-S46 PolarHBondContact O-N 2.81Å; A42-S46 PolarHBondContact O-OG 3.3Å |
| 43 | L | 90.3 | Very high | 84.9 | Confident | 62 Ų | 62 | 55 Ų | 55 | 33% | 0.325 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -65.5 | -52.9 | -179.8 | -72.3 | 171.7 | 0 | 0 | 0 | 112.1 | L39 Y40 S46 L47 L296 | L39-L43 HydrophobicContact CD1-CD1 4.16Å; L39-L43 HydrophobicContact CD1-CG 4.22Å; L39-L43 HydrophobicContact CG-CD1 3.94Å; L39-L43 HydrophobicContact CG-CG 4.4Å; L39-L43 WeakPolarHBondContact O-CB 3.43Å; L39-L43 VanDerWaalsContact O-CG 3.27Å; L39-L43 WeakPolarHBondContact O-CG 3.15Å; L39-L43 PolarHBondContact O-N 3.47Å; Y40-L43 PolarHBondContact O-N 2.98Å; L43-S46 PolarHBondContact O-N 2.99Å; L43-L47 WeakPolarHBondContact O-CG 3.27Å; L43-L47 PolarHBondContact O-N 3.36Å; L43-L296 HydrophobicContact CB-CD2 4.23Å; L43-L296 HydrophobicContact CD1-CD2 3.93Å |
| 44 | Y | 90.4 | Very high | 86 | Confident | 0 Ų | 0 | 51.4 Ų | 51.4 | 0% | 0 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -68.1 | -38.4 | 178.7 | -72.2 | -75.4 | 0 | 0 | 0 | 111.9 | Y40 L47 F48 W79 R83 T84 F87 L296 | Y40-Y44 HydrophobicContact CD1-CD2 4.18Å; Y40-Y44 AromaticContact CD1-CE2 3.59Å; Y40-Y44 HydrophobicContact CD1-CE2 3.59Å; Y40-Y44 HydrophobicContact CE1-CE2 4.42Å; Y40-Y44 HydrophobicContact CG-CE2 4.35Å; Y40-Y44 WeakPolarHBondContact O-CD2 3.23Å; Y40-Y44 PolarHBondContact O-N 2.95Å; Y44-L47 PolarHBondContact O-N 3.43Å; Y44-F48 WeakPolarHBondContact O-CB 3.38Å; Y44-F48 PolarHBondContact O-N 3.39Å; Y44-W79 AromaticContact CD1-CH2 3.92Å; Y44-W79 HydrophobicContact CD1-CH2 3.92Å; Y44-W79 HydrophobicContact CD1-CZ3 4Å; Y44-W79 AromaticContact CE1-CH2 3.37Å; Y44-W79 HydrophobicContact CE1-CH2 3.37Å; Y44-W79 AromaticContact CE1-CZ2 3.67Å; Y44-W79 HydrophobicContact CE1-CZ2 3.67Å; Y44-W79 AromaticContact CE1-CZ3 3.93Å; Y44-W79 HydrophobicContact CE1-CZ3 3.93Å; Y44-R83 HydrophobicContact CD1-CB 3.58Å; Y44-R83 HydrophobicContact CD1-CG 4.21Å; Y44-R83 HydrophobicContact CD2-CB 4.25Å; Y44-R83 HydrophobicContact CE1-CB 3.67Å; Y44-R83 HydrophobicContact CE1-CG 3.8Å; Y44-R83 HydrophobicContact CE2-CB 4.39Å; Y44-R83 HydrophobicContact CG-CB 3.89Å; Y44-T84 VanDerWaalsContact CB-OG1 3.31Å; Y44-T84 WeakPolarHBondContact CB-OG1 3.45Å; Y44-F87 AromaticContact CD2-CD2 3.79Å; Y44-F87 HydrophobicContact CD2-CD2 3.79Å; Y44-F87 AromaticContact CD2-CE2 3.7Å; Y44-F87 HydrophobicContact CD2-CE2 3.7Å; Y44-F87 AromaticContact CE2-CD2 3.89Å; Y44-F87 HydrophobicContact CE2-CD2 3.89Å; Y44-F87 AromaticContact CE2-CE2 3.29Å; Y44-F87 HydrophobicContact CE2-CE2 3.29Å; Y44-F87 HydrophobicContact CE2-CZ 4.14Å; Y44-L296 HydrophobicContact CD1-CD1 3.91Å; Y44-L296 HydrophobicContact CE1-CD1 3.59Å |
| 45 | G | 91.3 | Very high | 86.8 | Confident | 24 Ų | 24 | 48.8 Ų | 48.8 | 25% | 0.247 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -65.4 | -39.1 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | I41 F48 L49 T84 | I41-G45 WeakPolarHBondContact O-CA 3.19Å; I41-G45 PolarHBondContact O-N 3.42Å; G45-F48 WeakPolarHBondContact O-CB 3.35Å; G45-F48 PolarHBondContact O-N 2.99Å; G45-L49 PolarHBondContact O-N 3.13Å; G45-T84 PolarHBondContact N-OG1 2.85Å |
| 46 | S | 91.3 | Very high | 87.3 | Confident | 73 Ų | 73 | 53.8 Ų | 53.8 | 51% | 0.51 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -65.6 | -42.8 | 173.4 | -62 | 0 | 0 | 0 | 0 | 111.5 | A42 L43 F48 L49 V50 | A42-S46 WeakPolarHBondContact O-CB 3.33Å; A42-S46 PolarHBondContact O-N 2.81Å; A42-S46 PolarHBondContact O-OG 3.3Å; L43-S46 PolarHBondContact O-N 2.99Å; S46-F48 VanDerWaalsContact C-N 3.35Å; S46-L49 PolarHBondContact O-N 3.33Å; S46-V50 WeakPolarHBondContact O-CB 3.29Å; S46-V50 VanDerWaalsContact O-CG2 3.31Å; S46-V50 WeakPolarHBondContact O-CG2 3.43Å; S46-V50 PolarHBondContact O-N 3.21Å |
| 47 | L | 90.5 | Very high | 87.7 | Confident | 26 Ų | 26 | 53.1 Ų | 53.1 | 14% | 0.136 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -60.9 | -43.8 | 173.5 | -80 | 168.6 | 0 | 0 | 0 | 111.8 | L43 Y44 L49 V50 V51 W79 L296 S300 I303 | L43-L47 WeakPolarHBondContact O-CG 3.27Å; L43-L47 PolarHBondContact O-N 3.36Å; Y44-L47 PolarHBondContact O-N 3.43Å; L47-L49 VanDerWaalsContact C-N 3.33Å; L47-L49 PolarHBondContact O-N 2.93Å; L47-V50 PolarHBondContact O-N 3.5Å; L47-V51 WeakPolarHBondContact O-CB 3.22Å; L47-V51 VanDerWaalsContact O-CG2 3.28Å; L47-V51 WeakPolarHBondContact O-CG2 3.18Å; L47-V51 PolarHBondContact O-N 2.85Å; L47-W79 HydrophobicContact CD1-CZ3 4.37Å; L47-L296 HydrophobicContact CD1-CD1 3.32Å; L47-S300 WeakPolarHBondContact CD1-OG 3.45Å; L47-I303 HydrophobicContact CD2-CD1 4.09Å |
| 48 | F | 92.7 | Very high | 87.9 | Confident | 77 Ų | 77 | 53.6 Ų | 53.6 | 34% | 0.338 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -56 | -49 | 174.9 | 178.6 | -87.2 | 0 | 0 | 0 | 110.8 | Y44 G45 S46 V50 V51 Y52 L77 A80 | Y44-F48 WeakPolarHBondContact O-CB 3.38Å; Y44-F48 PolarHBondContact O-N 3.39Å; G45-F48 WeakPolarHBondContact O-CB 3.35Å; G45-F48 PolarHBondContact O-N 2.99Å; S46-F48 VanDerWaalsContact C-N 3.35Å; F48-V50 PolarHBondContact O-N 3.31Å; F48-V51 PolarHBondContact O-N 3.35Å; F48-Y52 WeakPolarHBondContact O-CB 3.46Å; F48-Y52 PolarHBondContact O-N 3.26Å; F48-L77 HydrophobicContact CD1-CD1 4.43Å; F48-L77 HydrophobicContact CD2-CD1 3.56Å; F48-L77 HydrophobicContact CD2-CG 4.13Å; F48-L77 HydrophobicContact CE1-CD1 4.34Å; F48-L77 HydrophobicContact CE2-CD1 3.47Å; F48-L77 VanDerWaalsContact CE2-CD1 3.47Å; F48-L77 HydrophobicContact CE2-CG 3.74Å; F48-L77 HydrophobicContact CG-CD1 4.07Å; F48-L77 HydrophobicContact CZ-CD1 3.88Å; F48-L77 HydrophobicContact CZ-CG 4.35Å; F48-A80 HydrophobicContact CB-CB 4Å; F48-A80 HydrophobicContact CD2-CB 4.45Å |
| 49 | L | 92.6 | Very high | 87.8 | Confident | 109 Ų | 109 | 57.3 Ų | 57.3 | 57% | 0.571 | 30% | 0.298 | S | S | * | . | H | α-helix | trans | -63.4 | -43.3 | 179 | -170 | 146.6 | 0 | 0 | 0 | 111.8 | G45 S46 L47 Y52 V53 | G45-L49 PolarHBondContact O-N 3.13Å; S46-L49 PolarHBondContact O-N 3.33Å; L47-L49 VanDerWaalsContact C-N 3.33Å; L47-L49 PolarHBondContact O-N 2.93Å; L49-Y52 PolarHBondContact O-N 2.83Å; L49-V53 HydrophobicContact CD2-CG2 4.08Å; L49-V53 WeakPolarHBondContact O-CB 3.42Å; L49-V53 VanDerWaalsContact O-CG2 3.27Å; L49-V53 WeakPolarHBondContact O-CG2 3.25Å; L49-V53 PolarHBondContact O-N 3.45Å |
| 50 | V | 90.1 | Very high | 87.5 | Confident | 62 Ų | 62 | 56.9 Ų | 56.9 | 38% | 0.376 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -60.6 | -47.5 | 176.7 | 167.2 | 0 | 0 | 0 | 0 | 111.3 | S46 L47 F48 V53 Q54 | S46-V50 WeakPolarHBondContact O-CB 3.29Å; S46-V50 VanDerWaalsContact O-CG2 3.31Å; S46-V50 WeakPolarHBondContact O-CG2 3.43Å; S46-V50 PolarHBondContact O-N 3.21Å; L47-V50 PolarHBondContact O-N 3.5Å; F48-V50 PolarHBondContact O-N 3.31Å; V50-V53 PolarHBondContact O-N 3.37Å; V50-Q54 WeakPolarHBondContact O-CG 3.27Å; V50-Q54 PolarHBondContact O-N 2.66Å |
| 51 | V | 90.1 | Very high | 87.1 | Confident | 0 Ų | 0 | 60.9 Ų | 60.9 | 0% | 0 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -67 | -39.7 | 179 | 175.3 | 0 | 0 | 0 | 0 | 110.8 | L47 F48 Q54 L55 L73 C76 L77 I303 | L47-V51 WeakPolarHBondContact O-CB 3.22Å; L47-V51 VanDerWaalsContact O-CG2 3.28Å; L47-V51 WeakPolarHBondContact O-CG2 3.18Å; L47-V51 PolarHBondContact O-N 2.85Å; F48-V51 PolarHBondContact O-N 3.35Å; V51-Q54 WeakPolarHBondContact O-CB 3.45Å; V51-Q54 PolarHBondContact O-N 3.05Å; V51-L55 PolarHBondContact O-N 3.1Å; V51-L73 HydrophobicContact CG1-CB 4.22Å; V51-L73 HydrophobicContact CG1-CD2 4.09Å; V51-L73 WeakPolarHBondContact CG1-O 3.47Å; V51-C76 HydrophobicContact CG1-CB 4.25Å; V51-C76 HydrophobicContact CG2-CB 4.31Å; V51-L77 HydrophobicContact CB-CD1 4.31Å; V51-L77 HydrophobicContact CG1-CB 3.86Å; V51-L77 HydrophobicContact CG1-CD1 4.15Å; V51-I303 HydrophobicContact CG2-CD1 3.87Å; V51-I303 HydrophobicContact CG2-CG1 4.27Å; V51-I303 HydrophobicContact CG2-CG2 3.93Å |
| 52 | Y | 90.6 | Very high | 86 | Confident | 121 Ų | 121 | 68.1 Ų | 68.1 | 48% | 0.475 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -60.3 | -47.3 | 175.7 | -179.8 | -100.4 | 0 | 0 | 0 | 111.7 | F48 L49 Q54 L55 W56 | F48-Y52 WeakPolarHBondContact O-CB 3.46Å; F48-Y52 PolarHBondContact O-N 3.26Å; L49-Y52 PolarHBondContact O-N 2.83Å; Y52-Q54 VanDerWaalsContact C-N 3.32Å; Y52-Q54 PolarHBondContact O-N 2.91Å; Y52-L55 PolarHBondContact O-N 2.91Å; Y52-W56 WeakPolarHBondContact O-CB 3.46Å; Y52-W56 PolarHBondContact O-N 3.43Å |
| 53 | V | 89.1 | Confident | 84.6 | Confident | 65 Ų | 65 | 67.6 Ų | 67.6 | 39% | 0.394 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -61.3 | -41.3 | 175 | 171.1 | 0 | 0 | 0 | 0 | 110.8 | L49 V50 L55 W56 L57 | L49-V53 HydrophobicContact CD2-CG2 4.08Å; L49-V53 WeakPolarHBondContact O-CB 3.42Å; L49-V53 VanDerWaalsContact O-CG2 3.27Å; L49-V53 WeakPolarHBondContact O-CG2 3.25Å; L49-V53 PolarHBondContact O-N 3.45Å; V50-V53 PolarHBondContact O-N 3.37Å; V53-L55 VanDerWaalsContact C-N 3.34Å; V53-L55 PolarHBondContact O-N 3.01Å; V53-W56 PolarHBondContact O-N 2.84Å; V53-L57 HydrophobicContact CG1-CD1 4.09Å; V53-L57 HydrophobicContact CG1-CG 4.4Å; V53-L57 WeakPolarHBondContact O-CB 3.32Å; V53-L57 VanDerWaalsContact O-CG 3.27Å; V53-L57 WeakPolarHBondContact O-CG 3.35Å; V53-L57 PolarHBondContact O-N 2.8Å |
| 54 | Q | 86.1 | Confident | 83.1 | Confident | 7 Ų | 7 | 70.2 Ų | 70.2 | 3% | 0.033 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -61.5 | -41.2 | 175.7 | -73.1 | -177.8 | 43.7 | 0 | 0 | 112.5 | V50 V51 Y52 L57 L58 L73 V308 | V50-Q54 WeakPolarHBondContact O-CG 3.27Å; V50-Q54 PolarHBondContact O-N 2.66Å; V51-Q54 WeakPolarHBondContact O-CB 3.45Å; V51-Q54 PolarHBondContact O-N 3.05Å; Y52-Q54 VanDerWaalsContact C-N 3.32Å; Y52-Q54 PolarHBondContact O-N 2.91Å; Q54-L57 PolarHBondContact O-N 2.67Å; Q54-L58 PolarHBondContact O-N 3.41Å; Q54-L73 HydrophobicContact CB-CD1 4.08Å; Q54-L73 HydrophobicContact CB-CD2 4.22Å; Q54-V308 HydrophobicContact CB-CG2 4.42Å |
| 55 | L | 85.6 | Confident | 81.5 | Confident | 39 Ų | 39 | 79.1 Ų | 79.1 | 20% | 0.204 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -68.7 | -40.1 | 177.5 | -167.9 | 69 | 0 | 0 | 0 | 111.6 | V51 Y52 V53 L58 F59 L73 L77 | V51-L55 PolarHBondContact O-N 3.1Å; Y52-L55 PolarHBondContact O-N 2.91Å; V53-L55 VanDerWaalsContact C-N 3.34Å; V53-L55 PolarHBondContact O-N 3.01Å; L55-L58 WeakPolarHBondContact O-CB 3.42Å; L55-L58 PolarHBondContact O-N 3.3Å; L55-F59 PolarHBondContact O-N 3.21Å; L55-L73 HydrophobicContact CD1-CB 4.24Å; L55-L77 HydrophobicContact CD2-CD2 4.24Å |
| 56 | W | 85 | Confident | 80 | Confident | 145 Ų | 145 | 89.4 Ų | 89.4 | 55% | 0.549 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -60.4 | -46.2 | 174.2 | 179.9 | -102 | 0 | 0 | 0 | 111.8 | Y52 V53 L58 F59 V60 | Y52-W56 WeakPolarHBondContact O-CB 3.46Å; Y52-W56 PolarHBondContact O-N 3.43Å; V53-W56 PolarHBondContact O-N 2.84Å; W56-L58 VanDerWaalsContact C-N 3.31Å; W56-L58 PolarHBondContact O-N 3.23Å; W56-F59 WeakPolarHBondContact O-CB 3.45Å; W56-F59 PolarHBondContact O-N 3.33Å; W56-F59 VanDerWaalsContact O-N 3.15Å; W56-V60 HydrophobicContact CD2-CG2 4.39Å; W56-V60 HydrophobicContact CZ2-CG2 4.24Å; W56-V60 WeakPolarHBondContact O-CG2 3.48Å; W56-V60 PolarHBondContact O-N 3.38Å |
| 57 | L | 81.9 | Confident | 79.3 | Confident | 60 Ų | 60 | 87 Ų | 87 | 31% | 0.314 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -58.2 | -44.7 | 174.5 | -72.3 | 171 | 0 | 0 | 0 | 111 | V53 Q54 F59 V60 Y61 | V53-L57 HydrophobicContact CG1-CD1 4.09Å; V53-L57 HydrophobicContact CG1-CG 4.4Å; V53-L57 WeakPolarHBondContact O-CB 3.32Å; V53-L57 VanDerWaalsContact O-CG 3.27Å; V53-L57 WeakPolarHBondContact O-CG 3.35Å; V53-L57 PolarHBondContact O-N 2.8Å; Q54-L57 PolarHBondContact O-N 2.67Å; L57-F59 VanDerWaalsContact C-N 3.27Å; L57-F59 PolarHBondContact O-N 3.04Å; L57-V60 PolarHBondContact O-N 3.05Å; L57-Y61 HydrophobicContact CB-CD2 4.23Å; L57-Y61 HydrophobicContact CB-CE2 3.99Å; L57-Y61 HydrophobicContact CD2-CE2 3.97Å; L57-Y61 WeakPolarHBondContact O-CD2 3.44Å; L57-Y61 PolarHBondContact O-N 3.45Å |
| 58 | L | 79.9 | Confident | 78.7 | Confident | 15 Ų | 15 | 89.2 Ų | 89.2 | 8% | 0.079 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -60.7 | -37.3 | 177.4 | -166 | 145.2 | 0 | 0 | 0 | 112.2 | Q54 L55 W56 H63 Q69 L73 | Q54-L58 PolarHBondContact O-N 3.41Å; L55-L58 WeakPolarHBondContact O-CB 3.42Å; L55-L58 PolarHBondContact O-N 3.3Å; W56-L58 VanDerWaalsContact C-N 3.31Å; W56-L58 PolarHBondContact O-N 3.23Å; L58-H63 HydrophobicContact CD2-CB 4.18Å; L58-H63 HydrophobicContact CG-CB 4.2Å; L58-Q69 HydrophobicContact CD1-CG 4.29Å; L58-L73 HydrophobicContact CD1-CD1 4.45Å |
| 59 | F | 78.9 | Confident | 78.1 | Confident | 122 Ų | 122 | 87.7 Ų | 87.7 | 54% | 0.535 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -67.3 | -45.9 | 174.5 | -177.8 | -97.9 | 0 | 0 | 0 | 112.5 | L55 W56 L57 Y61 K62 | L55-F59 PolarHBondContact O-N 3.21Å; W56-F59 WeakPolarHBondContact O-CB 3.45Å; W56-F59 PolarHBondContact O-N 3.33Å; W56-F59 VanDerWaalsContact O-N 3.15Å; L57-F59 VanDerWaalsContact C-N 3.27Å; L57-F59 PolarHBondContact O-N 3.04Å; F59-Y61 VanDerWaalsContact C-N 3.35Å; F59-Y61 PolarHBondContact O-N 2.98Å; F59-K62 PolarHBondContact O-N 3.34Å |
| 60 | V | 79.6 | Confident | 77.7 | Confident | 79 Ų | 79 | 83.5 Ų | 83.5 | 48% | 0.479 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -64 | -39.2 | 179.9 | 171.8 | 0 | 0 | 0 | 0 | 111.6 | W56 L57 K62 | W56-V60 HydrophobicContact CD2-CG2 4.39Å; W56-V60 HydrophobicContact CZ2-CG2 4.24Å; W56-V60 WeakPolarHBondContact O-CG2 3.48Å; W56-V60 PolarHBondContact O-N 3.38Å; L57-V60 PolarHBondContact O-N 3.05Å; V60-K62 PolarHBondContact O-N 3.05Å; V60-K62 VanDerWaalsContact O-N 3.15Å |
| 61 | Y | 76.2 | Confident | 77.6 | Confident | 96 Ų | 96 | 84.1 Ų | 84.1 | 38% | 0.376 | 37% | 0.371 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -75.2 | 6.7 | 178.7 | -66.4 | -55.8 | 0 | 0 | 0 | 114.3 | L57 F59 H63 | L57-Y61 HydrophobicContact CB-CD2 4.23Å; L57-Y61 HydrophobicContact CB-CE2 3.99Å; L57-Y61 HydrophobicContact CD2-CE2 3.97Å; L57-Y61 WeakPolarHBondContact O-CD2 3.44Å; L57-Y61 PolarHBondContact O-N 3.45Å; F59-Y61 VanDerWaalsContact C-N 3.35Å; F59-Y61 PolarHBondContact O-N 2.98Å; Y61-H63 PolarHBondContact O-N 2.95Å; Y61-H63 VanDerWaalsContact O-N 3.15Å |
| 62 | K | 64.3 | Low | 77.6 | Confident | 195 Ų | 195 | 84.5 Ų | 84.5 | 85% | 0.848 | 37% | 0.373 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 52.7 | 32.2 | 177.5 | -63.6 | -173.3 | 176.6 | 177.3 | 0 | 114.5 | F59 V60 | F59-K62 PolarHBondContact O-N 3.34Å; V60-K62 PolarHBondContact O-N 3.05Å; V60-K62 VanDerWaalsContact O-N 3.15Å |
| 63 | H | 60.3 | Low | 77.5 | Confident | 43 Ų | 43 | 78.8 Ų | 78.8 | 20% | 0.199 | 35% | 0.351 | C | S | . | . | trans | -65.1 | 155.2 | 173.8 | -77.7 | -66.2 | 0 | 0 | 0 | 112 | L58 Y61 R65 Y329 | L58-H63 HydrophobicContact CD2-CB 4.18Å; L58-H63 HydrophobicContact CG-CB 4.2Å; Y61-H63 PolarHBondContact O-N 2.95Å; Y61-H63 VanDerWaalsContact O-N 3.15Å; H63-R65 PolarHBondContact O-N 3.4Å; H63-Y329 AromaticContact CE1-CD1 3.58Å; H63-Y329 AromaticContact CE1-CD2 3.99Å; H63-Y329 AromaticContact CE1-CG 3.5Å; H63-Y329 AromaticContact NE2-CD1 3.84Å; H63-Y329 AromaticContact NE2-CE1 3.93Å | ||
| 64 | K | 59.3 | Low | 77.6 | Confident | 117 Ų | 117 | 81 Ų | 81 | 51% | 0.509 | 36% | 0.355 | S | S | . | . | trans | -50.6 | 112.4 | 173.5 | -156.4 | 168.8 | -172.9 | 169.3 | 0 | 108.8 | W66 D333 | K64-W66 PolarHBondContact O-N 3.32Å; K64-D333 IonicContact NZ-OD1 3.26Å; K64-D333 PolarHBondContact NZ-OD1 3.29Å; K64-D333 IonicContact NZ-OD2 2.82Å; K64-D333 PolarHBondContact NZ-OD2 3.43Å | ||
| 65 | R | 57.3 | Low | 77.8 | Confident | 187 Ų | 187 | 81.8 Ų | 81.8 | 71% | 0.706 | 36% | 0.359 | S | S | * | . | S | Bend | trans | -57.5 | -23.4 | -167.7 | -67.4 | 179.3 | 177.2 | 173.5 | -1.6 | 114.4 | H63 S70 | H63-R65 PolarHBondContact O-N 3.4Å; R65-S70 PolarHBondContact O-OG 3.39Å; R65-S70 VanDerWaalsContact O-OG 3.13Å |
| 66 | W | 59 | Low | 78.1 | Confident | 239 Ų | 239 | 79.9 Ų | 79.9 | 91% | 0.905 | 35% | 0.35 | S | S | * | . | S | Bend | trans | -114.9 | 64 | -176.4 | -71.7 | 93.5 | 0 | 0 | 0 | 112 | K64 | K64-W66 PolarHBondContact O-N 3.32Š|
| 67 | S | 76.1 | Confident | 78.5 | Confident | 23 Ų | 23 | 74.1 Ų | 74.1 | 16% | 0.161 | 33% | 0.329 | C | S | . | . | trans | -101.2 | 156 | 170.1 | 173.6 | 0 | 0 | 0 | 0 | 111.2 | Q69 S70 L71 | S67-Q69 PolarHBondContact O-N 3.3Å; S67-Q69 VanDerWaalsContact O-N 3.14Å; S67-Q69 PolarHBondContact OG-N 3.05Å; S67-S70 WeakPolarHBondContact O-CB 3.48Å; S67-S70 PolarHBondContact O-N 2.72Å; S67-L71 PolarHBondContact O-N 3.28Å; S67-L71 VanDerWaalsContact O-N 3.12Å | ||
| 68 | Y | 78.2 | Confident | 79.1 | Confident | 73 Ų | 73 | 74.9 Ų | 74.9 | 29% | 0.286 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -49 | -37 | 170.8 | -77.4 | -80.6 | 0 | 0 | 0 | 112.1 | F72 L122 L125 Y126 Q129 | Y68-F72 VanDerWaalsContact O-CB 3.32Å; Y68-F72 WeakPolarHBondContact O-CB 3.5Å; Y68-F72 PolarHBondContact O-N 3.41Å; Y68-L122 HydrophobicContact CD1-CD1 3.63Å; Y68-L122 HydrophobicContact CD1-CG 4.29Å; Y68-L122 HydrophobicContact CE1-CD1 3.98Å; Y68-L125 HydrophobicContact CE1-CD2 4.04Å; Y68-L125 HydrophobicContact CE1-CG 4.45Å; Y68-Y126 HydrophobicContact CG-CD2 4.48Å; Y68-Q129 PolarHBondContact OH-NE2 2.96Å; Y68-Q129 PolarHBondContact OH-OE1 3.44Å |
| 69 | Q | 80.9 | Confident | 79.7 | Confident | 44 Ų | 44 | 74.2 Ų | 74.2 | 21% | 0.206 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -68.3 | -42 | 178 | -175 | 174.9 | 6 | 0 | 0 | 113 | L58 S67 F72 L73 V308 F331 | L58-Q69 HydrophobicContact CD1-CG 4.29Å; S67-Q69 PolarHBondContact O-N 3.3Å; S67-Q69 VanDerWaalsContact O-N 3.14Å; S67-Q69 PolarHBondContact OG-N 3.05Å; Q69-F72 PolarHBondContact O-N 3.36Å; Q69-L73 HydrophobicContact CG-CD1 4.32Å; Q69-L73 WeakPolarHBondContact O-CG 3.31Å; Q69-L73 PolarHBondContact O-N 3Å; Q69-V308 VanDerWaalsContact NE2-CG2 3.32Å; Q69-F331 HydrophobicContact CB-CE2 4.21Å |
| 70 | S | 83.4 | Confident | 80.4 | Confident | 21 Ų | 21 | 68.4 Ų | 68.4 | 15% | 0.147 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -63.8 | -45.2 | 178.1 | -178 | 0 | 0 | 0 | 0 | 110.6 | R65 S67 L73 F74 | R65-S70 PolarHBondContact O-OG 3.39Å; R65-S70 VanDerWaalsContact O-OG 3.13Å; S67-S70 WeakPolarHBondContact O-CB 3.48Å; S67-S70 PolarHBondContact O-N 2.72Å; S70-L73 PolarHBondContact O-N 3.32Å; S70-F74 WeakPolarHBondContact O-CB 3.31Å; S70-F74 PolarHBondContact O-N 2.9Å |
| 71 | L | 87.7 | Confident | 80.9 | Confident | 75 Ų | 75 | 65.4 Ų | 65.4 | 39% | 0.393 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -63.8 | -42.4 | 176.9 | -175.6 | 61.9 | 0 | 0 | 0 | 112.1 | S67 F74 L75 L122 | S67-L71 PolarHBondContact O-N 3.28Å; S67-L71 VanDerWaalsContact O-N 3.12Å; L71-F74 PolarHBondContact O-N 3.37Å; L71-L75 HydrophobicContact CG-CD1 4.38Å; L71-L75 WeakPolarHBondContact O-CG 3.49Å; L71-L75 PolarHBondContact O-N 2.88Å; L71-L122 HydrophobicContact CB-CD2 4.08Å; L71-L122 HydrophobicContact CD2-CD1 3.92Å; L71-L122 HydrophobicContact CD2-CD2 4.04Å; L71-L122 HydrophobicContact CG-CD2 3.92Å |
| 72 | F | 89.4 | Confident | 81.5 | Confident | 8 Ų | 8 | 61.6 Ų | 61.6 | 4% | 0.035 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -57.3 | -50.4 | 174.2 | 170.6 | -102 | 0 | 0 | 0 | 111.8 | Y68 Q69 F74 L75 C76 L122 I123 L302 I303 F306 | Y68-F72 VanDerWaalsContact O-CB 3.32Å; Y68-F72 WeakPolarHBondContact O-CB 3.5Å; Y68-F72 PolarHBondContact O-N 3.41Å; Q69-F72 PolarHBondContact O-N 3.36Å; F72-F74 VanDerWaalsContact C-N 3.32Å; F72-F74 PolarHBondContact O-N 2.68Å; F72-L75 PolarHBondContact O-N 2.9Å; F72-C76 VanDerWaalsContact CZ-SG 3.58Å; F72-C76 PolarHBondContact O-N 2.89Å; F72-C76 PolarHBondContact O-SG 3.29Å; F72-C76 VanDerWaalsContact O-SG 3.4Å; F72-L122 HydrophobicContact CB-CD2 3.9Å; F72-I123 HydrophobicContact CD2-CD1 3.84Å; F72-I123 HydrophobicContact CD2-CG1 4.05Å; F72-I123 HydrophobicContact CE2-CD1 3.38Å; F72-I123 HydrophobicContact CE2-CG1 4.1Å; F72-I123 HydrophobicContact CZ-CD1 4.18Å; F72-L302 HydrophobicContact CE2-CB 4.33Å; F72-L302 HydrophobicContact CZ-CB 4.01Å; F72-I303 HydrophobicContact CE1-CG1 4.48Å; F72-I303 HydrophobicContact CZ-CG1 4.24Å; F72-F306 HydrophobicContact CD1-CB 4.41Å; F72-F306 HydrophobicContact CE1-CB 3.97Å; F72-F306 HydrophobicContact CE1-CD2 4.34Å; F72-F306 HydrophobicContact CE1-CG 4.47Å; F72-F306 HydrophobicContact CZ-CD2 4.24Å |
| 73 | L | 89 | Confident | 82.6 | Confident | 1 Ų | 1 | 52.3 Ų | 52.3 | 1% | 0.005 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -63.5 | -38.2 | 179.4 | -69.6 | 173.7 | 0 | 0 | 0 | 111.9 | V51 Q54 L55 L58 Q69 S70 C76 L77 | V51-L73 HydrophobicContact CG1-CB 4.22Å; V51-L73 HydrophobicContact CG1-CD2 4.09Å; V51-L73 WeakPolarHBondContact CG1-O 3.47Å; Q54-L73 HydrophobicContact CB-CD1 4.08Å; Q54-L73 HydrophobicContact CB-CD2 4.22Å; L55-L73 HydrophobicContact CD1-CB 4.24Å; L58-L73 HydrophobicContact CD1-CD1 4.45Å; Q69-L73 HydrophobicContact CG-CD1 4.32Å; Q69-L73 WeakPolarHBondContact O-CG 3.31Å; Q69-L73 PolarHBondContact O-N 3Å; S70-L73 PolarHBondContact O-N 3.32Å; L73-C76 PolarHBondContact O-N 3.44Å; L73-L77 VanDerWaalsContact O-CB 3.32Å; L73-L77 WeakPolarHBondContact O-CB 3.49Å; L73-L77 PolarHBondContact O-N 2.88Å |
| 74 | F | 90.8 | Very high | 83.9 | Confident | 113 Ų | 113 | 51.7 Ų | 51.7 | 50% | 0.496 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -64.3 | -44.4 | 176.6 | -171.3 | -96.7 | 0 | 0 | 0 | 112.3 | S70 L71 F72 C76 L77 L78 | S70-F74 WeakPolarHBondContact O-CB 3.31Å; S70-F74 PolarHBondContact O-N 2.9Å; L71-F74 PolarHBondContact O-N 3.37Å; F72-F74 VanDerWaalsContact C-N 3.32Å; F72-F74 PolarHBondContact O-N 2.68Å; F74-C76 PolarHBondContact O-N 2.83Å; F74-L77 PolarHBondContact O-N 2.85Å; F74-L78 PolarHBondContact O-N 3.3Å |
| 75 | L | 92 | Very high | 85.2 | Confident | 22 Ų | 22 | 49 Ų | 49 | 12% | 0.115 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -61.5 | -43.8 | 175.5 | -70.5 | 170.7 | 0 | 0 | 0 | 111.6 | L71 F72 L78 W79 L115 F118 T119 L122 | L71-L75 HydrophobicContact CG-CD1 4.38Å; L71-L75 WeakPolarHBondContact O-CG 3.49Å; L71-L75 PolarHBondContact O-N 2.88Å; F72-L75 PolarHBondContact O-N 2.9Å; L75-L78 PolarHBondContact O-N 2.99Å; L75-W79 WeakPolarHBondContact O-CB 3.12Å; L75-W79 PolarHBondContact O-N 3.29Å; L75-L115 HydrophobicContact CD2-CD2 3.82Å; L75-F118 HydrophobicContact CD1-CB 4.05Å; L75-F118 HydrophobicContact CD2-CB 4.37Å; L75-F118 HydrophobicContact CD2-CD2 4.49Å; L75-T119 HydrophobicContact CB-CG2 3.47Å; L75-T119 VanDerWaalsContact CB-CG2 3.47Å; L75-T119 HydrophobicContact CD1-CG2 4.17Å; L75-T119 HydrophobicContact CG-CG2 4.46Å; L75-L122 HydrophobicContact CD1-CD2 4.16Å |
| 76 | C | 91.6 | Very high | 86.3 | Confident | 0 Ų | 0 | 40.2 Ų | 40.2 | 0% | 0 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -64.4 | -38.3 | 175.7 | -70.8 | 0 | 0 | 0 | 0 | 112.6 | V51 F72 L73 F74 W79 A80 I303 | V51-C76 HydrophobicContact CG1-CB 4.25Å; V51-C76 HydrophobicContact CG2-CB 4.31Å; F72-C76 VanDerWaalsContact CZ-SG 3.58Å; F72-C76 PolarHBondContact O-N 2.89Å; F72-C76 PolarHBondContact O-SG 3.29Å; F72-C76 VanDerWaalsContact O-SG 3.4Å; L73-C76 PolarHBondContact O-N 3.44Å; F74-C76 PolarHBondContact O-N 2.83Å; C76-W79 PolarHBondContact O-N 2.79Å; C76-A80 VanDerWaalsContact O-CB 3.32Å; C76-A80 WeakPolarHBondContact O-CB 3.42Å; C76-A80 PolarHBondContact O-N 3.37Å; C76-I303 HydrophobicContact CB-CD1 4.1Å; C76-I303 HydrophobicContact CB-CG1 4.27Å |
| 77 | L | 93.3 | Very high | 87.1 | Confident | 23 Ų | 23 | 28.9 Ų | 28.9 | 12% | 0.12 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -63.9 | -47.1 | 177.5 | -172.1 | 72.5 | 0 | 0 | 0 | 110.8 | F48 V51 L55 L73 F74 A80 G81 | F48-L77 HydrophobicContact CD1-CD1 4.43Å; F48-L77 HydrophobicContact CD2-CD1 3.56Å; F48-L77 HydrophobicContact CD2-CG 4.13Å; F48-L77 HydrophobicContact CE1-CD1 4.34Å; F48-L77 HydrophobicContact CE2-CD1 3.47Å; F48-L77 VanDerWaalsContact CE2-CD1 3.47Å; F48-L77 HydrophobicContact CE2-CG 3.74Å; F48-L77 HydrophobicContact CG-CD1 4.07Å; F48-L77 HydrophobicContact CZ-CD1 3.88Å; F48-L77 HydrophobicContact CZ-CG 4.35Å; V51-L77 HydrophobicContact CB-CD1 4.31Å; V51-L77 HydrophobicContact CG1-CB 3.86Å; V51-L77 HydrophobicContact CG1-CD1 4.15Å; L55-L77 HydrophobicContact CD2-CD2 4.24Å; L73-L77 VanDerWaalsContact O-CB 3.32Å; L73-L77 WeakPolarHBondContact O-CB 3.49Å; L73-L77 PolarHBondContact O-N 2.88Å; F74-L77 PolarHBondContact O-N 2.85Å; L77-A80 PolarHBondContact O-N 3.39Å; L77-G81 PolarHBondContact O-N 3.32Å |
| 78 | L | 93.3 | Very high | 87.3 | Confident | 76 Ų | 76 | 30.7 Ų | 30.7 | 40% | 0.398 | 16% | 0.164 | S | C | . | . | H | α-helix | trans | -62.4 | -44.9 | 177.4 | -176.1 | 64.5 | 0 | 0 | 0 | 111 | F74 L75 G81 L82 L115 | F74-L78 PolarHBondContact O-N 3.3Å; L75-L78 PolarHBondContact O-N 2.99Å; L78-G81 PolarHBondContact O-N 3.31Å; L78-L82 HydrophobicContact CD1-CD1 4.4Å; L78-L82 HydrophobicContact CD1-CG 4.4Å; L78-L82 HydrophobicContact CG-CD1 4.15Å; L78-L82 WeakPolarHBondContact O-CB 3.48Å; L78-L82 VanDerWaalsContact O-CG 3.31Å; L78-L82 WeakPolarHBondContact O-CG 3.16Å; L78-L82 PolarHBondContact O-N 3.06Å; L78-L115 HydrophobicContact CB-CD1 4.05Å; L78-L115 HydrophobicContact CD2-CD1 3.71Å; L78-L115 HydrophobicContact CD2-CD2 3.75Å; L78-L115 HydrophobicContact CD2-CG 4.38Å; L78-L115 HydrophobicContact CG-CD1 3.62Å; L78-L115 HydrophobicContact CG-CD2 4.5Å |
| 79 | W | 93.5 | Very high | 87.1 | Confident | 2 Ų | 2 | 32.4 Ų | 32.4 | 1% | 0.008 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -59.9 | -49.1 | 176.8 | 172.6 | 86.6 | 0 | 0 | 0 | 112.4 | Y44 L47 L75 C76 G81 L82 R83 P112 L115 E295 L296 T299 | Y44-W79 AromaticContact CD1-CH2 3.92Å; Y44-W79 HydrophobicContact CD1-CH2 3.92Å; Y44-W79 HydrophobicContact CD1-CZ3 4Å; Y44-W79 AromaticContact CE1-CH2 3.37Å; Y44-W79 HydrophobicContact CE1-CH2 3.37Å; Y44-W79 AromaticContact CE1-CZ2 3.67Å; Y44-W79 HydrophobicContact CE1-CZ2 3.67Å; Y44-W79 AromaticContact CE1-CZ3 3.93Å; Y44-W79 HydrophobicContact CE1-CZ3 3.93Å; L47-W79 HydrophobicContact CD1-CZ3 4.37Å; L75-W79 WeakPolarHBondContact O-CB 3.12Å; L75-W79 PolarHBondContact O-N 3.29Å; C76-W79 PolarHBondContact O-N 2.79Å; W79-G81 VanDerWaalsContact C-N 3.32Å; W79-G81 PolarHBondContact O-N 3.47Å; W79-L82 PolarHBondContact O-N 3.2Å; W79-R83 PolarHBondContact O-N 2.84Å; W79-P112 VanDerWaalsContact CD1-O 3.23Å; W79-L115 HydrophobicContact CB-CB 4.08Å; W79-L115 HydrophobicContact CB-CD1 4.1Å; W79-E295 HydrophobicContact CZ2-CB 4.16Å; W79-L296 HydrophobicContact CH2-CD1 4.02Å; W79-T299 HydrophobicContact CD2-CG2 4.3Å; W79-T299 HydrophobicContact CE3-CG2 3.92Å; W79-T299 HydrophobicContact CH2-CG2 3.96Å; W79-T299 HydrophobicContact CZ2-CG2 4.37Å; W79-T299 HydrophobicContact CZ3-CG2 3.75Å |
| 80 | A | 92.3 | Very high | 86.4 | Confident | 0 Ų | 0 | 31.9 Ų | 31.9 | 0% | 0 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -64.9 | -38.3 | 179.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | F48 C76 L77 T84 | F48-A80 HydrophobicContact CB-CB 4Å; F48-A80 HydrophobicContact CD2-CB 4.45Å; C76-A80 VanDerWaalsContact O-CB 3.32Å; C76-A80 WeakPolarHBondContact O-CB 3.42Å; C76-A80 PolarHBondContact O-N 3.37Å; L77-A80 PolarHBondContact O-N 3.39Å; A80-T84 VanDerWaalsContact O-CB 3.32Å; A80-T84 WeakPolarHBondContact O-CB 3.24Å; A80-T84 PolarHBondContact O-N 2.91Å; A80-T84 PolarHBondContact O-OG1 3.14Å |
| 81 | G | 91.1 | Very high | 85.7 | Confident | 16 Ų | 16 | 35.7 Ų | 35.7 | 17% | 0.165 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -63.8 | -46.8 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | L77 L78 W79 T84 T85 | L77-G81 PolarHBondContact O-N 3.32Å; L78-G81 PolarHBondContact O-N 3.31Å; W79-G81 VanDerWaalsContact C-N 3.32Å; W79-G81 PolarHBondContact O-N 3.47Å; G81-T84 PolarHBondContact O-N 2.89Å; G81-T85 WeakPolarHBondContact O-CB 3.03Å; G81-T85 PolarHBondContact O-N 2.86Å; G81-T85 PolarHBondContact O-OG1 3Å |
| 82 | L | 88.8 | Confident | 84.4 | Confident | 16 Ų | 16 | 39 Ų | 39 | 8% | 0.084 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -63.2 | -45.4 | 177.4 | -71.3 | 172.5 | 0 | 0 | 0 | 111.8 | L78 W79 T85 L86 L107 L108 P112 L115 | L78-L82 HydrophobicContact CD1-CD1 4.4Å; L78-L82 HydrophobicContact CD1-CG 4.4Å; L78-L82 HydrophobicContact CG-CD1 4.15Å; L78-L82 WeakPolarHBondContact O-CB 3.48Å; L78-L82 VanDerWaalsContact O-CG 3.31Å; L78-L82 WeakPolarHBondContact O-CG 3.16Å; L78-L82 PolarHBondContact O-N 3.06Å; W79-L82 PolarHBondContact O-N 3.2Å; L82-T85 PolarHBondContact O-N 3.22Å; L82-L86 WeakPolarHBondContact O-CB 3.31Å; L82-L86 PolarHBondContact O-N 3.36Å; L82-L107 HydrophobicContact CD1-CD1 4.44Å; L82-L107 HydrophobicContact CD2-CD1 4.05Å; L82-L107 HydrophobicContact CD2-CD2 4.4Å; L82-L107 HydrophobicContact CD2-CG 3.82Å; L82-L108 HydrophobicContact CD2-CD2 4.2Å; L82-P112 HydrophobicContact CB-CG 4.08Å; L82-P112 HydrophobicContact CD1-CG 4.41Å; L82-L115 HydrophobicContact CD1-CD1 3.65Å |
| 83 | R | 86.9 | Confident | 83.3 | Confident | 0 Ų | 0 | 42.3 Ų | 42.3 | 0% | 0 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -63.4 | -44.2 | 176.5 | -77.2 | -72.2 | -175.4 | -158.3 | -6.6 | 111.7 | Y44 W79 T85 L86 F87 P112 D271 E295 | Y44-R83 HydrophobicContact CD1-CB 3.58Å; Y44-R83 HydrophobicContact CD1-CG 4.21Å; Y44-R83 HydrophobicContact CD2-CB 4.25Å; Y44-R83 HydrophobicContact CE1-CB 3.67Å; Y44-R83 HydrophobicContact CE1-CG 3.8Å; Y44-R83 HydrophobicContact CE2-CB 4.39Å; Y44-R83 HydrophobicContact CG-CB 3.89Å; W79-R83 PolarHBondContact O-N 2.84Å; R83-T85 VanDerWaalsContact C-N 3.3Å; R83-T85 PolarHBondContact O-N 3.44Å; R83-L86 WeakPolarHBondContact O-CB 3.35Å; R83-L86 PolarHBondContact O-N 2.95Å; R83-F87 WeakPolarHBondContact O-CD2 3.48Å; R83-F87 PolarHBondContact O-N 2.81Å; R83-P112 HydrophobicContact CG-CB 4.28Å; R83-D271 IonicContact NH1-OD1 3.72Å; R83-D271 IonicContact NH2-OD1 2.81Å; R83-E295 IonicContact CZ-OE1 2.88Å; R83-E295 IonicContact CZ-OE2 3.99Å; R83-E295 IonicContact NE-OE2 3.77Å; R83-E295 PolarHBondContact NE-OE2 3.4Å; R83-E295 IonicContact NH2-OE1 3.06Å; R83-E295 PolarHBondContact NH2-OE1 2.88Å; R83-E295 IonicContact NH2-OE2 3.87Å; R83-E295 PolarHBondContact NH2-OE2 3.4Å |
| 84 | T | 88.1 | Confident | 81.8 | Confident | 30 Ų | 30 | 45.9 Ų | 45.9 | 18% | 0.184 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -59.4 | -42.7 | 175.1 | -54.4 | 0 | 0 | 0 | 0 | 111.4 | Y44 G45 A80 G81 F87 S88 | Y44-T84 VanDerWaalsContact CB-OG1 3.31Å; Y44-T84 WeakPolarHBondContact CB-OG1 3.45Å; G45-T84 PolarHBondContact N-OG1 2.85Å; A80-T84 VanDerWaalsContact O-CB 3.32Å; A80-T84 WeakPolarHBondContact O-CB 3.24Å; A80-T84 PolarHBondContact O-N 2.91Å; A80-T84 PolarHBondContact O-OG1 3.14Å; G81-T84 PolarHBondContact O-N 2.89Å; T84-F87 PolarHBondContact O-N 3.27Å; T84-S88 WeakPolarHBondContact O-CB 3.19Å; T84-S88 PolarHBondContact O-N 3.37Å |
| 85 | T | 85.8 | Confident | 79.9 | Confident | 59 Ų | 59 | 43.9 Ų | 43.9 | 36% | 0.362 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -63.9 | -45.1 | 178.2 | -56.3 | 0 | 0 | 0 | 0 | 111.5 | G81 L82 R83 F87 S88 F89 L108 | G81-T85 WeakPolarHBondContact O-CB 3.03Å; G81-T85 PolarHBondContact O-N 2.86Å; G81-T85 PolarHBondContact O-OG1 3Å; L82-T85 PolarHBondContact O-N 3.22Å; R83-T85 VanDerWaalsContact C-N 3.3Å; R83-T85 PolarHBondContact O-N 3.44Å; T85-F87 PolarHBondContact O-N 3.46Å; T85-S88 PolarHBondContact O-N 2.88Å; T85-F89 HydrophobicContact CG2-CD2 3.72Å; T85-F89 HydrophobicContact CG2-CE2 3.49Å; T85-F89 VanDerWaalsContact CG2-CE2 3.49Å; T85-F89 VanDerWaalsContact O-CD2 3.27Å; T85-F89 WeakPolarHBondContact O-CD2 3.44Å; T85-F89 PolarHBondContact O-N 2.89Å; T85-L108 HydrophobicContact CG2-CD2 3.98Å |
| 86 | L | 80.1 | Confident | 78 | Confident | 3 Ų | 3 | 48.8 Ų | 48.8 | 2% | 0.016 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -55.8 | -52.9 | 175.6 | -178.6 | 78.4 | 0 | 0 | 0 | 111.1 | L82 R83 S88 F89 Y90 L108 Y109 | L82-L86 WeakPolarHBondContact O-CB 3.31Å; L82-L86 PolarHBondContact O-N 3.36Å; R83-L86 WeakPolarHBondContact O-CB 3.35Å; R83-L86 PolarHBondContact O-N 2.95Å; L86-S88 VanDerWaalsContact C-N 3.34Å; L86-S88 PolarHBondContact O-N 2.88Å; L86-F89 PolarHBondContact O-N 3.44Å; L86-Y90 HydrophobicContact CD1-CD2 4.38Å; L86-Y90 HydrophobicContact CD1-CE2 4.09Å; L86-Y90 HydrophobicContact CG-CD2 4.19Å; L86-Y90 HydrophobicContact CG-CE2 4.23Å; L86-Y90 WeakPolarHBondContact O-CD2 3.27Å; L86-Y90 PolarHBondContact O-N 2.88Å; L86-L108 HydrophobicContact CD1-CB 3.81Å; L86-Y109 HydrophobicContact CD1-CD1 4.16Å; L86-Y109 HydrophobicContact CD1-CD2 4.07Å; L86-Y109 HydrophobicContact CD1-CE1 3.79Å; L86-Y109 HydrophobicContact CD1-CE2 3.65Å; L86-Y109 HydrophobicContact CD1-CG 4.32Å |
| 87 | F | 76.9 | Confident | 76.2 | Confident | 1 Ų | 1 | 49 Ų | 49 | 0% | 0.004 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -67.1 | -33.9 | -179.4 | -72.9 | -68.8 | 0 | 0 | 0 | 113 | T37 Y40 I41 Y44 R83 T84 T85 F89 Y90 F91 F287 L291 | T37-F87 HydrophobicContact CG2-CB 4.44Å; T37-F87 WeakPolarHBondContact CG2-O 3.14Å; Y40-F87 HydrophobicContact CD1-CE2 4.48Å; Y40-F87 HydrophobicContact CD1-CZ 4.3Å; Y40-F87 HydrophobicContact CD2-CE1 4.23Å; Y40-F87 HydrophobicContact CD2-CZ 4.45Å; Y40-F87 HydrophobicContact CG-CE1 4.13Å; Y40-F87 HydrophobicContact CG-CE2 4.35Å; Y40-F87 HydrophobicContact CG-CZ 4.03Å; I41-F87 HydrophobicContact CD1-CB 4.46Å; I41-F87 HydrophobicContact CG1-CB 3.66Å; Y44-F87 AromaticContact CD2-CD2 3.79Å; Y44-F87 HydrophobicContact CD2-CD2 3.79Å; Y44-F87 AromaticContact CD2-CE2 3.7Å; Y44-F87 HydrophobicContact CD2-CE2 3.7Å; Y44-F87 AromaticContact CE2-CD2 3.89Å; Y44-F87 HydrophobicContact CE2-CD2 3.89Å; Y44-F87 AromaticContact CE2-CE2 3.29Å; Y44-F87 HydrophobicContact CE2-CE2 3.29Å; Y44-F87 HydrophobicContact CE2-CZ 4.14Å; R83-F87 WeakPolarHBondContact O-CD2 3.48Å; R83-F87 PolarHBondContact O-N 2.81Å; T84-F87 PolarHBondContact O-N 3.27Å; T85-F87 PolarHBondContact O-N 3.46Å; F87-F89 VanDerWaalsContact C-N 3.35Å; F87-Y90 PolarHBondContact O-N 2.91Å; F87-F91 WeakPolarHBondContact O-CB 3.48Å; F87-F91 PolarHBondContact O-N 3.34Å; F87-F287 HydrophobicContact CE1-CE1 4.33Å; F87-L291 HydrophobicContact CE2-CD1 4.42Å; F87-L291 HydrophobicContact CZ-CD1 3.64Å |
| 88 | S | 80.5 | Confident | 74.3 | Confident | 61 Ų | 61 | 49.6 Ų | 49.6 | 43% | 0.427 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -65.2 | -37.7 | 173.5 | -169.9 | 0 | 0 | 0 | 0 | 112.1 | T84 T85 L86 F91 H92 | T84-S88 WeakPolarHBondContact O-CB 3.19Å; T84-S88 PolarHBondContact O-N 3.37Å; T85-S88 PolarHBondContact O-N 2.88Å; L86-S88 VanDerWaalsContact C-N 3.34Å; L86-S88 PolarHBondContact O-N 2.88Å; S88-F91 WeakPolarHBondContact O-CB 3.34Å; S88-F91 PolarHBondContact O-N 3.49Å; S88-H92 PolarHBondContact O-N 3.29Å |
| 89 | F | 73.1 | Confident | 72.5 | Confident | 110 Ų | 110 | 53 Ų | 53 | 48% | 0.482 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -66.7 | -42.7 | 173.6 | -84.6 | -58.6 | 0 | 0 | 0 | 111.9 | T85 L86 F87 F91 H92 N93 L108 | T85-F89 HydrophobicContact CG2-CD2 3.72Å; T85-F89 HydrophobicContact CG2-CE2 3.49Å; T85-F89 VanDerWaalsContact CG2-CE2 3.49Å; T85-F89 VanDerWaalsContact O-CD2 3.27Å; T85-F89 WeakPolarHBondContact O-CD2 3.44Å; T85-F89 PolarHBondContact O-N 2.89Å; L86-F89 PolarHBondContact O-N 3.44Å; F87-F89 VanDerWaalsContact C-N 3.35Å; F89-F91 PolarHBondContact O-N 3.45Å; F89-H92 PolarHBondContact O-N 3.39Å; F89-H92 VanDerWaalsContact O-N 3.16Å; F89-N93 PolarHBondContact O-N 2.95Å; F89-L108 HydrophobicContact CD2-CD1 4.07Å; F89-L108 HydrophobicContact CE2-CD1 4.35Å |
| 90 | Y | 67.3 | Low | 71 | Confident | 33 Ų | 33 | 55.1 Ų | 55.1 | 13% | 0.129 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -59.6 | -35 | 172.7 | -94 | -79 | 0 | 0 | 0 | 112.9 | L86 F87 T94 A97 N98 Y109 | L86-Y90 HydrophobicContact CD1-CD2 4.38Å; L86-Y90 HydrophobicContact CD1-CE2 4.09Å; L86-Y90 HydrophobicContact CG-CD2 4.19Å; L86-Y90 HydrophobicContact CG-CE2 4.23Å; L86-Y90 WeakPolarHBondContact O-CD2 3.27Å; L86-Y90 PolarHBondContact O-N 2.88Å; F87-Y90 PolarHBondContact O-N 2.91Å; Y90-T94 HydrophobicContact CD1-CG2 4.49Å; Y90-T94 WeakPolarHBondContact O-CG2 3.18Å; Y90-A97 HydrophobicContact CD1-CB 4.47Å; Y90-A97 HydrophobicContact CD2-CB 4.43Å; Y90-A97 HydrophobicContact CE1-CB 4.36Å; Y90-A97 HydrophobicContact CE2-CB 4.33Å; Y90-A97 HydrophobicContact CG-CB 4.5Å; Y90-N98 PolarHBondContact OH-OD1 3.39Å; Y90-Y109 HydrophobicContact CE2-CE1 4.25Å; Y90-Y109 WeakPolarHBondContact CE2-OH 3.43Å; Y90-Y109 VanDerWaalsContact CZ-OH 3.3Å; Y90-Y109 PolarHBondContact OH-OH 2.87Å |
| 91 | F | 67.4 | Low | 69.9 | Low | 100 Ų | 100 | 59.5 Ų | 59.5 | 44% | 0.439 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -67.8 | -35.7 | 176.5 | -171.4 | -92 | 0 | 0 | 0 | 112.6 | L34 T37 I41 F87 S88 F89 | L34-F91 HydrophobicContact CD1-CD2 4.15Å; L34-F91 HydrophobicContact CD1-CE2 3.47Å; L34-F91 VanDerWaalsContact CD1-CE2 3.47Å; L34-F91 HydrophobicContact CD1-CZ 3.85Å; L34-F91 HydrophobicContact CG-CE2 3.73Å; L34-F91 HydrophobicContact CG-CZ 4.32Å; T37-F91 HydrophobicContact CG2-CB 3.89Å; T37-F91 HydrophobicContact CG2-CD2 4.06Å; I41-F91 HydrophobicContact CD1-CB 3.92Å; I41-F91 HydrophobicContact CD1-CD2 4.29Å; I41-F91 HydrophobicContact CD1-CG 4.22Å; F87-F91 WeakPolarHBondContact O-CB 3.48Å; F87-F91 PolarHBondContact O-N 3.34Å; S88-F91 WeakPolarHBondContact O-CB 3.34Å; S88-F91 PolarHBondContact O-N 3.49Å; F89-F91 PolarHBondContact O-N 3.45Å |
| 92 | H | 62 | Low | 68.8 | Low | 145 Ų | 145 | 61.3 Ų | 61.3 | 67% | 0.671 | 33% | 0.33 | S | S | * | . | H | α-helix | trans | -85.3 | -47.9 | -176.2 | -162.1 | 66.2 | 0 | 0 | 0 | 112.9 | S88 F89 | S88-H92 PolarHBondContact O-N 3.29Å; F89-H92 PolarHBondContact O-N 3.39Å; F89-H92 VanDerWaalsContact O-N 3.16Å |
| 93 | N | 64.9 | Low | 68 | Low | 77 Ų | 77 | 64.2 Ų | 64.2 | 41% | 0.412 | 36% | 0.357 | S | S | . | . | trans | -150.4 | 98.9 | -176.5 | -80.8 | -34.7 | 0 | 0 | 0 | 111.7 | F89 A95 Q96 A97 | F89-N93 PolarHBondContact O-N 2.95Å; N93-A95 PolarHBondContact O-N 3.38Å; N93-Q96 HydrophobicContact CB-CB 4.03Å; N93-Q96 PolarHBondContact O-N 2.94Å; N93-A97 PolarHBondContact O-N 3.45Å | ||
| 94 | T | 58.3 | Low | 67.4 | Low | 76 Ų | 76 | 65.7 Ų | 65.7 | 47% | 0.466 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -63.5 | -40.2 | 178.6 | 53.3 | 0 | 0 | 0 | 0 | 112.9 | Y90 Q96 A97 | Y90-T94 HydrophobicContact CD1-CG2 4.49Å; Y90-T94 WeakPolarHBondContact O-CG2 3.18Å; T94-Q96 PolarHBondContact O-N 2.97Å; T94-A97 PolarHBondContact O-N 2.86Å |
| 95 | A | 50.3 | Low | 66.6 | Low | 71 Ų | 71 | 66.1 Ų | 66.1 | 59% | 0.587 | 37% | 0.368 | S | S | * | . | H | α-helix | trans | -68.7 | -32.7 | -178.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | N93 H99 | N93-A95 PolarHBondContact O-N 3.38Å; A95-H99 PolarHBondContact O-CD2 3.01Å |
| 96 | Q | 52.9 | Low | 66.1 | Low | 125 Ų | 125 | 66.5 Ų | 66.5 | 58% | 0.584 | 36% | 0.363 | S | S | * | . | H | α-helix | trans | -82.4 | -29 | -179.6 | -163.6 | 175.4 | 11.4 | 0 | 0 | 112.2 | N93 T94 N98 H99 | N93-Q96 HydrophobicContact CB-CB 4.03Å; N93-Q96 PolarHBondContact O-N 2.94Å; T94-Q96 PolarHBondContact O-N 2.97Å; Q96-N98 PolarHBondContact O-N 2.88Å; Q96-H99 CarbonylContact O-C 3.54Å; Q96-H99 PolarHBondContact O-N 2.92Å; Q96-H99 VanDerWaalsContact O-N 3.1Å |
| 97 | A | 52.7 | Low | 66.2 | Low | 4 Ų | 4 | 70.1 Ų | 70.1 | 3% | 0.033 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -59.4 | -33.2 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | Y90 N93 T94 L100 | Y90-A97 HydrophobicContact CD1-CB 4.47Å; Y90-A97 HydrophobicContact CD2-CB 4.43Å; Y90-A97 HydrophobicContact CE1-CB 4.36Å; Y90-A97 HydrophobicContact CE2-CB 4.33Å; Y90-A97 HydrophobicContact CG-CB 4.5Å; N93-A97 PolarHBondContact O-N 3.45Å; T94-A97 PolarHBondContact O-N 2.86Å; A97-L100 WeakPolarHBondContact O-CD1 3.46Å; A97-L100 WeakPolarHBondContact O-CG 3.33Å |
| 98 | N | 54.4 | Low | 66.2 | Low | 36 Ų | 36 | 70.6 Ų | 70.6 | 19% | 0.193 | 38% | 0.384 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -80.3 | -13.6 | 178.3 | -70.8 | -9.4 | 0 | 0 | 0 | 113.8 | Y90 Q96 D274 | Y90-N98 PolarHBondContact OH-OD1 3.39Å; Q96-N98 PolarHBondContact O-N 2.88Å; N98-D274 PolarHBondContact ND2-OD2 2.93Å |
| 99 | H | 55.2 | Low | 65.8 | Low | 149 Ų | 149 | 67.9 Ų | 67.9 | 69% | 0.69 | 37% | 0.365 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -117.6 | 38.1 | -178.8 | -68.4 | -61.8 | 0 | 0 | 0 | 112.7 | A95 Q96 | A95-H99 PolarHBondContact O-CD2 3.01Å; Q96-H99 CarbonylContact O-C 3.54Å; Q96-H99 PolarHBondContact O-N 2.92Å; Q96-H99 VanDerWaalsContact O-N 3.1Å |
| 100 | L | 61.1 | Low | 66 | Low | 45 Ų | 45 | 62.6 Ų | 62.6 | 24% | 0.236 | 34% | 0.342 | C | S | . | . | trans | -74.7 | 146.4 | 176.5 | -73.3 | 170.3 | 0 | 0 | 0 | 111.6 | A97 A104 F105 L108 Y109 | A97-L100 WeakPolarHBondContact O-CD1 3.46Å; A97-L100 WeakPolarHBondContact O-CG 3.33Å; L100-A104 HydrophobicContact CB-CB 4.2Å; L100-A104 HydrophobicContact CD2-CB 4.37Å; L100-F105 HydrophobicContact CB-CB 4.49Å; L100-L108 HydrophobicContact CD1-CD1 3.88Å; L100-Y109 HydrophobicContact CD1-CE2 4.48Å | ||
| 101 | P | 69.9 | Low | 66.8 | Low | 93 Ų | 93 | 61.6 Ų | 61.6 | 60% | 0.604 | 34% | 0.339 | S | S | * | . | trans | -59.4 | 148.6 | 170.9 | 23.8 | -31.3 | 0 | 0 | 0 | 110.5 | A103 A104 F105 | P101-A103 PolarHBondContact O-N 2.96Å; P101-A104 HydrophobicContact CG-CB 4.03Å; P101-A104 WeakPolarHBondContact O-CA 3.24Å; P101-A104 WeakPolarHBondContact O-CB 3.4Å; P101-A104 PolarHBondContact O-N 2.97Å; P101-F105 PolarHBondContact O-N 2.66Å | ||
| 102 | T | 68.8 | Low | 67.7 | Low | 53 Ų | 53 | 56.8 Ų | 56.8 | 33% | 0.325 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -45.6 | -42.9 | -171.7 | -28.4 | 0 | 0 | 0 | 0 | 114 | F105 W106 E168 | T102-F105 PolarHBondContact O-N 3.44Å; T102-W106 WeakPolarHBondContact O-CB 3.31Å; T102-W106 PolarHBondContact O-N 2.58Å; T102-E168 WeakPolarHBondContact CB-OE1 3.48Å; T102-E168 VanDerWaalsContact CG2-CD 3.47Å; T102-E168 WeakPolarHBondContact CG2-OE1 3.42Å; T102-E168 WeakPolarHBondContact CG2-OE2 3.33Å; T102-E168 PolarHBondContact OG1-OE1 2.9Å; T102-E168 PolarHBondContact OG1-OE2 2.99Å |
| 103 | A | 71.4 | Confident | 68.8 | Low | 78 Ų | 78 | 50.1 Ų | 50.1 | 65% | 0.645 | 29% | 0.287 | S | S | * | . | H | α-helix | trans | -67.5 | -41.1 | -179.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | P101 L107 | P101-A103 PolarHBondContact O-N 2.96Å; A103-L107 VanDerWaalsContact O-CB 3.24Å; A103-L107 WeakPolarHBondContact O-CB 3.28Å; A103-L107 PolarHBondContact O-N 2.86Å |
| 104 | A | 73.5 | Confident | 70 | Confident | 30 Ų | 30 | 46.5 Ų | 46.5 | 25% | 0.248 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -70.4 | -37.6 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.1 | L100 P101 L107 L108 | L100-A104 HydrophobicContact CB-CB 4.2Å; L100-A104 HydrophobicContact CD2-CB 4.37Å; P101-A104 HydrophobicContact CG-CB 4.03Å; P101-A104 WeakPolarHBondContact O-CA 3.24Å; P101-A104 WeakPolarHBondContact O-CB 3.4Å; P101-A104 PolarHBondContact O-N 2.97Å; A104-L107 PolarHBondContact O-N 2.88Å; A104-L108 WeakPolarHBondContact O-CB 3.48Å; A104-L108 WeakPolarHBondContact O-CG 3.39Å; A104-L108 PolarHBondContact O-N 3.4Å |
| 105 | F | 71.9 | Confident | 71.6 | Confident | 40 Ų | 40 | 43.4 Ų | 43.4 | 18% | 0.175 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -61.4 | -50 | 172.9 | -179 | -94.7 | 0 | 0 | 0 | 111.6 | L100 P101 T102 L107 L108 Y109 Y267 | L100-F105 HydrophobicContact CB-CB 4.49Å; P101-F105 PolarHBondContact O-N 2.66Å; T102-F105 PolarHBondContact O-N 3.44Å; F105-L107 VanDerWaalsContact C-N 3.32Å; F105-L107 PolarHBondContact O-N 2.68Å; F105-L108 PolarHBondContact O-N 2.81Å; F105-Y109 AromaticContact CD2-CD2 3.53Å; F105-Y109 HydrophobicContact CD2-CD2 3.53Å; F105-Y109 AromaticContact CD2-CE2 3.75Å; F105-Y109 HydrophobicContact CD2-CE2 3.75Å; F105-Y109 HydrophobicContact CD2-CG 4.28Å; F105-Y109 AromaticContact CE2-CD2 3.68Å; F105-Y109 HydrophobicContact CE2-CD2 3.68Å; F105-Y109 AromaticContact CE2-CE2 3.95Å; F105-Y109 HydrophobicContact CE2-CE2 3.95Å; F105-Y109 HydrophobicContact CE2-CG 4.01Å; F105-Y109 HydrophobicContact CG-CD2 4.17Å; F105-Y109 HydrophobicContact CZ-CD2 4.43Å; F105-Y109 HydrophobicContact CZ-CG 4.41Å; F105-Y109 WeakPolarHBondContact O-CB 3.45Å; F105-Y109 WeakPolarHBondContact O-CD2 3.14Å; F105-Y109 PolarHBondContact O-N 2.67Å; F105-Y267 AromaticContact CE1-CD1 3.59Å; F105-Y267 HydrophobicContact CE1-CD1 3.59Å; F105-Y267 HydrophobicContact CE1-CE1 4.49Å; F105-Y267 AromaticContact CE1-CG 3.64Å; F105-Y267 HydrophobicContact CE1-CG 3.64Å; F105-Y267 HydrophobicContact CZ-CD1 4.27Å; F105-Y267 HydrophobicContact CZ-CG 4.26Å |
| 106 | W | 76.3 | Confident | 73.6 | Confident | 67 Ų | 67 | 40.2 Ų | 40.2 | 25% | 0.254 | 22% | 0.222 | S | C | . | . | I | π-helix | trans | -59 | -44 | 175.7 | -178 | 83.1 | 0 | 0 | 0 | 111.9 | T102 C110 S111 L157 V161 A164 | T102-W106 WeakPolarHBondContact O-CB 3.31Å; T102-W106 PolarHBondContact O-N 2.58Å; W106-C110 HydrophobicContact CG-CB 4.08Å; W106-C110 CarbonylContact O-C 3.52Å; W106-C110 WeakPolarHBondContact O-CA 3.43Å; W106-C110 VanDerWaalsContact O-CB 3.26Å; W106-C110 WeakPolarHBondContact O-CB 3.11Å; W106-C110 PolarHBondContact O-N 3.05Å; W106-S111 PolarHBondContact O-N 3.43Å; W106-L157 HydrophobicContact CZ2-CD1 4.19Å; W106-V161 HydrophobicContact CZ2-CG2 3.67Å; W106-A164 VanDerWaalsContact CD1-CB 3.44Å; W106-A164 HydrophobicContact CG-CB 4.3Å |
| 107 | L | 81 | Confident | 75.5 | Confident | 78 Ų | 78 | 34.3 Ų | 34.3 | 41% | 0.408 | 19% | 0.194 | S | C | . | . | I | π-helix | trans | -66.2 | -39.2 | -177.9 | -175.4 | 64.4 | 0 | 0 | 0 | 112.8 | L82 A103 A104 F105 S111 | L82-L107 HydrophobicContact CD1-CD1 4.44Å; L82-L107 HydrophobicContact CD2-CD1 4.05Å; L82-L107 HydrophobicContact CD2-CD2 4.4Å; L82-L107 HydrophobicContact CD2-CG 3.82Å; A103-L107 VanDerWaalsContact O-CB 3.24Å; A103-L107 WeakPolarHBondContact O-CB 3.28Å; A103-L107 PolarHBondContact O-N 2.86Å; A104-L107 PolarHBondContact O-N 2.88Å; F105-L107 VanDerWaalsContact C-N 3.32Å; F105-L107 PolarHBondContact O-N 2.68Å; L107-S111 WeakPolarHBondContact O-CB 3.32Å |
| 108 | L | 77.5 | Confident | 77.5 | Confident | 12 Ų | 12 | 36.3 Ų | 36.3 | 6% | 0.063 | 20% | 0.202 | C | C | . | . | I | π-helix | trans | -89.4 | -29.3 | -174.9 | -68.5 | 176.2 | 0 | 0 | 0 | 113.9 | L82 T85 L86 F89 L100 A104 F105 P112 | L82-L108 HydrophobicContact CD2-CD2 4.2Å; T85-L108 HydrophobicContact CG2-CD2 3.98Å; L86-L108 HydrophobicContact CD1-CB 3.81Å; F89-L108 HydrophobicContact CD2-CD1 4.07Å; F89-L108 HydrophobicContact CE2-CD1 4.35Å; L100-L108 HydrophobicContact CD1-CD1 3.88Å; A104-L108 WeakPolarHBondContact O-CB 3.48Å; A104-L108 WeakPolarHBondContact O-CG 3.39Å; A104-L108 PolarHBondContact O-N 3.4Å; F105-L108 PolarHBondContact O-N 2.81Å; L108-P112 WeakPolarHBondContact O-CG 3.47Å |
| 109 | Y | 71.9 | Confident | 79.3 | Confident | 3 Ų | 3 | 34.7 Ų | 34.7 | 1% | 0.012 | 19% | 0.194 | C | C | . | . | I | π-helix | trans | -103.8 | -49.2 | -178.6 | -66.2 | -92.6 | 0 | 0 | 0 | 112.2 | L86 Y90 L100 F105 D271 | L86-Y109 HydrophobicContact CD1-CD1 4.16Å; L86-Y109 HydrophobicContact CD1-CD2 4.07Å; L86-Y109 HydrophobicContact CD1-CE1 3.79Å; L86-Y109 HydrophobicContact CD1-CE2 3.65Å; L86-Y109 HydrophobicContact CD1-CG 4.32Å; Y90-Y109 HydrophobicContact CE2-CE1 4.25Å; Y90-Y109 WeakPolarHBondContact CE2-OH 3.43Å; Y90-Y109 VanDerWaalsContact CZ-OH 3.3Å; Y90-Y109 PolarHBondContact OH-OH 2.87Å; L100-Y109 HydrophobicContact CD1-CE2 4.48Å; F105-Y109 AromaticContact CD2-CD2 3.53Å; F105-Y109 HydrophobicContact CD2-CD2 3.53Å; F105-Y109 AromaticContact CD2-CE2 3.75Å; F105-Y109 HydrophobicContact CD2-CE2 3.75Å; F105-Y109 HydrophobicContact CD2-CG 4.28Å; F105-Y109 AromaticContact CE2-CD2 3.68Å; F105-Y109 HydrophobicContact CE2-CD2 3.68Å; F105-Y109 AromaticContact CE2-CE2 3.95Å; F105-Y109 HydrophobicContact CE2-CE2 3.95Å; F105-Y109 HydrophobicContact CE2-CG 4.01Å; F105-Y109 HydrophobicContact CG-CD2 4.17Å; F105-Y109 HydrophobicContact CZ-CD2 4.43Å; F105-Y109 HydrophobicContact CZ-CG 4.41Å; F105-Y109 WeakPolarHBondContact O-CB 3.45Å; F105-Y109 WeakPolarHBondContact O-CD2 3.14Å; F105-Y109 PolarHBondContact O-N 2.67Å; Y109-D271 HydrophobicContact CD1-CB 3.92Å |
| 110 | C | 76.5 | Confident | 81.1 | Confident | 0 Ų | 0 | 28.1 Ų | 28.1 | 0% | 0 | 16% | 0.163 | C | C | . | . | I | π-helix | trans | -84.3 | -37.9 | -173.2 | -167.7 | 0 | 0 | 0 | 0 | 113.9 | W106 V113 C114 Y267 | W106-C110 HydrophobicContact CG-CB 4.08Å; W106-C110 CarbonylContact O-C 3.52Å; W106-C110 WeakPolarHBondContact O-CA 3.43Å; W106-C110 VanDerWaalsContact O-CB 3.26Å; W106-C110 WeakPolarHBondContact O-CB 3.11Å; W106-C110 PolarHBondContact O-N 3.05Å; C110-V113 PolarHBondContact O-N 2.98Å; C110-C114 PolarHBondContact O-N 2.88Å; C110-C114 PolarHBondContact O-SG 3.37Å; C110-Y267 HydrophobicContact CB-CE1 3.94Å |
| 111 | S | 84.7 | Confident | 82.6 | Confident | 11 Ų | 11 | 26.2 Ų | 26.2 | 8% | 0.077 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -61.1 | -43.1 | -177.9 | -165.9 | 0 | 0 | 0 | 0 | 113.4 | W106 L107 V113 C114 L115 | W106-S111 PolarHBondContact O-N 3.43Å; L107-S111 WeakPolarHBondContact O-CB 3.32Å; S111-V113 VanDerWaalsContact C-N 3.27Å; S111-V113 PolarHBondContact O-N 2.87Å; S111-C114 WeakPolarHBondContact O-CA 3.39Å; S111-C114 WeakPolarHBondContact O-CB 3.29Å; S111-C114 PolarHBondContact O-N 3.42Å; S111-L115 WeakPolarHBondContact O-CG 3.16Å; S111-L115 PolarHBondContact O-N 2.91Å |
| 112 | P | 86.8 | Confident | 83.7 | Confident | 0 Ų | 0 | 22.8 Ų | 22.8 | 0% | 0 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -55 | -39.7 | 177.6 | -28.2 | 36.4 | 0 | 0 | 0 | 113.6 | W79 L82 R83 L108 C114 L115 Q116 | W79-P112 VanDerWaalsContact CD1-O 3.23Å; L82-P112 HydrophobicContact CB-CG 4.08Å; L82-P112 HydrophobicContact CD1-CG 4.41Å; R83-P112 HydrophobicContact CG-CB 4.28Å; L108-P112 WeakPolarHBondContact O-CG 3.47Å; P112-C114 VanDerWaalsContact C-N 3.35Å; P112-C114 PolarHBondContact O-N 3.25Å; P112-L115 PolarHBondContact O-N 3.05Å; P112-Q116 WeakPolarHBondContact O-CB 2.87Å; P112-Q116 PolarHBondContact O-N 3.36Å |
| 113 | V | 84.9 | Confident | 84.7 | Confident | 4 Ų | 4 | 20.5 Ų | 20.5 | 2% | 0.024 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -66.4 | -39.1 | 178 | -175.3 | 0 | 0 | 0 | 0 | 111.2 | C110 S111 Q116 F117 F156 F194 | C110-V113 PolarHBondContact O-N 2.98Å; S111-V113 VanDerWaalsContact C-N 3.27Å; S111-V113 PolarHBondContact O-N 2.87Å; V113-Q116 PolarHBondContact O-N 2.87Å; V113-F117 PolarHBondContact O-N 3.15Å; V113-F156 HydrophobicContact CG1-CE1 4.43Å; V113-F156 HydrophobicContact CG1-CZ 4.01Å; V113-F194 HydrophobicContact CG1-CE2 4.23Å; V113-F194 HydrophobicContact CG1-CZ 4.43Å |
| 114 | C | 90.7 | Very high | 85.7 | Confident | 2 Ų | 2 | 16.8 Ų | 16.8 | 1% | 0.014 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -64.7 | -43.2 | 174.7 | -59 | 0 | 0 | 0 | 0 | 111.7 | C110 S111 P112 Q116 F117 F118 F156 | C110-C114 PolarHBondContact O-N 2.88Å; C110-C114 PolarHBondContact O-SG 3.37Å; S111-C114 WeakPolarHBondContact O-CA 3.39Å; S111-C114 WeakPolarHBondContact O-CB 3.29Å; S111-C114 PolarHBondContact O-N 3.42Å; P112-C114 VanDerWaalsContact C-N 3.35Å; P112-C114 PolarHBondContact O-N 3.25Å; C114-Q116 VanDerWaalsContact C-N 3.33Å; C114-Q116 PolarHBondContact O-N 3.35Å; C114-F117 PolarHBondContact O-N 2.99Å; C114-F118 HydrophobicContact CB-CE2 4.33Å; C114-F118 HydrophobicContact CB-CZ 4.35Å; C114-F118 WeakPolarHBondContact O-CD1 3.24Å; C114-F118 WeakPolarHBondContact O-CD2 3.29Å; C114-F118 WeakPolarHBondContact O-CG 3.28Å; C114-F118 PolarHBondContact O-N 3.38Å; C114-F156 HydrophobicContact CB-CE1 4.31Å |
| 115 | L | 91.4 | Very high | 86.6 | Confident | 10 Ų | 10 | 16.3 Ų | 16.3 | 5% | 0.052 | 8% | 0.078 | C | C | . | . | H | α-helix | trans | -62.9 | -41.6 | 176.4 | -64.8 | 173.2 | 0 | 0 | 0 | 111.4 | L75 L78 W79 L82 S111 P112 F117 F118 T119 | L75-L115 HydrophobicContact CD2-CD2 3.82Å; L78-L115 HydrophobicContact CB-CD1 4.05Å; L78-L115 HydrophobicContact CD2-CD1 3.71Å; L78-L115 HydrophobicContact CD2-CD2 3.75Å; L78-L115 HydrophobicContact CD2-CG 4.38Å; L78-L115 HydrophobicContact CG-CD1 3.62Å; L78-L115 HydrophobicContact CG-CD2 4.5Å; W79-L115 HydrophobicContact CB-CB 4.08Å; W79-L115 HydrophobicContact CB-CD1 4.1Å; L82-L115 HydrophobicContact CD1-CD1 3.65Å; S111-L115 WeakPolarHBondContact O-CG 3.16Å; S111-L115 PolarHBondContact O-N 2.91Å; P112-L115 PolarHBondContact O-N 3.05Å; L115-F117 VanDerWaalsContact C-N 3.35Å; L115-F117 PolarHBondContact O-N 2.95Å; L115-F118 HydrophobicContact CD2-CD2 4.45Å; L115-F118 PolarHBondContact O-N 2.9Å; L115-T119 WeakPolarHBondContact O-CG2 3.22Å; L115-T119 PolarHBondContact O-N 3.17Å; L115-T119 PolarHBondContact O-OG1 3.35Å |
| 116 | Q | 91.5 | Very high | 87.5 | Confident | 5 Ų | 5 | 15.7 Ų | 15.7 | 2% | 0.023 | 8% | 0.075 | C | C | . | . | H | α-helix | trans | -59.3 | -46.9 | 174.4 | -170.5 | -174.3 | 1.2 | 0 | 0 | 110.8 | P112 V113 C114 F118 T119 F120 W294 | P112-Q116 WeakPolarHBondContact O-CB 2.87Å; P112-Q116 PolarHBondContact O-N 3.36Å; V113-Q116 PolarHBondContact O-N 2.87Å; C114-Q116 VanDerWaalsContact C-N 3.33Å; C114-Q116 PolarHBondContact O-N 3.35Å; Q116-F118 PolarHBondContact O-N 3Å; Q116-T119 PolarHBondContact O-N 2.95Å; Q116-T119 PolarHBondContact O-OG1 3.21Å; Q116-F120 PolarHBondContact O-N 3.4Å; Q116-W294 PolarHBondContact NE2-O 3.48Å |
| 117 | F | 93.2 | Very high | 88 | Confident | 0 Ų | 0 | 13 Ų | 13 | 0% | 0 | 7% | 0.065 | C | C | . | . | H | α-helix | trans | -59.3 | -46.3 | 175.9 | -173.9 | -94.4 | 0 | 0 | 0 | 111.9 | V113 C114 L115 T119 F120 S121 M152 F156 L193 F194 E197 | V113-F117 PolarHBondContact O-N 3.15Å; C114-F117 PolarHBondContact O-N 2.99Å; L115-F117 VanDerWaalsContact C-N 3.35Å; L115-F117 PolarHBondContact O-N 2.95Å; F117-T119 PolarHBondContact O-N 3.15Å; F117-F120 PolarHBondContact O-N 2.93Å; F117-S121 WeakPolarHBondContact O-CB 3.48Å; F117-S121 PolarHBondContact O-N 3.44Å; F117-M152 HydrophobicContact CZ-CB 4.38Å; F117-F156 HydrophobicContact CB-CD1 3.96Å; F117-F156 HydrophobicContact CB-CD2 4.26Å; F117-F156 HydrophobicContact CB-CE1 3.84Å; F117-F156 HydrophobicContact CB-CE2 4.13Å; F117-F156 HydrophobicContact CB-CG 4.2Å; F117-F156 HydrophobicContact CB-CZ 3.93Å; F117-F156 HydrophobicContact CD1-CB 3.84Å; F117-F156 HydrophobicContact CD1-CD1 4.14Å; F117-F156 HydrophobicContact CD1-CD2 4.02Å; F117-F156 AromaticContact CD1-CG 3.73Å; F117-F156 HydrophobicContact CD1-CG 3.73Å; F117-F156 AromaticContact CD2-CD2 3.65Å; F117-F156 HydrophobicContact CD2-CD2 3.65Å; F117-F156 AromaticContact CD2-CE2 3.76Å; F117-F156 HydrophobicContact CD2-CE2 3.76Å; F117-F156 HydrophobicContact CD2-CG 4.2Å; F117-F156 HydrophobicContact CD2-CZ 4.4Å; F117-F156 HydrophobicContact CE1-CB 3.93Å; F117-F156 HydrophobicContact CE1-CD2 4.34Å; F117-F156 HydrophobicContact CE1-CG 4.19Å; F117-F156 AromaticContact CE2-CD2 3.98Å; F117-F156 HydrophobicContact CE2-CD2 3.98Å; F117-F156 HydrophobicContact CE2-CE2 4.41Å; F117-F156 HydrophobicContact CG-CB 4.35Å; F117-F156 HydrophobicContact CG-CD1 4.02Å; F117-F156 AromaticContact CG-CD2 3.67Å; F117-F156 HydrophobicContact CG-CD2 3.67Å; F117-F156 HydrophobicContact CG-CE1 4.27Å; F117-F156 AromaticContact CG-CE2 3.92Å; F117-F156 HydrophobicContact CG-CE2 3.92Å; F117-F156 AromaticContact CG-CG 3.74Å; F117-F156 HydrophobicContact CG-CG 3.74Å; F117-F156 HydrophobicContact CG-CZ 4.22Å; F117-F156 HydrophobicContact CZ-CB 4.49Å; F117-F156 HydrophobicContact CZ-CD2 4.32Å; F117-L193 HydrophobicContact CE2-CB 3.72Å; F117-L193 HydrophobicContact CZ-CB 4.09Å; F117-F194 HydrophobicContact CB-CE1 4.1Å; F117-F194 HydrophobicContact CB-CZ 3.78Å; F117-F194 HydrophobicContact CD2-CD1 4.05Å; F117-F194 HydrophobicContact CD2-CD2 4.43Å; F117-F194 AromaticContact CD2-CE1 3.86Å; F117-F194 HydrophobicContact CD2-CE1 3.86Å; F117-F194 HydrophobicContact CD2-CE2 4.25Å; F117-F194 HydrophobicContact CD2-CG 4.32Å; F117-F194 AromaticContact CD2-CZ 3.97Å; F117-F194 HydrophobicContact CD2-CZ 3.97Å; F117-F194 HydrophobicContact CG-CE1 4.49Å; F117-F194 HydrophobicContact CG-CZ 4.4Å; F117-E197 HydrophobicContact CE2-CG 3.75Å; F117-E197 HydrophobicContact CZ-CG 3.9Å |
| 118 | F | 94.8 | Very high | 88.5 | Confident | 46 Ų | 46 | 10.1 Ų | 10.1 | 20% | 0.202 | 5% | 0.051 | C | C | . | . | H | α-helix | trans | -62.5 | -40.2 | 178.2 | -60.5 | -21.7 | 0 | 0 | 0 | 112.7 | L75 C114 L115 Q116 F120 L122 S153 L157 | L75-F118 HydrophobicContact CD1-CB 4.05Å; L75-F118 HydrophobicContact CD2-CB 4.37Å; L75-F118 HydrophobicContact CD2-CD2 4.49Å; C114-F118 HydrophobicContact CB-CE2 4.33Å; C114-F118 HydrophobicContact CB-CZ 4.35Å; C114-F118 WeakPolarHBondContact O-CD1 3.24Å; C114-F118 WeakPolarHBondContact O-CD2 3.29Å; C114-F118 WeakPolarHBondContact O-CG 3.28Å; C114-F118 PolarHBondContact O-N 3.38Å; L115-F118 HydrophobicContact CD2-CD2 4.45Å; L115-F118 PolarHBondContact O-N 2.9Å; Q116-F118 PolarHBondContact O-N 3Å; F118-F120 VanDerWaalsContact C-N 3.31Å; F118-F120 PolarHBondContact O-N 2.9Å; F118-L122 WeakPolarHBondContact O-CB 3.27Å; F118-L122 PolarHBondContact O-N 3.41Å; F118-S153 WeakPolarHBondContact CE1-O 3.39Å; F118-L157 HydrophobicContact CZ-CB 4.05Å; F118-L157 HydrophobicContact CZ-CD1 4.21Å; F118-L157 HydrophobicContact CZ-CD2 4.32Å; F118-L157 HydrophobicContact CZ-CG 4.42Å |
| 119 | T | 92.8 | Very high | 89.1 | Confident | 2 Ų | 2 | 10.7 Ų | 10.7 | 1% | 0.012 | 5% | 0.053 | C | C | . | . | H | α-helix | trans | -61.3 | -42.5 | 175.2 | 58.2 | 0 | 0 | 0 | 0 | 111.5 | L75 L115 Q116 F117 L122 I123 | L75-T119 HydrophobicContact CB-CG2 3.47Å; L75-T119 VanDerWaalsContact CB-CG2 3.47Å; L75-T119 HydrophobicContact CD1-CG2 4.17Å; L75-T119 HydrophobicContact CG-CG2 4.46Å; L115-T119 WeakPolarHBondContact O-CG2 3.22Å; L115-T119 PolarHBondContact O-N 3.17Å; L115-T119 PolarHBondContact O-OG1 3.35Å; Q116-T119 PolarHBondContact O-N 2.95Å; Q116-T119 PolarHBondContact O-OG1 3.21Å; F117-T119 PolarHBondContact O-N 3.15Å; T119-L122 PolarHBondContact O-N 3.29Å; T119-I123 WeakPolarHBondContact O-CD1 3.48Å; T119-I123 WeakPolarHBondContact O-CG1 3.14Å; T119-I123 PolarHBondContact O-N 3.24Å; T119-I123 VanDerWaalsContact O-N 3.14Å |
| 120 | F | 92.1 | Very high | 89.8 | Confident | 12 Ų | 12 | 12.7 Ų | 12.7 | 5% | 0.053 | 7% | 0.065 | C | C | . | . | H | α-helix | trans | -69.3 | -45.2 | -179.2 | -163.5 | -129.9 | 0 | 0 | 0 | 111.7 | Q116 F117 F118 L122 I123 N124 E197 A198 L201 V236 F240 L302 | Q116-F120 PolarHBondContact O-N 3.4Å; F117-F120 PolarHBondContact O-N 2.93Å; F118-F120 VanDerWaalsContact C-N 3.31Å; F118-F120 PolarHBondContact O-N 2.9Å; F120-L122 VanDerWaalsContact C-N 3.33Å; F120-L122 PolarHBondContact O-N 3.34Å; F120-I123 PolarHBondContact O-N 3.24Å; F120-N124 PolarHBondContact O-N 3.21Å; F120-E197 HydrophobicContact CD1-CB 3.42Å; F120-E197 VanDerWaalsContact CD1-CB 3.42Å; F120-E197 HydrophobicContact CD1-CG 4.29Å; F120-E197 VanDerWaalsContact CE1-C 3.5Å; F120-E197 HydrophobicContact CE1-CB 3.39Å; F120-A198 HydrophobicContact CE1-CB 4.32Å; F120-A198 HydrophobicContact CZ-CB 4.33Å; F120-L201 HydrophobicContact CD2-CD2 4.48Å; F120-L201 HydrophobicContact CE2-CD2 3.44Å; F120-L201 VanDerWaalsContact CE2-CD2 3.44Å; F120-L201 HydrophobicContact CZ-CB 4.36Å; F120-L201 HydrophobicContact CZ-CD2 3.79Å; F120-V236 HydrophobicContact CZ-CG1 4.15Å; F120-F240 HydrophobicContact CD1-CZ 4.47Å; F120-F240 AromaticContact CE1-CE2 3.81Å; F120-F240 HydrophobicContact CE1-CE2 3.81Å; F120-F240 HydrophobicContact CE1-CZ 4.2Å; F120-F240 HydrophobicContact CE2-CE2 4.37Å; F120-F240 AromaticContact CZ-CE2 3.75Å; F120-F240 HydrophobicContact CZ-CE2 3.75Å; F120-F240 HydrophobicContact CZ-CZ 4.36Å; F120-L302 HydrophobicContact CD2-CD1 4.28Å |
| 121 | S | 94.3 | Very high | 90.3 | Very high | 4 Ų | 4 | 14.3 Ų | 14.3 | 3% | 0.028 | 7% | 0.072 | C | C | . | . | H | α-helix | trans | -61.6 | -39.8 | 175.7 | -159.4 | 0 | 0 | 0 | 0 | 112.1 | F117 I123 N124 L125 Y149 E197 | F117-S121 WeakPolarHBondContact O-CB 3.48Å; F117-S121 PolarHBondContact O-N 3.44Å; S121-I123 PolarHBondContact O-N 3.46Å; S121-N124 PolarHBondContact O-N 2.98Å; S121-L125 WeakPolarHBondContact O-CB 3.43Å; S121-L125 PolarHBondContact O-N 3.49Å; S121-Y149 WeakPolarHBondContact OG-CD1 3.42Å; S121-E197 VanDerWaalsContact CB-OE1 3.23Å; S121-E197 WeakPolarHBondContact CB-OE1 3.37Å; S121-E197 PolarHBondContact OG-OE1 3.15Å |
| 122 | L | 92.3 | Very high | 90.5 | Very high | 21 Ų | 21 | 15.1 Ų | 15.1 | 11% | 0.11 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -63 | -41.1 | 176.1 | -173 | 68.2 | 0 | 0 | 0 | 112.1 | Y68 L71 F72 L75 F118 T119 F120 Y126 | Y68-L122 HydrophobicContact CD1-CD1 3.63Å; Y68-L122 HydrophobicContact CD1-CG 4.29Å; Y68-L122 HydrophobicContact CE1-CD1 3.98Å; L71-L122 HydrophobicContact CB-CD2 4.08Å; L71-L122 HydrophobicContact CD2-CD1 3.92Å; L71-L122 HydrophobicContact CD2-CD2 4.04Å; L71-L122 HydrophobicContact CG-CD2 3.92Å; F72-L122 HydrophobicContact CB-CD2 3.9Å; L75-L122 HydrophobicContact CD1-CD2 4.16Å; F118-L122 WeakPolarHBondContact O-CB 3.27Å; F118-L122 PolarHBondContact O-N 3.41Å; T119-L122 PolarHBondContact O-N 3.29Å; F120-L122 VanDerWaalsContact C-N 3.33Å; F120-L122 PolarHBondContact O-N 3.34Å; L122-Y126 WeakPolarHBondContact O-CB 3.49Å; L122-Y126 PolarHBondContact O-N 2.96Å |
| 123 | I | 89.9 | Confident | 90.5 | Very high | 5 Ų | 5 | 22 Ų | 22 | 3% | 0.026 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -67 | -43.3 | 176.4 | -73.1 | 163.6 | 0 | 0 | 0 | 111 | F72 T119 F120 S121 Y126 F127 L201 L302 F306 | F72-I123 HydrophobicContact CD2-CD1 3.84Å; F72-I123 HydrophobicContact CD2-CG1 4.05Å; F72-I123 HydrophobicContact CE2-CD1 3.38Å; F72-I123 HydrophobicContact CE2-CG1 4.1Å; F72-I123 HydrophobicContact CZ-CD1 4.18Å; T119-I123 WeakPolarHBondContact O-CD1 3.48Å; T119-I123 WeakPolarHBondContact O-CG1 3.14Å; T119-I123 PolarHBondContact O-N 3.24Å; T119-I123 VanDerWaalsContact O-N 3.14Å; F120-I123 PolarHBondContact O-N 3.24Å; S121-I123 PolarHBondContact O-N 3.46Å; I123-Y126 WeakPolarHBondContact O-CB 3.38Å; I123-Y126 PolarHBondContact O-N 2.86Å; I123-F127 HydrophobicContact CG2-CD2 3.62Å; I123-F127 HydrophobicContact CG2-CE2 3.49Å; I123-F127 VanDerWaalsContact CG2-CE2 3.49Å; I123-F127 VanDerWaalsContact O-CD2 3.3Å; I123-F127 WeakPolarHBondContact O-CD2 3.27Å; I123-F127 PolarHBondContact O-N 2.91Å; I123-L201 HydrophobicContact CG2-CD1 4.35Å; I123-L302 HydrophobicContact CD1-CB 4.03Å; I123-L302 HydrophobicContact CD1-CD1 3.58Å; I123-L302 HydrophobicContact CD1-CD2 3.76Å; I123-L302 HydrophobicContact CD1-CG 3.95Å; I123-F306 HydrophobicContact CD1-CD2 4.23Å; I123-F306 HydrophobicContact CD1-CE2 3.72Å; I123-F306 HydrophobicContact CG1-CE2 3.78Å; I123-F306 HydrophobicContact CG1-CZ 4.18Å; I123-F306 HydrophobicContact CG2-CE2 4Å; I123-F306 HydrophobicContact CG2-CZ 3.99Å |
| 124 | N | 92.6 | Very high | 90.4 | Very high | 0 Ų | 0 | 24 Ų | 24 | 0% | 0 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -62.8 | -44.4 | 176.5 | -93.1 | -40 | 0 | 0 | 0 | 112.5 | F120 S121 Y126 F127 T128 Y149 E197 L201 | F120-N124 PolarHBondContact O-N 3.21Å; S121-N124 PolarHBondContact O-N 2.98Å; N124-Y126 VanDerWaalsContact C-N 3.32Å; N124-Y126 PolarHBondContact O-N 2.86Å; N124-F127 PolarHBondContact O-N 3.4Å; N124-T128 VanDerWaalsContact O-CB 3.28Å; N124-T128 WeakPolarHBondContact O-CB 3.47Å; N124-T128 PolarHBondContact O-N 2.96Å; N124-T128 PolarHBondContact O-OG1 2.9Å; N124-Y149 HydrophobicContact CB-CD1 4.35Å; N124-Y149 HydrophobicContact CB-CE1 3.54Å; N124-E197 VanDerWaalsContact CB-OE2 3.25Å; N124-E197 WeakPolarHBondContact CB-OE2 3.47Å; N124-E197 VanDerWaalsContact CG-OE2 3.3Å; N124-E197 PolarHBondContact ND2-O 3.46Å; N124-E197 PolarHBondContact ND2-OE2 3.28Å; N124-L201 WeakPolarHBondContact OD1-CA 3.18Å; N124-L201 WeakPolarHBondContact OD1-CB 3.32Å; N124-L201 VanDerWaalsContact OD1-CD1 3.23Å; N124-L201 WeakPolarHBondContact OD1-CD1 3.29Å; N124-L201 PolarHBondContact OD1-N 2.85Å; N124-L201 VanDerWaalsContact OD1-N 3.15Å |
| 125 | L | 92.8 | Very high | 90.1 | Very high | 20 Ų | 20 | 26.4 Ų | 26.4 | 11% | 0.105 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -56 | -50.4 | 172.1 | 176.8 | 61.7 | 0 | 0 | 0 | 109.8 | Y68 S121 F127 T128 Q129 R146 Y149 | Y68-L125 HydrophobicContact CE1-CD2 4.04Å; Y68-L125 HydrophobicContact CE1-CG 4.45Å; S121-L125 WeakPolarHBondContact O-CB 3.43Å; S121-L125 PolarHBondContact O-N 3.49Å; L125-F127 PolarHBondContact O-N 3.47Å; L125-T128 WeakPolarHBondContact O-CB 3.49Å; L125-T128 PolarHBondContact O-N 3.5Å; L125-Q129 HydrophobicContact CD1-CG 4.04Å; L125-Q129 HydrophobicContact CG-CG 4.35Å; L125-Q129 VanDerWaalsContact O-CG 3.25Å; L125-Q129 WeakPolarHBondContact O-CG 3.34Å; L125-Q129 PolarHBondContact O-N 3.4Å; L125-R146 HydrophobicContact CD1-CB 4.48Å; L125-R146 HydrophobicContact CD1-CG 3.91Å; L125-R146 HydrophobicContact CD2-CG 4.47Å; L125-Y149 HydrophobicContact CB-CD2 3.84Å; L125-Y149 HydrophobicContact CB-CE2 4.3Å; L125-Y149 HydrophobicContact CB-CG 4.05Å; L125-Y149 HydrophobicContact CD1-CD2 3.6Å; L125-Y149 HydrophobicContact CD1-CE2 4.24Å; L125-Y149 HydrophobicContact CD1-CG 4.38Å; L125-Y149 HydrophobicContact CG-CD2 4.3Å |
| 126 | Y | 89.3 | Confident | 89.8 | Confident | 27 Ų | 27 | 30.2 Ų | 30.2 | 11% | 0.106 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -55 | -51.9 | 179.3 | 169.4 | -97.6 | 0 | 0 | 0 | 112.8 | Y68 L122 I123 N124 T128 Q129 V130 F306 F330 F331 | Y68-Y126 HydrophobicContact CG-CD2 4.48Å; L122-Y126 WeakPolarHBondContact O-CB 3.49Å; L122-Y126 PolarHBondContact O-N 2.96Å; I123-Y126 WeakPolarHBondContact O-CB 3.38Å; I123-Y126 PolarHBondContact O-N 2.86Å; N124-Y126 VanDerWaalsContact C-N 3.32Å; N124-Y126 PolarHBondContact O-N 2.86Å; Y126-T128 VanDerWaalsContact C-N 3.32Å; Y126-T128 PolarHBondContact O-N 3.34Å; Y126-Q129 PolarHBondContact O-N 3.25Å; Y126-V130 HydrophobicContact CE1-CG2 4.24Å; Y126-V130 HydrophobicContact CE2-CG2 4.03Å; Y126-V130 WeakPolarHBondContact O-CG2 3.37Å; Y126-V130 PolarHBondContact O-N 2.99Å; Y126-F306 HydrophobicContact CE1-CE1 4.36Å; Y126-F330 WeakPolarHBondContact OH-CE1 3.25Å; Y126-F330 WeakPolarHBondContact OH-CZ 3.46Å; Y126-F331 AromaticContact CE2-CE1 3.86Å; Y126-F331 HydrophobicContact CE2-CE1 3.86Å; Y126-F331 AromaticContact CE2-CZ 3.85Å; Y126-F331 HydrophobicContact CE2-CZ 3.85Å |
| 127 | F | 87.9 | Confident | 89.5 | Confident | 12 Ų | 12 | 31.2 Ų | 31.2 | 5% | 0.053 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -65.5 | -36.3 | 178.8 | -75.8 | -61.9 | 0 | 0 | 0 | 112.7 | I123 N124 L125 Q129 V130 F131 L201 L205 L208 F305 F306 | I123-F127 HydrophobicContact CG2-CD2 3.62Å; I123-F127 HydrophobicContact CG2-CE2 3.49Å; I123-F127 VanDerWaalsContact CG2-CE2 3.49Å; I123-F127 VanDerWaalsContact O-CD2 3.3Å; I123-F127 WeakPolarHBondContact O-CD2 3.27Å; I123-F127 PolarHBondContact O-N 2.91Å; N124-F127 PolarHBondContact O-N 3.4Å; L125-F127 PolarHBondContact O-N 3.47Å; F127-Q129 VanDerWaalsContact C-N 3.34Å; F127-V130 PolarHBondContact O-N 3.39Å; F127-F131 WeakPolarHBondContact O-CB 3.35Å; F127-F131 PolarHBondContact O-N 2.99Å; F127-L201 HydrophobicContact CD2-CD1 3.7Å; F127-L201 HydrophobicContact CE2-CD1 4.16Å; F127-L205 HydrophobicContact CD1-CD2 4.02Å; F127-L205 HydrophobicContact CD2-CD2 4.28Å; F127-L205 HydrophobicContact CE1-CD2 4Å; F127-L205 HydrophobicContact CE2-CD2 4.23Å; F127-L205 HydrophobicContact CG-CD2 4.17Å; F127-L205 HydrophobicContact CZ-CD2 4.1Å; F127-L208 HydrophobicContact CD1-CD2 4.45Å; F127-F305 AromaticContact CZ-CE1 3.99Å; F127-F305 HydrophobicContact CZ-CE1 3.99Å; F127-F305 HydrophobicContact CZ-CZ 4.44Å; F127-F306 AromaticContact CE2-CZ 3.78Å; F127-F306 HydrophobicContact CE2-CZ 3.78Å; F127-F306 HydrophobicContact CZ-CE1 4.35Å; F127-F306 AromaticContact CZ-CZ 3.79Å; F127-F306 HydrophobicContact CZ-CZ 3.79Å |
| 128 | T | 90.6 | Very high | 89.3 | Confident | 17 Ų | 17 | 34.2 Ų | 34.2 | 10% | 0.104 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -62.1 | -42.8 | 174.2 | -56.1 | 0 | 0 | 0 | 0 | 110.9 | N124 L125 Y126 F131 L132 A145 Y149 | N124-T128 VanDerWaalsContact O-CB 3.28Å; N124-T128 WeakPolarHBondContact O-CB 3.47Å; N124-T128 PolarHBondContact O-N 2.96Å; N124-T128 PolarHBondContact O-OG1 2.9Å; L125-T128 WeakPolarHBondContact O-CB 3.49Å; L125-T128 PolarHBondContact O-N 3.5Å; Y126-T128 VanDerWaalsContact C-N 3.32Å; Y126-T128 PolarHBondContact O-N 3.34Å; T128-F131 PolarHBondContact O-N 3.45Å; T128-L132 HydrophobicContact CG2-CD1 3.99Å; T128-L132 HydrophobicContact CG2-CG 4.29Å; T128-L132 WeakPolarHBondContact O-CB 3.24Å; T128-L132 VanDerWaalsContact O-CG 3.3Å; T128-L132 WeakPolarHBondContact O-CG 3.39Å; T128-L132 PolarHBondContact O-N 3.46Å; T128-A145 HydrophobicContact CG2-CB 4.15Å; T128-Y149 HydrophobicContact CG2-CE2 4.25Å; T128-Y149 PolarHBondContact OG1-OH 3.12Å |
| 129 | Q | 90 | Very high | 89 | Confident | 24 Ų | 24 | 38 Ų | 38 | 11% | 0.112 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -63.4 | -45.2 | 177.6 | -68.1 | -169.2 | 7.1 | 0 | 0 | 112 | Y68 L125 Y126 F127 F131 L132 K133 L142 | Y68-Q129 PolarHBondContact OH-NE2 2.96Å; Y68-Q129 PolarHBondContact OH-OE1 3.44Å; L125-Q129 HydrophobicContact CD1-CG 4.04Å; L125-Q129 HydrophobicContact CG-CG 4.35Å; L125-Q129 VanDerWaalsContact O-CG 3.25Å; L125-Q129 WeakPolarHBondContact O-CG 3.34Å; L125-Q129 PolarHBondContact O-N 3.4Å; Y126-Q129 PolarHBondContact O-N 3.25Å; F127-Q129 VanDerWaalsContact C-N 3.34Å; Q129-F131 VanDerWaalsContact C-N 3.32Å; Q129-F131 PolarHBondContact O-N 3.02Å; Q129-L132 PolarHBondContact O-N 3.23Å; Q129-K133 VanDerWaalsContact O-CB 3.31Å; Q129-K133 WeakPolarHBondContact O-CB 3.4Å; Q129-K133 PolarHBondContact O-N 2.85Å; Q129-L142 HydrophobicContact CB-CD1 4.03Å; Q129-L142 HydrophobicContact CG-CD1 3.48Å; Q129-L142 VanDerWaalsContact CG-CD1 3.48Å |
| 130 | V | 86.5 | Confident | 89 | Confident | 44 Ų | 44 | 42.7 Ų | 42.7 | 27% | 0.267 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -59.3 | -45.8 | 175.9 | 172.4 | 0 | 0 | 0 | 0 | 110.4 | Y126 F127 K133 I134 L208 | Y126-V130 HydrophobicContact CE1-CG2 4.24Å; Y126-V130 HydrophobicContact CE2-CG2 4.03Å; Y126-V130 WeakPolarHBondContact O-CG2 3.37Å; Y126-V130 PolarHBondContact O-N 2.99Å; F127-V130 PolarHBondContact O-N 3.39Å; V130-K133 PolarHBondContact O-N 2.93Å; V130-I134 HydrophobicContact CG1-CD1 3.74Å; V130-I134 WeakPolarHBondContact O-CD1 3.26Å; V130-I134 VanDerWaalsContact O-CG1 3.27Å; V130-I134 WeakPolarHBondContact O-CG1 3.5Å; V130-I134 PolarHBondContact O-N 3.48Å; V130-L208 HydrophobicContact CG1-CD1 4.31Å |
| 131 | F | 87.1 | Confident | 88.9 | Confident | 34 Ų | 34 | 48.2 Ų | 48.2 | 15% | 0.149 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -62.9 | -46.6 | 178.4 | 174.8 | -104.1 | 0 | 0 | 0 | 113 | F127 T128 Q129 K133 I134 S135 L207 Q211 | F127-F131 WeakPolarHBondContact O-CB 3.35Å; F127-F131 PolarHBondContact O-N 2.99Å; T128-F131 PolarHBondContact O-N 3.45Å; Q129-F131 VanDerWaalsContact C-N 3.32Å; Q129-F131 PolarHBondContact O-N 3.02Å; F131-K133 VanDerWaalsContact C-N 3.31Å; F131-K133 PolarHBondContact O-N 2.98Å; F131-I134 PolarHBondContact O-N 3.26Å; F131-S135 WeakPolarHBondContact O-CB 3.24Å; F131-S135 PolarHBondContact O-N 2.9Å; F131-S135 PolarHBondContact O-OG 3.14Å; F131-L207 HydrophobicContact CD2-CB 4.03Å; F131-L207 HydrophobicContact CE1-CD1 4.11Å; F131-L207 HydrophobicContact CE2-CB 3.57Å; F131-L207 HydrophobicContact CE2-CD1 4.45Å; F131-L207 HydrophobicContact CE2-CG 4.49Å; F131-L207 HydrophobicContact CZ-CB 3.91Å; F131-L207 HydrophobicContact CZ-CD1 3.94Å; F131-L207 HydrophobicContact CZ-CG 4.37Å; F131-Q211 HydrophobicContact CE2-CG 4.44Å |
| 132 | L | 89 | Confident | 88.8 | Confident | 29 Ų | 29 | 49.9 Ų | 49.9 | 15% | 0.152 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -63 | -39 | 178 | -73.4 | 177.2 | 0 | 0 | 0 | 111.7 | T128 Q129 S135 A136 A137 A145 | T128-L132 HydrophobicContact CG2-CD1 3.99Å; T128-L132 HydrophobicContact CG2-CG 4.29Å; T128-L132 WeakPolarHBondContact O-CB 3.24Å; T128-L132 VanDerWaalsContact O-CG 3.3Å; T128-L132 WeakPolarHBondContact O-CG 3.39Å; T128-L132 PolarHBondContact O-N 3.46Å; Q129-L132 PolarHBondContact O-N 3.23Å; L132-S135 CarbonylContact O-C 3.56Å; L132-S135 PolarHBondContact O-N 3.37Å; L132-A136 PolarHBondContact O-N 2.93Å; L132-A137 HydrophobicContact CB-CB 4Å; L132-A137 HydrophobicContact CD2-CB 3.77Å; L132-A137 HydrophobicContact CG-CB 4.46Å; L132-A137 VanDerWaalsContact O-CB 3.3Å; L132-A137 WeakPolarHBondContact O-CB 3.47Å; L132-A137 PolarHBondContact O-N 3.32Å; L132-A145 HydrophobicContact CD1-CB 4.11Å |
| 133 | K | 86 | Confident | 88.8 | Confident | 144 Ų | 144 | 56.6 Ų | 56.6 | 63% | 0.626 | 30% | 0.303 | S | S | * | . | H | α-helix | trans | -66.1 | -43.4 | 177.4 | -168.7 | 171.7 | -176.5 | 176.5 | 0 | 112 | Q129 V130 F131 S135 A136 | Q129-K133 VanDerWaalsContact O-CB 3.31Å; Q129-K133 WeakPolarHBondContact O-CB 3.4Å; Q129-K133 PolarHBondContact O-N 2.85Å; V130-K133 PolarHBondContact O-N 2.93Å; F131-K133 VanDerWaalsContact C-N 3.31Å; F131-K133 PolarHBondContact O-N 2.98Å; K133-S135 VanDerWaalsContact C-N 3.25Å; K133-S135 PolarHBondContact O-N 2.95Å; K133-A136 PolarHBondContact O-N 3.44Å; K133-A136 VanDerWaalsContact O-N 3.16Å |
| 134 | I | 84.8 | Confident | 89 | Confident | 47 Ų | 47 | 60.8 Ų | 60.8 | 24% | 0.241 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -64 | -35.2 | 174.6 | -67.2 | 163.1 | 0 | 0 | 0 | 111 | V130 F131 A136 L208 Q211 F215 | V130-I134 HydrophobicContact CG1-CD1 3.74Å; V130-I134 WeakPolarHBondContact O-CD1 3.26Å; V130-I134 VanDerWaalsContact O-CG1 3.27Å; V130-I134 WeakPolarHBondContact O-CG1 3.5Å; V130-I134 PolarHBondContact O-N 3.48Å; F131-I134 PolarHBondContact O-N 3.26Å; I134-A136 PolarHBondContact O-N 3.13Å; I134-L208 HydrophobicContact CD1-CD1 3.53Å; I134-Q211 HydrophobicContact CG2-CG 4.42Å; I134-F215 HydrophobicContact CG2-CB 4.28Å |
| 135 | S | 83.4 | Confident | 89 | Confident | 51 Ų | 51 | 61.4 Ų | 61.4 | 36% | 0.357 | 33% | 0.334 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -79.2 | 7.4 | 178.4 | -53 | 0 | 0 | 0 | 0 | 113.4 | F131 L132 K133 A137 | F131-S135 WeakPolarHBondContact O-CB 3.24Å; F131-S135 PolarHBondContact O-N 2.9Å; F131-S135 PolarHBondContact O-OG 3.14Å; L132-S135 CarbonylContact O-C 3.56Å; L132-S135 PolarHBondContact O-N 3.37Å; K133-S135 VanDerWaalsContact C-N 3.25Å; K133-S135 PolarHBondContact O-N 2.95Å; S135-A137 PolarHBondContact O-N 3.48Å; S135-A137 VanDerWaalsContact O-N 3.1Å |
| 136 | A | 84.8 | Confident | 89.1 | Confident | 91 Ų | 91 | 64.5 Ų | 64.5 | 75% | 0.752 | 34% | 0.344 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 47.4 | 38 | -174.8 | 0 | 0 | 0 | 0 | 0 | 113 | L132 K133 I134 | L132-A136 PolarHBondContact O-N 2.93Å; K133-A136 PolarHBondContact O-N 3.44Å; K133-A136 VanDerWaalsContact O-N 3.16Å; I134-A136 PolarHBondContact O-N 3.13Å |
| 137 | A | 85.8 | Confident | 89.4 | Confident | 26 Ų | 26 | 66.5 Ų | 66.5 | 22% | 0.215 | 36% | 0.361 | C | S | . | . | trans | -70.3 | 149.9 | 180 | 0 | 0 | 0 | 0 | 0 | 111.1 | L132 S135 K141 | L132-A137 HydrophobicContact CB-CB 4Å; L132-A137 HydrophobicContact CD2-CB 3.77Å; L132-A137 HydrophobicContact CG-CB 4.46Å; L132-A137 VanDerWaalsContact O-CB 3.3Å; L132-A137 WeakPolarHBondContact O-CB 3.47Å; L132-A137 PolarHBondContact O-N 3.32Å; S135-A137 PolarHBondContact O-N 3.48Å; S135-A137 VanDerWaalsContact O-N 3.1Å; A137-K141 HydrophobicContact CB-CB 4.38Å; A137-K141 HydrophobicContact CB-CD 4.05Å | ||
| 138 | S | 88.8 | Confident | 89.7 | Confident | 63 Ų | 63 | 68.4 Ų | 68.4 | 44% | 0.441 | 38% | 0.379 | S | S | . | . | trans | -63.1 | 152.3 | 179.4 | 61.9 | 0 | 0 | 0 | 0 | 113 | T140 K141 L142 | S138-T140 PolarHBondContact O-N 2.7Å; S138-T140 VanDerWaalsContact O-N 3.12Å; S138-K141 WeakPolarHBondContact O-CB 3.28Å; S138-K141 PolarHBondContact O-N 2.89Å; S138-L142 PolarHBondContact O-N 3.01Å | ||
| 139 | D | 89.3 | Confident | 89.9 | Confident | 124 Ų | 124 | 68.5 Ų | 68.5 | 66% | 0.663 | 38% | 0.377 | S | S | * | . | H | α-helix | trans | -56.5 | -29.7 | 175.9 | -69 | -33.2 | 0 | 0 | 0 | 112.8 | K141 L142 W143 | D139-K141 PolarHBondContact O-N 3.48Å; D139-L142 WeakPolarHBondContact O-CB 3.25Å; D139-L142 PolarHBondContact O-N 3.41Å; D139-W143 PolarHBondContact O-N 2.81Å |
| 140 | T | 91.9 | Very high | 90.2 | Very high | 101 Ų | 101 | 69.9 Ų | 69.9 | 62% | 0.62 | 39% | 0.393 | S | S | * | . | H | α-helix | trans | -60.6 | -44.1 | 173.3 | -45.4 | 0 | 0 | 0 | 0 | 111.8 | S138 L142 W143 V144 | S138-T140 PolarHBondContact O-N 2.7Å; S138-T140 VanDerWaalsContact O-N 3.12Å; T140-L142 VanDerWaalsContact C-N 3.31Å; T140-L142 PolarHBondContact O-N 3.35Å; T140-W143 PolarHBondContact O-N 2.69Å; T140-V144 VanDerWaalsContact O-CG2 3.25Å; T140-V144 WeakPolarHBondContact O-CG2 3.48Å; T140-V144 PolarHBondContact O-N 3.38Å |
| 141 | K | 90.9 | Very high | 90.6 | Very high | 129 Ų | 129 | 70 Ų | 70 | 56% | 0.561 | 40% | 0.398 | S | S | * | . | H | α-helix | trans | -65.7 | -37.2 | 178.6 | -71.4 | 178.1 | 176.4 | 179.8 | 0 | 111.4 | A137 S138 D139 V144 A145 | A137-K141 HydrophobicContact CB-CB 4.38Å; A137-K141 HydrophobicContact CB-CD 4.05Å; S138-K141 WeakPolarHBondContact O-CB 3.28Å; S138-K141 PolarHBondContact O-N 2.89Å; D139-K141 PolarHBondContact O-N 3.48Å; K141-V144 PolarHBondContact O-N 3.49Å; K141-A145 PolarHBondContact O-N 3.4Å |
| 142 | L | 90.8 | Very high | 91 | Very high | 39 Ų | 39 | 70.2 Ų | 70.2 | 20% | 0.204 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -63.2 | -46 | 174.7 | 177.6 | 62.4 | 0 | 0 | 0 | 111.7 | Q129 S138 D139 T140 A145 R146 | Q129-L142 HydrophobicContact CB-CD1 4.03Å; Q129-L142 HydrophobicContact CG-CD1 3.48Å; Q129-L142 VanDerWaalsContact CG-CD1 3.48Å; S138-L142 PolarHBondContact O-N 3.01Å; D139-L142 WeakPolarHBondContact O-CB 3.25Å; D139-L142 PolarHBondContact O-N 3.41Å; T140-L142 VanDerWaalsContact C-N 3.31Å; T140-L142 PolarHBondContact O-N 3.35Å; L142-A145 PolarHBondContact O-N 3.25Å; L142-R146 WeakPolarHBondContact O-CG 3.39Å; L142-R146 PolarHBondContact O-N 2.89Å |
| 143 | W | 92.4 | Very high | 91.3 | Very high | 162 Ų | 162 | 69.8 Ų | 69.8 | 61% | 0.614 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -62.7 | -44.3 | 175.9 | -97.6 | 103.7 | 0 | 0 | 0 | 112.6 | D139 T140 A145 R146 C147 | D139-W143 PolarHBondContact O-N 2.81Å; T140-W143 PolarHBondContact O-N 2.69Å; W143-A145 VanDerWaalsContact C-N 3.3Å; W143-A145 PolarHBondContact O-N 3.43Å; W143-R146 WeakPolarHBondContact O-CB 3.32Å; W143-R146 PolarHBondContact O-N 2.83Å; W143-C147 PolarHBondContact O-N 3.04Å; W143-C147 PolarHBondContact O-SG 3.49Å; W143-C147 VanDerWaalsContact O-SG 3.36Å |
| 144 | V | 94.7 | Very high | 91.8 | Very high | 92 Ų | 92 | 67.1 Ų | 67.1 | 56% | 0.558 | 40% | 0.396 | S | S | * | . | H | α-helix | trans | -59.3 | -42.9 | 176.1 | 170.3 | 0 | 0 | 0 | 0 | 110.9 | T140 K141 C147 A148 | T140-V144 VanDerWaalsContact O-CG2 3.25Å; T140-V144 WeakPolarHBondContact O-CG2 3.48Å; T140-V144 PolarHBondContact O-N 3.38Å; K141-V144 PolarHBondContact O-N 3.49Å; V144-C147 PolarHBondContact O-N 3.36Å; V144-A148 WeakPolarHBondContact O-CB 3.42Å; V144-A148 PolarHBondContact O-N 3.09Å |
| 145 | A | 93.2 | Very high | 92.2 | Very high | 13 Ų | 13 | 68.6 Ų | 68.6 | 11% | 0.107 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -61 | -46.3 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | T128 L132 K141 L142 W143 C147 A148 Y149 | T128-A145 HydrophobicContact CG2-CB 4.15Å; L132-A145 HydrophobicContact CD1-CB 4.11Å; K141-A145 PolarHBondContact O-N 3.4Å; L142-A145 PolarHBondContact O-N 3.25Å; W143-A145 VanDerWaalsContact C-N 3.3Å; W143-A145 PolarHBondContact O-N 3.43Å; A145-C147 PolarHBondContact O-N 2.93Å; A145-A148 PolarHBondContact O-N 3.48Å; A145-Y149 WeakPolarHBondContact O-CD2 3.34Å; A145-Y149 PolarHBondContact O-N 2.92Å |
| 146 | R | 93.7 | Very high | 92.7 | Very high | 85 Ų | 85 | 66.1 Ų | 66.1 | 32% | 0.321 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -57.9 | -47.5 | 176.1 | -72.1 | 173 | 177.4 | 177.2 | -0.4 | 111.9 | L125 L142 W143 A148 A150 | L125-R146 HydrophobicContact CD1-CB 4.48Å; L125-R146 HydrophobicContact CD1-CG 3.91Å; L125-R146 HydrophobicContact CD2-CG 4.47Å; L142-R146 WeakPolarHBondContact O-CG 3.39Å; L142-R146 PolarHBondContact O-N 2.89Å; W143-R146 WeakPolarHBondContact O-CB 3.32Å; W143-R146 PolarHBondContact O-N 2.83Å; R146-A148 VanDerWaalsContact C-N 3.33Å; R146-A148 PolarHBondContact O-N 2.69Å; R146-A150 VanDerWaalsContact O-CB 3.25Å; R146-A150 WeakPolarHBondContact O-CB 3.32Å; R146-A150 PolarHBondContact O-N 3.2Å |
| 147 | C | 95.2 | Very high | 93.1 | Very high | 70 Ų | 70 | 64.7 Ų | 64.7 | 47% | 0.473 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -63.2 | -39.2 | 177.7 | -68.7 | 0 | 0 | 0 | 0 | 111.9 | W143 V144 A145 A151 | W143-C147 PolarHBondContact O-N 3.04Å; W143-C147 PolarHBondContact O-SG 3.49Å; W143-C147 VanDerWaalsContact O-SG 3.36Å; V144-C147 PolarHBondContact O-N 3.36Å; A145-C147 PolarHBondContact O-N 2.93Å; C147-A151 VanDerWaalsContact O-CB 3.23Å; C147-A151 WeakPolarHBondContact O-CB 3.42Å; C147-A151 PolarHBondContact O-N 3.15Å |
| 148 | A | 95.1 | Very high | 93.4 | Very high | 51 Ų | 51 | 66.5 Ų | 66.5 | 42% | 0.421 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -62.9 | -54.2 | 178 | 0 | 0 | 0 | 0 | 0 | 111.5 | V144 A145 R146 A150 A151 M152 | V144-A148 WeakPolarHBondContact O-CB 3.42Å; V144-A148 PolarHBondContact O-N 3.09Å; A145-A148 PolarHBondContact O-N 3.48Å; R146-A148 VanDerWaalsContact C-N 3.33Å; R146-A148 PolarHBondContact O-N 2.69Å; A148-A150 VanDerWaalsContact C-N 3.31Å; A148-A150 PolarHBondContact O-N 2.87Å; A148-A151 PolarHBondContact O-N 3.11Å; A148-M152 VanDerWaalsContact O-CG 3.29Å; A148-M152 WeakPolarHBondContact O-CG 3.44Å; A148-M152 PolarHBondContact O-N 3.49Å |
| 149 | Y | 95.2 | Very high | 93.4 | Very high | 19 Ų | 19 | 65 Ų | 65 | 8% | 0.075 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -62.6 | -37 | 178.7 | -73.9 | -70.7 | 0 | 0 | 0 | 112.5 | S121 N124 L125 T128 A145 M152 S153 E197 L200 | S121-Y149 WeakPolarHBondContact OG-CD1 3.42Å; N124-Y149 HydrophobicContact CB-CD1 4.35Å; N124-Y149 HydrophobicContact CB-CE1 3.54Å; L125-Y149 HydrophobicContact CB-CD2 3.84Å; L125-Y149 HydrophobicContact CB-CE2 4.3Å; L125-Y149 HydrophobicContact CB-CG 4.05Å; L125-Y149 HydrophobicContact CD1-CD2 3.6Å; L125-Y149 HydrophobicContact CD1-CE2 4.24Å; L125-Y149 HydrophobicContact CD1-CG 4.38Å; L125-Y149 HydrophobicContact CG-CD2 4.3Å; T128-Y149 HydrophobicContact CG2-CE2 4.25Å; T128-Y149 PolarHBondContact OG1-OH 3.12Å; A145-Y149 WeakPolarHBondContact O-CD2 3.34Å; A145-Y149 PolarHBondContact O-N 2.92Å; Y149-M152 PolarHBondContact O-N 3.01Å; Y149-S153 WeakPolarHBondContact O-CB 3.45Å; Y149-S153 PolarHBondContact O-N 3.27Å; Y149-S153 PolarHBondContact O-OG 3.42Å; Y149-S153 VanDerWaalsContact O-OG 3.1Å; Y149-E197 WeakPolarHBondContact CD1-OE1 3.32Å; Y149-E197 WeakPolarHBondContact CE1-OE2 3.27Å; Y149-L200 HydrophobicContact CE1-CD1 4.18Å |
| 150 | A | 94.8 | Very high | 93.2 | Very high | 53 Ų | 53 | 59.1 Ų | 59.1 | 44% | 0.438 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -63.9 | -45.4 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | R146 A148 M152 S153 V154 | R146-A150 VanDerWaalsContact O-CB 3.25Å; R146-A150 WeakPolarHBondContact O-CB 3.32Å; R146-A150 PolarHBondContact O-N 3.2Å; A148-A150 VanDerWaalsContact C-N 3.31Å; A148-A150 PolarHBondContact O-N 2.87Å; A150-M152 VanDerWaalsContact C-N 3.34Å; A150-M152 PolarHBondContact O-N 2.91Å; A150-S153 PolarHBondContact O-N 3.32Å; A150-V154 WeakPolarHBondContact O-CG2 3.49Å; A150-V154 PolarHBondContact O-N 3.37Å |
| 151 | A | 95.8 | Very high | 92.9 | Very high | 46 Ų | 46 | 57.3 Ų | 57.3 | 38% | 0.38 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -60.9 | -42.8 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | C147 A148 S153 V154 I155 | C147-A151 VanDerWaalsContact O-CB 3.23Å; C147-A151 WeakPolarHBondContact O-CB 3.42Å; C147-A151 PolarHBondContact O-N 3.15Å; A148-A151 PolarHBondContact O-N 3.11Å; A151-S153 PolarHBondContact O-N 3.38Å; A151-V154 PolarHBondContact O-N 2.83Å; A151-I155 WeakPolarHBondContact O-CB 3.47Å; A151-I155 WeakPolarHBondContact O-CD1 3.48Å; A151-I155 VanDerWaalsContact O-CG1 3.23Å; A151-I155 WeakPolarHBondContact O-CG1 3.47Å; A151-I155 PolarHBondContact O-N 2.9Å |
| 152 | M | 95.6 | Very high | 92.5 | Very high | 39 Ų | 39 | 54.1 Ų | 54.1 | 19% | 0.192 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -62 | -43.1 | 176.6 | -64.4 | -53.6 | -105.6 | 0 | 0 | 112.2 | F117 A148 Y149 A150 I155 F156 L193 M196 | F117-M152 HydrophobicContact CZ-CB 4.38Å; A148-M152 VanDerWaalsContact O-CG 3.29Å; A148-M152 WeakPolarHBondContact O-CG 3.44Å; A148-M152 PolarHBondContact O-N 3.49Å; Y149-M152 PolarHBondContact O-N 3.01Å; A150-M152 VanDerWaalsContact C-N 3.34Å; A150-M152 PolarHBondContact O-N 2.91Å; M152-I155 PolarHBondContact O-N 3Å; M152-I155 HydrophobicContact SD-CD1 4.39Å; M152-F156 WeakPolarHBondContact O-CB 3.41Å; M152-F156 PolarHBondContact O-N 2.91Å; M152-L193 HydrophobicContact CB-CD2 4.49Å; M152-L193 HydrophobicContact CE-CD2 3.02Å; M152-L193 HydrophobicContact SD-CD2 3.74Å; M152-M196 HydrophobicContact CE-CE 3.27Å; M152-M196 HydrophobicContact CE-SD 3.27Å; M152-M196 WeakPolarHBondContact CE-SD 3.33Å |
| 153 | S | 95.5 | Very high | 91.9 | Very high | 21 Ų | 21 | 52.6 Ų | 52.6 | 15% | 0.147 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -63.2 | -41.9 | 175 | -65.8 | 0 | 0 | 0 | 0 | 112.5 | F118 Y149 A150 A151 F156 L157 | F118-S153 WeakPolarHBondContact CE1-O 3.39Å; Y149-S153 WeakPolarHBondContact O-CB 3.45Å; Y149-S153 PolarHBondContact O-N 3.27Å; Y149-S153 PolarHBondContact O-OG 3.42Å; Y149-S153 VanDerWaalsContact O-OG 3.1Å; A150-S153 PolarHBondContact O-N 3.32Å; A151-S153 PolarHBondContact O-N 3.38Å; S153-F156 PolarHBondContact O-N 3.42Å; S153-L157 WeakPolarHBondContact O-CB 3.32Å; S153-L157 PolarHBondContact O-N 2.66Å |
| 154 | V | 95.8 | Very high | 91 | Very high | 88 Ų | 88 | 45.6 Ų | 45.6 | 53% | 0.533 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -65.4 | -45.9 | 176.6 | 170.9 | 0 | 0 | 0 | 0 | 111 | A150 A151 F156 L157 C158 | A150-V154 WeakPolarHBondContact O-CG2 3.49Å; A150-V154 PolarHBondContact O-N 3.37Å; A151-V154 PolarHBondContact O-N 2.83Å; V154-F156 VanDerWaalsContact C-N 3.32Å; V154-F156 PolarHBondContact O-N 3.2Å; V154-L157 PolarHBondContact O-N 3.46Å; V154-C158 WeakPolarHBondContact O-CB 3.35Å; V154-C158 PolarHBondContact O-N 3.16Å; V154-C158 PolarHBondContact O-SG 2.92Å |
| 155 | I | 94.8 | Very high | 90.1 | Very high | 77 Ų | 77 | 44.5 Ų | 44.5 | 40% | 0.395 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -57.8 | -47.6 | 176.5 | -70 | 164 | 0 | 0 | 0 | 110.2 | A151 M152 L157 C158 I159 V189 L193 | A151-I155 WeakPolarHBondContact O-CB 3.47Å; A151-I155 WeakPolarHBondContact O-CD1 3.48Å; A151-I155 VanDerWaalsContact O-CG1 3.23Å; A151-I155 WeakPolarHBondContact O-CG1 3.47Å; A151-I155 PolarHBondContact O-N 2.9Å; M152-I155 PolarHBondContact O-N 3Å; M152-I155 HydrophobicContact SD-CD1 4.39Å; I155-L157 PolarHBondContact O-N 2.98Å; I155-C158 PolarHBondContact O-N 3.03Å; I155-I159 HydrophobicContact CG2-CD1 3.76Å; I155-I159 WeakPolarHBondContact O-CG1 3.5Å; I155-I159 PolarHBondContact O-N 3.29Å; I155-V189 HydrophobicContact CG2-CG1 4.46Å; I155-L193 HydrophobicContact CG2-CD1 4.41Å |
| 156 | F | 93.6 | Very high | 89 | Confident | 0 Ų | 0 | 48.6 Ų | 48.6 | 0% | 0 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -56.9 | -49.2 | 177.4 | -168.2 | -83.5 | 0 | 0 | 0 | 111.3 | V113 C114 F117 M152 S153 V154 N160 N190 L193 F194 | V113-F156 HydrophobicContact CG1-CE1 4.43Å; V113-F156 HydrophobicContact CG1-CZ 4.01Å; C114-F156 HydrophobicContact CB-CE1 4.31Å; F117-F156 HydrophobicContact CB-CD1 3.96Å; F117-F156 HydrophobicContact CB-CD2 4.26Å; F117-F156 HydrophobicContact CB-CE1 3.84Å; F117-F156 HydrophobicContact CB-CE2 4.13Å; F117-F156 HydrophobicContact CB-CG 4.2Å; F117-F156 HydrophobicContact CB-CZ 3.93Å; F117-F156 HydrophobicContact CD1-CB 3.84Å; F117-F156 HydrophobicContact CD1-CD1 4.14Å; F117-F156 HydrophobicContact CD1-CD2 4.02Å; F117-F156 AromaticContact CD1-CG 3.73Å; F117-F156 HydrophobicContact CD1-CG 3.73Å; F117-F156 AromaticContact CD2-CD2 3.65Å; F117-F156 HydrophobicContact CD2-CD2 3.65Å; F117-F156 AromaticContact CD2-CE2 3.76Å; F117-F156 HydrophobicContact CD2-CE2 3.76Å; F117-F156 HydrophobicContact CD2-CG 4.2Å; F117-F156 HydrophobicContact CD2-CZ 4.4Å; F117-F156 HydrophobicContact CE1-CB 3.93Å; F117-F156 HydrophobicContact CE1-CD2 4.34Å; F117-F156 HydrophobicContact CE1-CG 4.19Å; F117-F156 AromaticContact CE2-CD2 3.98Å; F117-F156 HydrophobicContact CE2-CD2 3.98Å; F117-F156 HydrophobicContact CE2-CE2 4.41Å; F117-F156 HydrophobicContact CG-CB 4.35Å; F117-F156 HydrophobicContact CG-CD1 4.02Å; F117-F156 AromaticContact CG-CD2 3.67Å; F117-F156 HydrophobicContact CG-CD2 3.67Å; F117-F156 HydrophobicContact CG-CE1 4.27Å; F117-F156 AromaticContact CG-CE2 3.92Å; F117-F156 HydrophobicContact CG-CE2 3.92Å; F117-F156 AromaticContact CG-CG 3.74Å; F117-F156 HydrophobicContact CG-CG 3.74Å; F117-F156 HydrophobicContact CG-CZ 4.22Å; F117-F156 HydrophobicContact CZ-CB 4.49Å; F117-F156 HydrophobicContact CZ-CD2 4.32Å; M152-F156 WeakPolarHBondContact O-CB 3.41Å; M152-F156 PolarHBondContact O-N 2.91Å; S153-F156 PolarHBondContact O-N 3.42Å; V154-F156 VanDerWaalsContact C-N 3.32Å; V154-F156 PolarHBondContact O-N 3.2Å; F156-N160 VanDerWaalsContact CD1-ND2 3.33Å; F156-N160 WeakPolarHBondContact CD1-ND2 3.3Å; F156-N160 WeakPolarHBondContact CE1-ND2 3.2Å; F156-N160 PolarHBondContact O-N 3.41Å; F156-N160 VanDerWaalsContact O-N 3.13Å; F156-N160 PolarHBondContact O-ND2 3.39Å; F156-N190 HydrophobicContact CD2-CB 4.41Å; F156-N190 HydrophobicContact CE2-CB 3.63Å; F156-N190 WeakPolarHBondContact CE2-OD1 3.32Å; F156-N190 HydrophobicContact CZ-CB 4.15Å; F156-L193 HydrophobicContact CB-CD1 4.03Å; F156-L193 HydrophobicContact CD2-CB 4.32Å; F156-L193 HydrophobicContact CD2-CD1 3.77Å; F156-L193 HydrophobicContact CG-CD1 4.41Å; F156-F194 HydrophobicContact CE2-CD2 4.13Å; F156-F194 AromaticContact CE2-CE2 3.7Å; F156-F194 HydrophobicContact CE2-CE2 3.7Å; F156-F194 HydrophobicContact CE2-CZ 4.39Å; F156-F194 AromaticContact CZ-CE2 3.71Å; F156-F194 HydrophobicContact CZ-CE2 3.71Å; F156-F194 HydrophobicContact CZ-CZ 4.22Å |
| 157 | L | 92.3 | Very high | 87.4 | Confident | 60 Ų | 60 | 45.1 Ų | 45.1 | 31% | 0.314 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -62.6 | -48.6 | 179 | -175.8 | 61.6 | 0 | 0 | 0 | 111.8 | W106 F118 S153 V154 I155 I159 N160 V161 | W106-L157 HydrophobicContact CZ2-CD1 4.19Å; F118-L157 HydrophobicContact CZ-CB 4.05Å; F118-L157 HydrophobicContact CZ-CD1 4.21Å; F118-L157 HydrophobicContact CZ-CD2 4.32Å; F118-L157 HydrophobicContact CZ-CG 4.42Å; S153-L157 WeakPolarHBondContact O-CB 3.32Å; S153-L157 PolarHBondContact O-N 2.66Å; V154-L157 PolarHBondContact O-N 3.46Å; I155-L157 PolarHBondContact O-N 2.98Å; L157-I159 VanDerWaalsContact C-N 3.3Å; L157-I159 PolarHBondContact O-N 3.48Å; L157-N160 PolarHBondContact O-N 3.48Å; L157-V161 HydrophobicContact CD1-CG2 3.93Å; L157-V161 HydrophobicContact CG-CG2 4.2Å; L157-V161 WeakPolarHBondContact O-CB 3.43Å; L157-V161 WeakPolarHBondContact O-CG2 3.25Å; L157-V161 PolarHBondContact O-N 2.93Å |
| 158 | C | 91.6 | Very high | 85.4 | Confident | 65 Ų | 65 | 46.4 Ų | 46.4 | 44% | 0.439 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -57.9 | -43.8 | -178.6 | -74.6 | 0 | 0 | 0 | 0 | 111.4 | V154 I155 V161 T162 | V154-C158 WeakPolarHBondContact O-CB 3.35Å; V154-C158 PolarHBondContact O-N 3.16Å; V154-C158 PolarHBondContact O-SG 2.92Å; I155-C158 PolarHBondContact O-N 3.03Å; C158-V161 PolarHBondContact O-N 2.96Å; C158-T162 WeakPolarHBondContact O-CB 3.26Å; C158-T162 PolarHBondContact O-N 2.96Å; C158-T162 PolarHBondContact O-OG1 2.92Å |
| 159 | I | 88.8 | Confident | 83.1 | Confident | 32 Ų | 32 | 54.3 Ų | 54.3 | 16% | 0.164 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -65 | -44.7 | 178.5 | -69.9 | 171 | 0 | 0 | 0 | 110.9 | I155 L157 T162 C163 R186 V189 | I155-I159 HydrophobicContact CG2-CD1 3.76Å; I155-I159 WeakPolarHBondContact O-CG1 3.5Å; I155-I159 PolarHBondContact O-N 3.29Å; L157-I159 VanDerWaalsContact C-N 3.3Å; L157-I159 PolarHBondContact O-N 3.48Å; I159-T162 PolarHBondContact O-N 3.47Å; I159-C163 WeakPolarHBondContact O-CB 3.4Å; I159-C163 PolarHBondContact O-N 3.23Å; I159-C163 PolarHBondContact O-SG 3.35Å; I159-R186 HydrophobicContact CG2-CB 3.98Å; I159-R186 HydrophobicContact CG2-CG 4Å; I159-V189 HydrophobicContact CD1-CB 3.76Å; I159-V189 HydrophobicContact CD1-CG1 3.29Å; I159-V189 HydrophobicContact CD1-CG2 4.12Å |
| 160 | N | 86.5 | Confident | 80.7 | Confident | 0 Ų | 0 | 55.6 Ų | 55.6 | 0% | 0 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -70.2 | -29.7 | 179.6 | -78.5 | -74.6 | 0 | 0 | 0 | 113.5 | F156 L157 R186 N190 Y267 | F156-N160 VanDerWaalsContact CD1-ND2 3.33Å; F156-N160 WeakPolarHBondContact CD1-ND2 3.3Å; F156-N160 WeakPolarHBondContact CE1-ND2 3.2Å; F156-N160 PolarHBondContact O-N 3.41Å; F156-N160 VanDerWaalsContact O-N 3.13Å; F156-N160 PolarHBondContact O-ND2 3.39Å; L157-N160 PolarHBondContact O-N 3.48Å; N160-R186 PolarHBondContact OD1-NE 3.41Å; N160-R186 PolarHBondContact OD1-NH2 2.91Å; N160-N190 PolarHBondContact ND2-ND2 3.42Å; N160-N190 VanDerWaalsContact ND2-ND2 3.13Å; N160-N190 PolarHBondContact ND2-OD1 2.89Å; N160-N190 PolarHBondContact OD1-ND2 3Å; N160-Y267 PolarHBondContact O-OH 3.46Å |
| 161 | V | 85 | Confident | 78.5 | Confident | 62 Ų | 62 | 59.3 Ų | 59.3 | 38% | 0.376 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -77.9 | -43.1 | 173 | 172.1 | 0 | 0 | 0 | 0 | 110.8 | W106 L157 C158 C163 A164 A165 | W106-V161 HydrophobicContact CZ2-CG2 3.67Å; L157-V161 HydrophobicContact CD1-CG2 3.93Å; L157-V161 HydrophobicContact CG-CG2 4.2Å; L157-V161 WeakPolarHBondContact O-CB 3.43Å; L157-V161 WeakPolarHBondContact O-CG2 3.25Å; L157-V161 PolarHBondContact O-N 2.93Å; C158-V161 PolarHBondContact O-N 2.96Å; V161-C163 VanDerWaalsContact C-N 3.31Å; V161-C163 PolarHBondContact O-N 3.15Å; V161-A164 PolarHBondContact O-N 3.22Å; V161-A165 PolarHBondContact O-N 3.34Å |
| 162 | T | 83.1 | Confident | 76.5 | Confident | 63 Ų | 63 | 60.2 Ų | 60.2 | 39% | 0.387 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -62.8 | -40.6 | -179.8 | -60.6 | 0 | 0 | 0 | 0 | 111.1 | C158 I159 A164 L166 | C158-T162 WeakPolarHBondContact O-CB 3.26Å; C158-T162 PolarHBondContact O-N 2.96Å; C158-T162 PolarHBondContact O-OG1 2.92Å; I159-T162 PolarHBondContact O-N 3.47Å; T162-A164 VanDerWaalsContact C-N 3.29Å; T162-A164 PolarHBondContact O-N 3.05Å; T162-L166 HydrophobicContact CG2-CD1 3.52Å; T162-L166 HydrophobicContact CG2-CG 4.2Å; T162-L166 VanDerWaalsContact O-CB 3.25Å; T162-L166 WeakPolarHBondContact O-CB 3.42Å; T162-L166 VanDerWaalsContact O-CG 3.28Å; T162-L166 WeakPolarHBondContact O-CG 2.94Å; T162-L166 PolarHBondContact O-N 2.98Å |
| 163 | C | 77.8 | Confident | 74.7 | Confident | 7 Ų | 7 | 61.5 Ų | 61.5 | 5% | 0.047 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -61.2 | -40.6 | 173.9 | -69.8 | 0 | 0 | 0 | 0 | 111.3 | I159 V161 G167 R186 Y267 | I159-C163 WeakPolarHBondContact O-CB 3.4Å; I159-C163 PolarHBondContact O-N 3.23Å; I159-C163 PolarHBondContact O-SG 3.35Å; V161-C163 VanDerWaalsContact C-N 3.31Å; V161-C163 PolarHBondContact O-N 3.15Å; C163-G167 WeakPolarHBondContact O-CA 3.25Å; C163-G167 PolarHBondContact O-N 2.93Å; C163-R186 VanDerWaalsContact SG-CB 3.59Å; C163-Y267 HydrophobicContact CB-CE2 3.92Å; C163-Y267 VanDerWaalsContact CB-OH 3.32Å; C163-Y267 WeakPolarHBondContact CB-OH 3.08Å; C163-Y267 WeakPolarHBondContact O-CE2 3.37Å |
| 164 | A | 73.9 | Confident | 73.1 | Confident | 14 Ų | 14 | 67.3 Ų | 67.3 | 12% | 0.116 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -69.7 | -44.8 | -177.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | W106 V161 T162 L166 Y267 | W106-A164 VanDerWaalsContact CD1-CB 3.44Å; W106-A164 HydrophobicContact CG-CB 4.3Å; V161-A164 PolarHBondContact O-N 3.22Å; T162-A164 VanDerWaalsContact C-N 3.29Å; T162-A164 PolarHBondContact O-N 3.05Å; A164-L166 VanDerWaalsContact C-N 3.34Å; A164-L166 PolarHBondContact O-N 3.13Å; A164-Y267 VanDerWaalsContact CA-CZ 3.48Å; A164-Y267 VanDerWaalsContact CA-OH 3.24Å; A164-Y267 WeakPolarHBondContact CA-OH 3.22Å; A164-Y267 HydrophobicContact CB-CE1 4.42Å; A164-Y267 HydrophobicContact CB-CE2 3.96Å; A164-Y267 VanDerWaalsContact CB-OH 3.24Å; A164-Y267 WeakPolarHBondContact CB-OH 3.48Å; A164-Y267 PolarHBondContact N-OH 3.47Å |
| 165 | A | 74.6 | Confident | 71.5 | Confident | 70 Ų | 70 | 68.1 Ų | 68.1 | 58% | 0.579 | 40% | 0.399 | S | S | * | . | H | α-helix | trans | -68.6 | -32.4 | 179.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | V161 | V161-A165 PolarHBondContact O-N 3.34Å |
| 166 | L | 69.9 | Low | 70.1 | Confident | 98 Ų | 98 | 66.4 Ų | 66.4 | 51% | 0.513 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -97 | -13.3 | -177.7 | -61.9 | -179.7 | 0 | 0 | 0 | 114 | T162 A164 E168 L182 | T162-L166 HydrophobicContact CG2-CD1 3.52Å; T162-L166 HydrophobicContact CG2-CG 4.2Å; T162-L166 VanDerWaalsContact O-CB 3.25Å; T162-L166 WeakPolarHBondContact O-CB 3.42Å; T162-L166 VanDerWaalsContact O-CG 3.28Å; T162-L166 WeakPolarHBondContact O-CG 2.94Å; T162-L166 PolarHBondContact O-N 2.98Å; A164-L166 VanDerWaalsContact C-N 3.34Å; A164-L166 PolarHBondContact O-N 3.13Å; L166-E168 PolarHBondContact O-N 3.41Å; L166-L182 HydrophobicContact CB-CD1 3.96Å; L166-L182 HydrophobicContact CD1-CD1 4.02Å |
| 167 | G | 60.7 | Low | 68.9 | Low | 13 Ų | 13 | 73.7 Ų | 73.7 | 13% | 0.134 | 43% | 0.433 | C | S | . | . | H | α-helix | trans | -67.6 | -21.9 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | C163 R169 | C163-G167 WeakPolarHBondContact O-CA 3.25Å; C163-G167 PolarHBondContact O-N 2.93Å; G167-R169 PolarHBondContact O-N 3Å |
| 168 | E | 53.6 | Low | 67.9 | Low | 96 Ų | 96 | 78.8 Ų | 78.8 | 45% | 0.449 | 45% | 0.448 | S | S | . | . | S | Bend | trans | -102.9 | 79.5 | -172.3 | -161.4 | 175.3 | -130 | 0 | 0 | 110.4 | T102 L166 | T102-E168 WeakPolarHBondContact CB-OE1 3.48Å; T102-E168 VanDerWaalsContact CG2-CD 3.47Å; T102-E168 WeakPolarHBondContact CG2-OE1 3.42Å; T102-E168 WeakPolarHBondContact CG2-OE2 3.33Å; T102-E168 PolarHBondContact OG1-OE1 2.9Å; T102-E168 PolarHBondContact OG1-OE2 2.99Å; L166-E168 PolarHBondContact O-N 3.41Å |
| 169 | R | 47 | Very low | 67 | Low | 217 Ų | 217 | 77 Ų | 77 | 82% | 0.819 | 44% | 0.435 | S | S | * | . | S | Bend | trans | 168.9 | 101.9 | 152.9 | -97.1 | 156.1 | 174.4 | -166 | -2.1 | 113.4 | G167 K175 | G167-R169 PolarHBondContact O-N 3Å; R169-K175 WeakPolarHBondContact O-CD 3.32Å |
| 170 | G | 44.6 | Very low | 66.3 | Low | 47 Ų | 47 | 78.1 Ų | 78.1 | 49% | 0.485 | 44% | 0.437 | S | S | . | . | trans | 112.2 | 108.9 | 135.6 | 0 | 0 | 0 | 0 | 0 | 115.6 | S172 K175 | G170-S172 PolarHBondContact O-N 3.32Å; G170-K175 WeakPolarHBondContact O-CB 3.47Å | ||
| 171 | S | 48.2 | Very low | 66 | Low | 131 Ų | 131 | 84.5 Ų | 84.5 | 92% | 0.916 | 47% | 0.465 | S | S | * | . | trans | -61.8 | 78.2 | 161.9 | 179.3 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 172 | S | 53.7 | Low | 65.7 | Low | 64 Ų | 64 | 84.3 Ų | 84.3 | 45% | 0.448 | 46% | 0.461 | S | S | . | . | trans | -135.2 | 139.4 | 157.7 | 88.4 | 0 | 0 | 0 | 0 | 109.1 | G170 E174 K175 G176 | G170-S172 PolarHBondContact O-N 3.32Å; S172-E174 PolarHBondContact O-N 3.34Å; S172-K175 PolarHBondContact O-N 3.42Å; S172-G176 PolarHBondContact O-N 2.88Å; S172-G176 VanDerWaalsContact O-N 3.12Å | ||
| 173 | G | 59 | Low | 65.5 | Low | 66 Ų | 66 | 81.5 Ų | 81.5 | 68% | 0.68 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -57 | -18.8 | -164.8 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||
| 174 | E | 61.9 | Low | 65.7 | Low | 144 Ų | 144 | 82.7 Ų | 82.7 | 67% | 0.673 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -86.1 | -36.2 | 173.8 | -159.8 | 178.1 | 155.9 | 0 | 0 | 112.8 | S172 R178 | S172-E174 PolarHBondContact O-N 3.34Å; E174-R178 WeakPolarHBondContact O-CG 3.41Å; E174-R178 PolarHBondContact O-N 3.27Å |
| 175 | K | 60.6 | Low | 66.3 | Low | 104 Ų | 104 | 85.7 Ų | 85.7 | 45% | 0.452 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -68.4 | -40.7 | 175.3 | -75.8 | -174.9 | 172.6 | -172.1 | 0 | 112 | R169 G170 S172 K177 R178 T179 | R169-K175 WeakPolarHBondContact O-CD 3.32Å; G170-K175 WeakPolarHBondContact O-CB 3.47Å; S172-K175 PolarHBondContact O-N 3.42Å; K175-K177 VanDerWaalsContact C-N 3.29Å; K175-K177 PolarHBondContact O-N 2.98Å; K175-R178 WeakPolarHBondContact O-CB 3.34Å; K175-R178 PolarHBondContact O-N 2.94Å; K175-T179 PolarHBondContact O-N 3.42Å; K175-T179 PolarHBondContact O-OG1 2.82Å; K175-T179 VanDerWaalsContact O-OG1 3.09Å |
| 176 | G | 66 | Low | 66.8 | Low | 42 Ų | 42 | 83.2 Ų | 83.2 | 43% | 0.433 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -58.1 | -37.8 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | S172 T179 W180 | S172-G176 PolarHBondContact O-N 2.88Å; S172-G176 VanDerWaalsContact O-N 3.12Å; G176-T179 PolarHBondContact O-N 3.32Å; G176-W180 WeakPolarHBondContact O-CB 3.33Å; G176-W180 PolarHBondContact O-N 2.83Å |
| 177 | K | 68.9 | Low | 67.6 | Low | 153 Ų | 153 | 79.2 Ų | 79.2 | 67% | 0.665 | 42% | 0.422 | S | S | * | . | H | α-helix | trans | -67.1 | -35.5 | 174.8 | -70.1 | 178.2 | -177.4 | 178.6 | 0 | 112.7 | K175 K181 | K175-K177 VanDerWaalsContact C-N 3.29Å; K175-K177 PolarHBondContact O-N 2.98Å; K177-K181 WeakPolarHBondContact O-CG 3.47Å; K177-K181 PolarHBondContact O-N 3.06Å; K177-K181 VanDerWaalsContact O-N 3.12Å |
| 178 | R | 70.9 | Confident | 68.9 | Low | 167 Ų | 167 | 82 Ų | 82 | 63% | 0.63 | 43% | 0.433 | S | S | * | . | H | α-helix | trans | -70.8 | -43.9 | 177.1 | -64.3 | 174.9 | 82.4 | 109.1 | 0.5 | 110.4 | E174 K175 W180 K181 L182 | E174-R178 WeakPolarHBondContact O-CG 3.41Å; E174-R178 PolarHBondContact O-N 3.27Å; K175-R178 WeakPolarHBondContact O-CB 3.34Å; K175-R178 PolarHBondContact O-N 2.94Å; R178-W180 PolarHBondContact O-N 3.46Å; R178-K181 PolarHBondContact O-N 3.48Å; R178-L182 WeakPolarHBondContact O-CG 3.31Å; R178-L182 PolarHBondContact O-N 3.47Å |
| 179 | T | 72.8 | Confident | 70.7 | Confident | 27 Ų | 27 | 79.3 Ų | 79.3 | 17% | 0.166 | 42% | 0.423 | C | S | . | . | H | α-helix | trans | -56.9 | -49.3 | 173.8 | -57.1 | 0 | 0 | 0 | 0 | 110.4 | K175 G176 K181 L182 V183 W266 | K175-T179 PolarHBondContact O-N 3.42Å; K175-T179 PolarHBondContact O-OG1 2.82Å; K175-T179 VanDerWaalsContact O-OG1 3.09Å; G176-T179 PolarHBondContact O-N 3.32Å; T179-K181 PolarHBondContact O-N 3.44Å; T179-L182 WeakPolarHBondContact O-CB 3.18Å; T179-L182 PolarHBondContact O-N 3.19Å; T179-V183 PolarHBondContact O-N 3.35Å; T179-W266 HydrophobicContact CG2-CB 4.07Å; T179-W266 HydrophobicContact CG2-CG 3.75Å; T179-W266 PolarHBondContact O-NE1 3.37Å |
| 180 | W | 74.8 | Confident | 72.8 | Confident | 56 Ų | 56 | 69.4 Ų | 69.4 | 21% | 0.212 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -54.7 | -49 | 175.6 | -176.3 | 91.9 | 0 | 0 | 0 | 112.9 | G176 R178 L182 V183 L184 W266 | G176-W180 WeakPolarHBondContact O-CB 3.33Å; G176-W180 PolarHBondContact O-N 2.83Å; R178-W180 PolarHBondContact O-N 3.46Å; W180-L182 VanDerWaalsContact C-N 3.3Å; W180-L182 PolarHBondContact O-N 3.01Å; W180-V183 PolarHBondContact O-N 3.18Å; W180-L184 HydrophobicContact CH2-CD2 3.64Å; W180-L184 HydrophobicContact CZ2-CD2 4.39Å; W180-L184 HydrophobicContact CZ3-CD2 3.75Å; W180-L184 PolarHBondContact O-N 3.42Å; W180-W266 VanDerWaalsContact CA-CE2 3.47Å; W180-W266 HydrophobicContact CB-CH2 4.3Å; W180-W266 HydrophobicContact CB-CZ2 4.05Å; W180-W266 AromaticContact CD1-CH2 2.97Å; W180-W266 AromaticContact CD1-CZ2 3.56Å; W180-W266 AromaticContact CD1-CZ3 3.5Å; W180-W266 AromaticContact CG-CH2 3.74Å; W180-W266 HydrophobicContact CG-CH2 3.74Å; W180-W266 AromaticContact CG-CZ2 3.85Å; W180-W266 HydrophobicContact CG-CZ2 3.85Å; W180-W266 HydrophobicContact CG-CZ3 4.45Å; W180-W266 AromaticContact NE1-CH2 3.41Å; W180-W266 WeakPolarHBondContact O-CZ2 3.39Å |
| 181 | K | 78.9 | Confident | 75 | Confident | 134 Ų | 134 | 67.5 Ų | 67.5 | 58% | 0.583 | 37% | 0.365 | S | S | * | . | H | α-helix | trans | -60 | -39.2 | 176.5 | -73.6 | 179.6 | -178.7 | -175.4 | 0 | 112.5 | K177 R178 T179 L184 V185 | K177-K181 WeakPolarHBondContact O-CG 3.47Å; K177-K181 PolarHBondContact O-N 3.06Å; K177-K181 VanDerWaalsContact O-N 3.12Å; R178-K181 PolarHBondContact O-N 3.48Å; T179-K181 PolarHBondContact O-N 3.44Å; K181-L184 PolarHBondContact O-N 3.07Å; K181-V185 VanDerWaalsContact O-CG2 3.3Å; K181-V185 WeakPolarHBondContact O-CG2 3.34Å; K181-V185 PolarHBondContact O-N 2.69Å |
| 182 | L | 80.1 | Confident | 77.3 | Confident | 58 Ų | 58 | 66.2 Ų | 66.2 | 30% | 0.304 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -62.8 | -43.6 | -179.4 | -74.4 | 171.3 | 0 | 0 | 0 | 112.5 | L166 R178 T179 W180 V185 R186 | L166-L182 HydrophobicContact CB-CD1 3.96Å; L166-L182 HydrophobicContact CD1-CD1 4.02Å; R178-L182 WeakPolarHBondContact O-CG 3.31Å; R178-L182 PolarHBondContact O-N 3.47Å; T179-L182 WeakPolarHBondContact O-CB 3.18Å; T179-L182 PolarHBondContact O-N 3.19Å; W180-L182 VanDerWaalsContact C-N 3.3Å; W180-L182 PolarHBondContact O-N 3.01Å; L182-V185 PolarHBondContact O-N 3.45Å; L182-R186 PolarHBondContact O-N 3.42Å |
| 183 | V | 76.9 | Confident | 79.2 | Confident | 4 Ų | 4 | 63.6 Ų | 63.6 | 2% | 0.024 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -80 | -27.6 | 178.1 | 167.8 | 0 | 0 | 0 | 0 | 112.4 | T179 W180 V185 R186 V187 L251 W266 | T179-V183 PolarHBondContact O-N 3.35Å; W180-V183 PolarHBondContact O-N 3.18Å; V183-V185 VanDerWaalsContact C-N 3.27Å; V183-V185 PolarHBondContact O-N 3.14Å; V183-R186 WeakPolarHBondContact O-CB 3.48Å; V183-R186 PolarHBondContact O-N 3.31Å; V183-V187 HydrophobicContact CG1-CG2 3.95Å; V183-V187 WeakPolarHBondContact O-CB 3.36Å; V183-V187 VanDerWaalsContact O-CG2 3.3Å; V183-V187 WeakPolarHBondContact O-CG2 3.39Å; V183-V187 PolarHBondContact O-N 2.85Å; V183-L251 HydrophobicContact CG1-CD1 3.99Å; V183-W266 HydrophobicContact CB-CD2 4.33Å; V183-W266 HydrophobicContact CB-CZ2 3.47Å; V183-W266 VanDerWaalsContact CB-CZ2 3.47Å; V183-W266 HydrophobicContact CG1-CZ2 3.78Å; V183-W266 HydrophobicContact CG2-CD2 4.4Å; V183-W266 HydrophobicContact CG2-CG 4.07Å; V183-W266 HydrophobicContact CG2-CZ2 4.36Å |
| 184 | L | 83.3 | Confident | 80.9 | Confident | 31 Ų | 31 | 60.5 Ų | 60.5 | 16% | 0.162 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -55.9 | -48.3 | 166.3 | 177.4 | 69.6 | 0 | 0 | 0 | 110.3 | W180 K181 R186 V187 I188 L248 L251 | W180-L184 HydrophobicContact CH2-CD2 3.64Å; W180-L184 HydrophobicContact CZ2-CD2 4.39Å; W180-L184 HydrophobicContact CZ3-CD2 3.75Å; W180-L184 PolarHBondContact O-N 3.42Å; K181-L184 PolarHBondContact O-N 3.07Å; L184-R186 VanDerWaalsContact C-N 3.34Å; L184-R186 PolarHBondContact O-N 3.45Å; L184-V187 PolarHBondContact O-N 3.24Å; L184-I188 HydrophobicContact CD1-CD1 3.73Å; L184-I188 HydrophobicContact CD1-CG1 4.23Å; L184-I188 HydrophobicContact CD2-CD1 4.48Å; L184-I188 HydrophobicContact CG-CD1 3.8Å; L184-I188 WeakPolarHBondContact O-CB 3.14Å; L184-I188 VanDerWaalsContact O-CG1 3.28Å; L184-I188 WeakPolarHBondContact O-CG1 3.33Å; L184-I188 PolarHBondContact O-N 2.9Å; L184-L248 HydrophobicContact CD1-CD1 4.45Å; L184-L251 HydrophobicContact CB-CD2 3.95Å; L184-L251 HydrophobicContact CD1-CD2 3.35Å; L184-L251 HydrophobicContact CG-CD2 4.26Å |
| 185 | V | 85.1 | Confident | 82.5 | Confident | 77 Ų | 77 | 55.1 Ų | 55.1 | 47% | 0.467 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -60.8 | -44.2 | 175.4 | 171.2 | 0 | 0 | 0 | 0 | 110.7 | K181 L182 V183 V189 | K181-V185 VanDerWaalsContact O-CG2 3.3Å; K181-V185 WeakPolarHBondContact O-CG2 3.34Å; K181-V185 PolarHBondContact O-N 2.69Å; L182-V185 PolarHBondContact O-N 3.45Å; V183-V185 VanDerWaalsContact C-N 3.27Å; V183-V185 PolarHBondContact O-N 3.14Å; V185-V189 HydrophobicContact CG1-CG2 4.09Å; V185-V189 WeakPolarHBondContact O-CB 3.41Å; V185-V189 VanDerWaalsContact O-CG2 3.24Å; V185-V189 WeakPolarHBondContact O-CG2 3.28Å; V185-V189 PolarHBondContact O-N 3.5Å |
| 186 | R | 86.6 | Confident | 84.2 | Confident | 19 Ų | 19 | 54.2 Ų | 54.2 | 7% | 0.072 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -56.4 | -52.2 | 176 | -176.4 | -171.7 | 173.7 | -146.6 | -4.5 | 112.6 | I159 N160 C163 L182 V183 L184 N190 Y267 | I159-R186 HydrophobicContact CG2-CB 3.98Å; I159-R186 HydrophobicContact CG2-CG 4Å; N160-R186 PolarHBondContact OD1-NE 3.41Å; N160-R186 PolarHBondContact OD1-NH2 2.91Å; C163-R186 VanDerWaalsContact SG-CB 3.59Å; L182-R186 PolarHBondContact O-N 3.42Å; V183-R186 WeakPolarHBondContact O-CB 3.48Å; V183-R186 PolarHBondContact O-N 3.31Å; L184-R186 VanDerWaalsContact C-N 3.34Å; L184-R186 PolarHBondContact O-N 3.45Å; R186-N190 WeakPolarHBondContact O-CB 3.25Å; R186-N190 PolarHBondContact O-N 3.13Å; R186-Y267 PolarHBondContact NH1-O 3.03Å |
| 187 | V | 85.8 | Confident | 85.5 | Confident | 14 Ų | 14 | 52.4 Ų | 52.4 | 9% | 0.085 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -61 | -52.1 | -177.7 | 167.9 | 0 | 0 | 0 | 0 | 109.4 | V183 L184 V189 D191 N247 L251 | V183-V187 HydrophobicContact CG1-CG2 3.95Å; V183-V187 WeakPolarHBondContact O-CB 3.36Å; V183-V187 VanDerWaalsContact O-CG2 3.3Å; V183-V187 WeakPolarHBondContact O-CG2 3.39Å; V183-V187 PolarHBondContact O-N 2.85Å; L184-V187 PolarHBondContact O-N 3.24Å; V187-V189 PolarHBondContact O-N 2.99Å; V187-D191 WeakPolarHBondContact CG1-OD2 3.14Å; V187-D191 VanDerWaalsContact O-CB 3.29Å; V187-D191 WeakPolarHBondContact O-CB 3.28Å; V187-D191 PolarHBondContact O-N 3.26Å; V187-N247 HydrophobicContact CG1-CB 3.7Å; V187-L251 HydrophobicContact CB-CD2 4.46Å; V187-L251 HydrophobicContact CG2-CD2 4.5Å |
| 188 | I | 88.9 | Confident | 86.7 | Confident | 71 Ų | 71 | 45.2 Ų | 45.2 | 36% | 0.364 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -58.8 | -51.5 | 179.8 | -68.8 | 172.9 | 0 | 0 | 0 | 110.8 | L184 L192 | L184-I188 HydrophobicContact CD1-CD1 3.73Å; L184-I188 HydrophobicContact CD1-CG1 4.23Å; L184-I188 HydrophobicContact CD2-CD1 4.48Å; L184-I188 HydrophobicContact CG-CD1 3.8Å; L184-I188 WeakPolarHBondContact O-CB 3.14Å; L184-I188 VanDerWaalsContact O-CG1 3.28Å; L184-I188 WeakPolarHBondContact O-CG1 3.33Å; L184-I188 PolarHBondContact O-N 2.9Å; I188-L192 HydrophobicContact CG2-CD1 3.63Å; I188-L192 HydrophobicContact CG2-CG 4.31Å; I188-L192 VanDerWaalsContact O-CB 3.24Å; I188-L192 WeakPolarHBondContact O-CB 3.42Å; I188-L192 WeakPolarHBondContact O-CG 3.49Å; I188-L192 PolarHBondContact O-N 2.89Å |
| 189 | V | 90.9 | Very high | 87.9 | Confident | 39 Ų | 39 | 40.7 Ų | 40.7 | 24% | 0.236 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -67.7 | -46.4 | -175.5 | 177.8 | 0 | 0 | 0 | 0 | 111 | I155 I159 V185 V187 D191 L192 L193 | I155-V189 HydrophobicContact CG2-CG1 4.46Å; I159-V189 HydrophobicContact CD1-CB 3.76Å; I159-V189 HydrophobicContact CD1-CG1 3.29Å; I159-V189 HydrophobicContact CD1-CG2 4.12Å; V185-V189 HydrophobicContact CG1-CG2 4.09Å; V185-V189 WeakPolarHBondContact O-CB 3.41Å; V185-V189 VanDerWaalsContact O-CG2 3.24Å; V185-V189 WeakPolarHBondContact O-CG2 3.28Å; V185-V189 PolarHBondContact O-N 3.5Å; V187-V189 PolarHBondContact O-N 2.99Å; V189-D191 PolarHBondContact O-N 2.78Å; V189-L192 PolarHBondContact O-N 3.02Å; V189-L193 HydrophobicContact CG1-CD1 3.72Å; V189-L193 HydrophobicContact CG1-CG 4.11Å; V189-L193 WeakPolarHBondContact O-CB 3.38Å; V189-L193 WeakPolarHBondContact O-CG 3.26Å; V189-L193 PolarHBondContact O-N 3.13Å |
| 190 | N | 91.2 | Very high | 89 | Confident | 10 Ų | 10 | 42.4 Ų | 42.4 | 5% | 0.053 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -59.4 | -48.3 | 179.7 | -74.4 | -3.5 | 0 | 0 | 0 | 111.6 | F156 N160 R186 L193 F194 | F156-N190 HydrophobicContact CD2-CB 4.41Å; F156-N190 HydrophobicContact CE2-CB 3.63Å; F156-N190 WeakPolarHBondContact CE2-OD1 3.32Å; F156-N190 HydrophobicContact CZ-CB 4.15Å; N160-N190 PolarHBondContact ND2-ND2 3.42Å; N160-N190 VanDerWaalsContact ND2-ND2 3.13Å; N160-N190 PolarHBondContact ND2-OD1 2.89Å; N160-N190 PolarHBondContact OD1-ND2 3Å; R186-N190 WeakPolarHBondContact O-CB 3.25Å; R186-N190 PolarHBondContact O-N 3.13Å; N190-L193 PolarHBondContact O-N 3.16Å; N190-F194 VanDerWaalsContact O-CD2 3.28Å; N190-F194 WeakPolarHBondContact O-CD2 3.31Å; N190-F194 PolarHBondContact O-N 2.95Å |
| 191 | D | 91.3 | Very high | 89.8 | Confident | 7 Ų | 7 | 40.4 Ų | 40.4 | 4% | 0.037 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -70.2 | -37.8 | -176.4 | -70.7 | -31.8 | 0 | 0 | 0 | 111.7 | V187 V189 L193 F194 I195 R243 A244 N247 | V187-D191 WeakPolarHBondContact CG1-OD2 3.14Å; V187-D191 VanDerWaalsContact O-CB 3.29Å; V187-D191 WeakPolarHBondContact O-CB 3.28Å; V187-D191 PolarHBondContact O-N 3.26Å; V189-D191 PolarHBondContact O-N 2.78Å; D191-L193 VanDerWaalsContact C-N 3.33Å; D191-L193 PolarHBondContact O-N 3.29Å; D191-F194 PolarHBondContact O-N 3.01Å; D191-I195 VanDerWaalsContact O-CG1 3.31Å; D191-I195 WeakPolarHBondContact O-CG1 3.44Å; D191-I195 PolarHBondContact O-N 3.29Å; D191-R243 IonicContact OD1-NE 2.68Å; D191-A244 HydrophobicContact CB-CB 3.68Å; D191-N247 PolarHBondContact OD1-ND2 2.86Å; D191-N247 VanDerWaalsContact OD1-ND2 3.11Å; D191-N247 WeakPolarHBondContact OD2-CB 3.43Å; D191-N247 PolarHBondContact OD2-ND2 3.41Å |
| 192 | L | 95.1 | Very high | 90.4 | Very high | 103 Ų | 103 | 34.5 Ų | 34.5 | 54% | 0.539 | 19% | 0.187 | S | C | . | . | H | α-helix | trans | -63.7 | -38 | 172.3 | -73 | 177.1 | 0 | 0 | 0 | 112.3 | I188 V189 I195 M196 | I188-L192 HydrophobicContact CG2-CD1 3.63Å; I188-L192 HydrophobicContact CG2-CG 4.31Å; I188-L192 VanDerWaalsContact O-CB 3.24Å; I188-L192 WeakPolarHBondContact O-CB 3.42Å; I188-L192 WeakPolarHBondContact O-CG 3.49Å; I188-L192 PolarHBondContact O-N 2.89Å; V189-L192 PolarHBondContact O-N 3.02Å; L192-I195 PolarHBondContact O-N 3.38Å; L192-M196 WeakPolarHBondContact O-CB 3.36Å; L192-M196 PolarHBondContact O-N 3.38Å |
| 193 | L | 95.3 | Very high | 91 | Very high | 9 Ų | 9 | 33.8 Ų | 33.8 | 5% | 0.047 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -64 | -43.5 | 175.3 | -73 | 174.3 | 0 | 0 | 0 | 111.3 | F117 M152 I155 F156 V189 N190 D191 M196 E197 | F117-L193 HydrophobicContact CE2-CB 3.72Å; F117-L193 HydrophobicContact CZ-CB 4.09Å; M152-L193 HydrophobicContact CB-CD2 4.49Å; M152-L193 HydrophobicContact CE-CD2 3.02Å; M152-L193 HydrophobicContact SD-CD2 3.74Å; I155-L193 HydrophobicContact CG2-CD1 4.41Å; F156-L193 HydrophobicContact CB-CD1 4.03Å; F156-L193 HydrophobicContact CD2-CB 4.32Å; F156-L193 HydrophobicContact CD2-CD1 3.77Å; F156-L193 HydrophobicContact CG-CD1 4.41Å; V189-L193 HydrophobicContact CG1-CD1 3.72Å; V189-L193 HydrophobicContact CG1-CG 4.11Å; V189-L193 WeakPolarHBondContact O-CB 3.38Å; V189-L193 WeakPolarHBondContact O-CG 3.26Å; V189-L193 PolarHBondContact O-N 3.13Å; N190-L193 PolarHBondContact O-N 3.16Å; D191-L193 VanDerWaalsContact C-N 3.33Å; D191-L193 PolarHBondContact O-N 3.29Å; L193-M196 PolarHBondContact O-N 3.48Å; L193-E197 WeakPolarHBondContact O-CB 3.3Å; L193-E197 WeakPolarHBondContact O-CG 3.37Å; L193-E197 PolarHBondContact O-N 3.19Å |
| 194 | F | 94 | Very high | 91.6 | Very high | 1 Ų | 1 | 34.3 Ų | 34.3 | 0% | 0.004 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -62.2 | -43.2 | 174.4 | -86.6 | -66.9 | 0 | 0 | 0 | 112.6 | V113 F117 F156 N190 D191 M196 E197 A198 F240 | V113-F194 HydrophobicContact CG1-CE2 4.23Å; V113-F194 HydrophobicContact CG1-CZ 4.43Å; F117-F194 HydrophobicContact CB-CE1 4.1Å; F117-F194 HydrophobicContact CB-CZ 3.78Å; F117-F194 HydrophobicContact CD2-CD1 4.05Å; F117-F194 HydrophobicContact CD2-CD2 4.43Å; F117-F194 AromaticContact CD2-CE1 3.86Å; F117-F194 HydrophobicContact CD2-CE1 3.86Å; F117-F194 HydrophobicContact CD2-CE2 4.25Å; F117-F194 HydrophobicContact CD2-CG 4.32Å; F117-F194 AromaticContact CD2-CZ 3.97Å; F117-F194 HydrophobicContact CD2-CZ 3.97Å; F117-F194 HydrophobicContact CG-CE1 4.49Å; F117-F194 HydrophobicContact CG-CZ 4.4Å; F156-F194 HydrophobicContact CE2-CD2 4.13Å; F156-F194 AromaticContact CE2-CE2 3.7Å; F156-F194 HydrophobicContact CE2-CE2 3.7Å; F156-F194 HydrophobicContact CE2-CZ 4.39Å; F156-F194 AromaticContact CZ-CE2 3.71Å; F156-F194 HydrophobicContact CZ-CE2 3.71Å; F156-F194 HydrophobicContact CZ-CZ 4.22Å; N190-F194 VanDerWaalsContact O-CD2 3.28Å; N190-F194 WeakPolarHBondContact O-CD2 3.31Å; N190-F194 PolarHBondContact O-N 2.95Å; D191-F194 PolarHBondContact O-N 3.01Å; F194-M196 VanDerWaalsContact C-N 3.34Å; F194-E197 PolarHBondContact O-N 2.96Å; F194-A198 WeakPolarHBondContact O-CB 3.29Å; F194-A198 PolarHBondContact O-N 3.45Å; F194-F240 HydrophobicContact CB-CB 4.44Å; F194-F240 HydrophobicContact CB-CD1 3.75Å; F194-F240 HydrophobicContact CB-CE1 4.21Å; F194-F240 HydrophobicContact CB-CG 4.17Å; F194-F240 AromaticContact CD1-CD1 3.93Å; F194-F240 HydrophobicContact CD1-CD1 3.93Å; F194-F240 AromaticContact CD1-CE1 3.48Å; F194-F240 HydrophobicContact CD1-CE1 3.48Å; F194-F240 VanDerWaalsContact CD1-CE1 3.48Å; F194-F240 HydrophobicContact CD1-CZ 4.02Å; F194-F240 HydrophobicContact CE1-CE1 4.07Å; F194-F240 AromaticContact CG-CD1 4Å; F194-F240 HydrophobicContact CG-CD1 4Å; F194-F240 HydrophobicContact CG-CE1 4.02Å |
| 195 | I | 95.1 | Very high | 91.9 | Very high | 31 Ų | 31 | 34.8 Ų | 34.8 | 16% | 0.159 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -63.6 | -42.3 | 176.1 | -68.4 | 165.2 | 0 | 0 | 0 | 110.5 | D191 L192 A198 V199 F240 F241 A244 | D191-I195 VanDerWaalsContact O-CG1 3.31Å; D191-I195 WeakPolarHBondContact O-CG1 3.44Å; D191-I195 PolarHBondContact O-N 3.29Å; L192-I195 PolarHBondContact O-N 3.38Å; I195-A198 WeakPolarHBondContact O-CB 3.47Å; I195-A198 PolarHBondContact O-N 3.34Å; I195-V199 HydrophobicContact CG2-CG2 4.43Å; I195-V199 WeakPolarHBondContact O-CG2 3.29Å; I195-V199 PolarHBondContact O-N 3.23Å; I195-F240 HydrophobicContact CG1-CB 4.16Å; I195-F241 HydrophobicContact CD1-CD2 4.27Å; I195-A244 HydrophobicContact CD1-CB 3.78Å |
| 196 | M | 95.8 | Very high | 92 | Very high | 86 Ų | 86 | 32.8 Ų | 32.8 | 42% | 0.424 | 18% | 0.182 | S | C | . | . | H | α-helix | trans | -61.1 | -49 | 177.5 | -170.6 | -164.7 | -58.2 | 0 | 0 | 111.2 | M152 L192 L193 F194 A198 V199 L200 | M152-M196 HydrophobicContact CE-CE 3.27Å; M152-M196 HydrophobicContact CE-SD 3.27Å; M152-M196 WeakPolarHBondContact CE-SD 3.33Å; L192-M196 WeakPolarHBondContact O-CB 3.36Å; L192-M196 PolarHBondContact O-N 3.38Å; L193-M196 PolarHBondContact O-N 3.48Å; F194-M196 VanDerWaalsContact C-N 3.34Å; M196-A198 PolarHBondContact O-N 3.33Å; M196-V199 PolarHBondContact O-N 3.31Å; M196-L200 HydrophobicContact CG-CD1 3.99Å; M196-L200 HydrophobicContact CG-CG 4.41Å; M196-L200 WeakPolarHBondContact O-CB 3.28Å; M196-L200 VanDerWaalsContact O-CG 3.28Å; M196-L200 WeakPolarHBondContact O-CG 3.42Å; M196-L200 PolarHBondContact O-N 3.34Å; M196-L200 HydrophobicContact SD-CD1 4.29Å |
| 197 | E | 94.8 | Very high | 92.1 | Very high | 4 Ų | 4 | 35.2 Ų | 35.2 | 2% | 0.019 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -59.1 | -36.6 | 175.6 | -72.4 | -80.5 | -172.2 | 0 | 0 | 111.4 | F117 F120 S121 N124 Y149 L193 F194 L200 L201 | F117-E197 HydrophobicContact CE2-CG 3.75Å; F117-E197 HydrophobicContact CZ-CG 3.9Å; F120-E197 HydrophobicContact CD1-CB 3.42Å; F120-E197 VanDerWaalsContact CD1-CB 3.42Å; F120-E197 HydrophobicContact CD1-CG 4.29Å; F120-E197 VanDerWaalsContact CE1-C 3.5Å; F120-E197 HydrophobicContact CE1-CB 3.39Å; S121-E197 VanDerWaalsContact CB-OE1 3.23Å; S121-E197 WeakPolarHBondContact CB-OE1 3.37Å; S121-E197 PolarHBondContact OG-OE1 3.15Å; N124-E197 VanDerWaalsContact CB-OE2 3.25Å; N124-E197 WeakPolarHBondContact CB-OE2 3.47Å; N124-E197 VanDerWaalsContact CG-OE2 3.3Å; N124-E197 PolarHBondContact ND2-O 3.46Å; N124-E197 PolarHBondContact ND2-OE2 3.28Å; Y149-E197 WeakPolarHBondContact CD1-OE1 3.32Å; Y149-E197 WeakPolarHBondContact CE1-OE2 3.27Å; L193-E197 WeakPolarHBondContact O-CB 3.3Å; L193-E197 WeakPolarHBondContact O-CG 3.37Å; L193-E197 PolarHBondContact O-N 3.19Å; F194-E197 PolarHBondContact O-N 2.96Å; E197-L200 PolarHBondContact O-N 3.26Å; E197-L201 WeakPolarHBondContact O-CB 3.32Å; E197-L201 PolarHBondContact O-N 3.33Å |
| 198 | A | 94.1 | Very high | 92 | Very high | 1 Ų | 1 | 35 Ų | 35 | 1% | 0.008 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -67.1 | -42.1 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | F120 F194 I195 M196 L201 A202 V236 I237 F240 | F120-A198 HydrophobicContact CE1-CB 4.32Å; F120-A198 HydrophobicContact CZ-CB 4.33Å; F194-A198 WeakPolarHBondContact O-CB 3.29Å; F194-A198 PolarHBondContact O-N 3.45Å; I195-A198 WeakPolarHBondContact O-CB 3.47Å; I195-A198 PolarHBondContact O-N 3.34Å; M196-A198 PolarHBondContact O-N 3.33Å; A198-L201 PolarHBondContact O-N 3.48Å; A198-A202 WeakPolarHBondContact O-CB 3.15Å; A198-A202 PolarHBondContact O-N 3.4Å; A198-V236 HydrophobicContact CB-CG1 4.05Å; A198-I237 HydrophobicContact CB-CG1 4.1Å; A198-F240 HydrophobicContact CB-CD2 3.65Å; A198-F240 HydrophobicContact CB-CE2 4.27Å |
| 199 | V | 95.8 | Very high | 91.7 | Very high | 72 Ų | 72 | 32.8 Ų | 32.8 | 44% | 0.436 | 18% | 0.184 | S | C | . | . | H | α-helix | trans | -66.3 | -43.1 | 175.3 | 172.4 | 0 | 0 | 0 | 0 | 110.6 | I195 M196 L201 A202 A203 I237 | I195-V199 HydrophobicContact CG2-CG2 4.43Å; I195-V199 WeakPolarHBondContact O-CG2 3.29Å; I195-V199 PolarHBondContact O-N 3.23Å; M196-V199 PolarHBondContact O-N 3.31Å; V199-L201 VanDerWaalsContact C-N 3.34Å; V199-L201 PolarHBondContact O-N 2.95Å; V199-A202 PolarHBondContact O-N 2.8Å; V199-A203 VanDerWaalsContact O-CB 3.25Å; V199-A203 WeakPolarHBondContact O-CB 3.13Å; V199-A203 PolarHBondContact O-N 2.87Å; V199-I237 HydrophobicContact CG2-CD1 4.05Å; V199-I237 HydrophobicContact CG2-CG1 4.14Å |
| 200 | L | 94.9 | Very high | 91.2 | Very high | 63 Ų | 63 | 38.9 Ų | 38.9 | 33% | 0.33 | 20% | 0.203 | S | C | . | . | H | α-helix | trans | -61.3 | -42.3 | 175.9 | -72.5 | 168.9 | 0 | 0 | 0 | 111.3 | Y149 M196 E197 A203 T204 | Y149-L200 HydrophobicContact CE1-CD1 4.18Å; M196-L200 HydrophobicContact CG-CD1 3.99Å; M196-L200 HydrophobicContact CG-CG 4.41Å; M196-L200 WeakPolarHBondContact O-CB 3.28Å; M196-L200 VanDerWaalsContact O-CG 3.28Å; M196-L200 WeakPolarHBondContact O-CG 3.42Å; M196-L200 PolarHBondContact O-N 3.34Å; M196-L200 HydrophobicContact SD-CD1 4.29Å; E197-L200 PolarHBondContact O-N 3.26Å; L200-A203 PolarHBondContact O-N 3.44Å; L200-T204 WeakPolarHBondContact O-CB 3.49Å; L200-T204 VanDerWaalsContact O-CG2 3.28Å; L200-T204 WeakPolarHBondContact O-CG2 3.45Å; L200-T204 PolarHBondContact O-N 2.98Å; L200-T204 PolarHBondContact O-OG1 3.42Å |
| 201 | L | 91.9 | Very high | 90.4 | Very high | 15 Ų | 15 | 41.7 Ų | 41.7 | 8% | 0.079 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -62.5 | -50.2 | 175.6 | -171.8 | 57.4 | 0 | 0 | 0 | 111.4 | F120 I123 N124 F127 E197 A198 V199 A203 T204 L205 | F120-L201 HydrophobicContact CD2-CD2 4.48Å; F120-L201 HydrophobicContact CE2-CD2 3.44Å; F120-L201 VanDerWaalsContact CE2-CD2 3.44Å; F120-L201 HydrophobicContact CZ-CB 4.36Å; F120-L201 HydrophobicContact CZ-CD2 3.79Å; I123-L201 HydrophobicContact CG2-CD1 4.35Å; N124-L201 WeakPolarHBondContact OD1-CA 3.18Å; N124-L201 WeakPolarHBondContact OD1-CB 3.32Å; N124-L201 VanDerWaalsContact OD1-CD1 3.23Å; N124-L201 WeakPolarHBondContact OD1-CD1 3.29Å; N124-L201 PolarHBondContact OD1-N 2.85Å; N124-L201 VanDerWaalsContact OD1-N 3.15Å; F127-L201 HydrophobicContact CD2-CD1 3.7Å; F127-L201 HydrophobicContact CE2-CD1 4.16Å; E197-L201 WeakPolarHBondContact O-CB 3.32Å; E197-L201 PolarHBondContact O-N 3.33Å; A198-L201 PolarHBondContact O-N 3.48Å; V199-L201 VanDerWaalsContact C-N 3.34Å; V199-L201 PolarHBondContact O-N 2.95Å; L201-A203 VanDerWaalsContact C-N 3.31Å; L201-A203 PolarHBondContact O-N 2.97Å; L201-T204 PolarHBondContact O-N 2.97Å; L201-T204 PolarHBondContact O-OG1 3.12Å; L201-L205 HydrophobicContact CD1-CD1 3.92Å; L201-L205 HydrophobicContact CD1-CG 4.06Å; L201-L205 HydrophobicContact CG-CD1 3.87Å; L201-L205 HydrophobicContact CG-CG 4.38Å; L201-L205 WeakPolarHBondContact O-CB 3.35Å; L201-L205 VanDerWaalsContact O-CG 3.22Å; L201-L205 WeakPolarHBondContact O-CG 3.39Å; L201-L205 PolarHBondContact O-N 3.45Å |
| 202 | A | 92.4 | Very high | 88.8 | Confident | 10 Ų | 10 | 45.2 Ų | 45.2 | 8% | 0.083 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -60.2 | -43.9 | 179.4 | 0 | 0 | 0 | 0 | 0 | 111.2 | A198 V199 L206 I237 | A198-A202 WeakPolarHBondContact O-CB 3.15Å; A198-A202 PolarHBondContact O-N 3.4Å; V199-A202 PolarHBondContact O-N 2.8Å; A202-L206 VanDerWaalsContact O-CB 3.29Å; A202-L206 WeakPolarHBondContact O-CB 3.4Å; A202-L206 WeakPolarHBondContact O-CG 3.49Å; A202-L206 PolarHBondContact O-N 2.94Å; A202-I237 HydrophobicContact CB-CD1 3.94Å |
| 203 | A | 92.2 | Very high | 86.8 | Confident | 43 Ų | 43 | 51.8 Ų | 51.8 | 36% | 0.355 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -64.1 | -49.2 | 178.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | V199 L200 L201 L205 L206 L207 | V199-A203 VanDerWaalsContact O-CB 3.25Å; V199-A203 WeakPolarHBondContact O-CB 3.13Å; V199-A203 PolarHBondContact O-N 2.87Å; L200-A203 PolarHBondContact O-N 3.44Å; L201-A203 VanDerWaalsContact C-N 3.31Å; L201-A203 PolarHBondContact O-N 2.97Å; A203-L205 PolarHBondContact O-N 3.17Å; A203-L206 PolarHBondContact O-N 3.39Å; A203-L207 WeakPolarHBondContact O-CB 3.2Å; A203-L207 VanDerWaalsContact O-CG 3.23Å; A203-L207 WeakPolarHBondContact O-CG 3.49Å; A203-L207 PolarHBondContact O-N 3.44Å |
| 204 | T | 89.9 | Confident | 84.5 | Confident | 14 Ų | 14 | 56.1 Ų | 56.1 | 9% | 0.086 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -63.6 | -42.1 | 179.9 | 51.6 | 0 | 0 | 0 | 0 | 111.8 | L200 L201 L207 L208 | L200-T204 WeakPolarHBondContact O-CB 3.49Å; L200-T204 VanDerWaalsContact O-CG2 3.28Å; L200-T204 WeakPolarHBondContact O-CG2 3.45Å; L200-T204 PolarHBondContact O-N 2.98Å; L200-T204 PolarHBondContact O-OG1 3.42Å; L201-T204 PolarHBondContact O-N 2.97Å; L201-T204 PolarHBondContact O-OG1 3.12Å; T204-L207 PolarHBondContact O-N 2.87Å; T204-L208 VanDerWaalsContact O-CB 3.3Å; T204-L208 WeakPolarHBondContact O-CB 3.43Å; T204-L208 PolarHBondContact O-N 2.94Å |
| 205 | L | 88 | Confident | 82.3 | Confident | 41 Ų | 41 | 62.8 Ų | 62.8 | 22% | 0.215 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -64.5 | -42 | 175.2 | -69.2 | 176.5 | 0 | 0 | 0 | 112.1 | F127 L201 A203 L208 T209 T229 | F127-L205 HydrophobicContact CD1-CD2 4.02Å; F127-L205 HydrophobicContact CD2-CD2 4.28Å; F127-L205 HydrophobicContact CE1-CD2 4Å; F127-L205 HydrophobicContact CE2-CD2 4.23Å; F127-L205 HydrophobicContact CG-CD2 4.17Å; F127-L205 HydrophobicContact CZ-CD2 4.1Å; L201-L205 HydrophobicContact CD1-CD1 3.92Å; L201-L205 HydrophobicContact CD1-CG 4.06Å; L201-L205 HydrophobicContact CG-CD1 3.87Å; L201-L205 HydrophobicContact CG-CG 4.38Å; L201-L205 WeakPolarHBondContact O-CB 3.35Å; L201-L205 VanDerWaalsContact O-CG 3.22Å; L201-L205 WeakPolarHBondContact O-CG 3.39Å; L201-L205 PolarHBondContact O-N 3.45Å; A203-L205 PolarHBondContact O-N 3.17Å; L205-L208 PolarHBondContact O-N 3.49Å; L205-T209 VanDerWaalsContact O-CG2 3.28Å; L205-T209 WeakPolarHBondContact O-CG2 3.3Å; L205-T209 PolarHBondContact O-N 3.35Å; L205-T209 PolarHBondContact O-OG1 3.2Å; L205-T229 HydrophobicContact CB-CG2 3.74Å |
| 206 | L | 88 | Confident | 80.1 | Confident | 36 Ų | 36 | 62.3 Ų | 62.3 | 19% | 0.188 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -63.4 | -45 | 175.8 | -77.9 | 171.9 | 0 | 0 | 0 | 111.9 | A202 A203 L208 T209 R210 V226 T229 A230 | A202-L206 VanDerWaalsContact O-CB 3.29Å; A202-L206 WeakPolarHBondContact O-CB 3.4Å; A202-L206 WeakPolarHBondContact O-CG 3.49Å; A202-L206 PolarHBondContact O-N 2.94Å; A203-L206 PolarHBondContact O-N 3.39Å; L206-L208 VanDerWaalsContact C-N 3.3Å; L206-L208 PolarHBondContact O-N 3.31Å; L206-T209 PolarHBondContact O-N 2.86Å; L206-T209 PolarHBondContact O-OG1 2.87Å; L206-R210 WeakPolarHBondContact O-CG 3.09Å; L206-R210 PolarHBondContact O-N 3.25Å; L206-R210 VanDerWaalsContact O-N 3.13Å; L206-V226 HydrophobicContact CD2-CG1 4.24Å; L206-T229 HydrophobicContact CD2-CG2 4.33Å; L206-A230 HydrophobicContact CD2-CB 3.85Å |
| 207 | L | 88.4 | Confident | 78 | Confident | 69 Ų | 69 | 62.9 Ų | 62.9 | 36% | 0.361 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -61 | -41.4 | 175.8 | -71.6 | 170.9 | 0 | 0 | 0 | 111.1 | F131 A203 T204 T209 R210 Q211 | F131-L207 HydrophobicContact CD2-CB 4.03Å; F131-L207 HydrophobicContact CE1-CD1 4.11Å; F131-L207 HydrophobicContact CE2-CB 3.57Å; F131-L207 HydrophobicContact CE2-CD1 4.45Å; F131-L207 HydrophobicContact CE2-CG 4.49Å; F131-L207 HydrophobicContact CZ-CB 3.91Å; F131-L207 HydrophobicContact CZ-CD1 3.94Å; F131-L207 HydrophobicContact CZ-CG 4.37Å; A203-L207 WeakPolarHBondContact O-CB 3.2Å; A203-L207 VanDerWaalsContact O-CG 3.23Å; A203-L207 WeakPolarHBondContact O-CG 3.49Å; A203-L207 PolarHBondContact O-N 3.44Å; T204-L207 PolarHBondContact O-N 2.87Å; L207-T209 PolarHBondContact O-N 3.07Å; L207-R210 PolarHBondContact O-N 3.32Å; L207-Q211 PolarHBondContact O-N 2.99Å |
| 208 | L | 84.5 | Confident | 75.7 | Confident | 9 Ų | 9 | 66.1 Ų | 66.1 | 5% | 0.047 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -64.9 | -36.9 | 177.4 | -165.8 | 67 | 0 | 0 | 0 | 112.3 | F127 V130 I134 T204 L205 L206 R210 L219 | F127-L208 HydrophobicContact CD1-CD2 4.45Å; V130-L208 HydrophobicContact CG1-CD1 4.31Å; I134-L208 HydrophobicContact CD1-CD1 3.53Å; T204-L208 VanDerWaalsContact O-CB 3.3Å; T204-L208 WeakPolarHBondContact O-CB 3.43Å; T204-L208 PolarHBondContact O-N 2.94Å; L205-L208 PolarHBondContact O-N 3.49Å; L206-L208 VanDerWaalsContact C-N 3.3Å; L206-L208 PolarHBondContact O-N 3.31Å; L208-R210 VanDerWaalsContact C-N 3.3Å; L208-R210 PolarHBondContact O-N 2.87Å; L208-L219 HydrophobicContact CB-CD1 4.44Å; L208-L219 HydrophobicContact CD2-CD1 4.17Å; L208-L219 HydrophobicContact CG-CD1 4.01Å |
| 209 | T | 81.6 | Confident | 73.6 | Confident | 26 Ų | 26 | 67.5 Ų | 67.5 | 16% | 0.16 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -72.5 | -20.2 | 175.5 | 61.4 | 0 | 0 | 0 | 0 | 114.2 | L205 L206 L207 L219 T229 | L205-T209 VanDerWaalsContact O-CG2 3.28Å; L205-T209 WeakPolarHBondContact O-CG2 3.3Å; L205-T209 PolarHBondContact O-N 3.35Å; L205-T209 PolarHBondContact O-OG1 3.2Å; L206-T209 PolarHBondContact O-N 2.86Å; L206-T209 PolarHBondContact O-OG1 2.87Å; L207-T209 PolarHBondContact O-N 3.07Å; T209-L219 HydrophobicContact CG2-CD1 3.68Å; T209-T229 HydrophobicContact CG2-CG2 3.95Å; T209-T229 WeakPolarHBondContact CG2-OG1 3.12Å |
| 210 | R | 81.3 | Confident | 71.1 | Confident | 167 Ų | 167 | 71.2 Ų | 71.2 | 63% | 0.63 | 36% | 0.36 | S | S | * | . | H | α-helix | trans | -87.1 | -14.7 | 178.9 | -75.6 | 178.7 | 176.2 | 150.6 | -1 | 113.5 | L206 L207 L208 | L206-R210 WeakPolarHBondContact O-CG 3.09Å; L206-R210 PolarHBondContact O-N 3.25Å; L206-R210 VanDerWaalsContact O-N 3.13Å; L207-R210 PolarHBondContact O-N 3.32Å; L208-R210 VanDerWaalsContact C-N 3.3Å; L208-R210 PolarHBondContact O-N 2.87Å |
| 211 | Q | 74.1 | Confident | 68.7 | Low | 68 Ų | 68 | 71.7 Ų | 71.7 | 32% | 0.318 | 37% | 0.369 | S | S | . | . | S | Bend | trans | -66.1 | 148.3 | 176.9 | -66.5 | -56.2 | -39.3 | 0 | 0 | 111.4 | F131 I134 L207 | F131-Q211 HydrophobicContact CE2-CG 4.44Å; I134-Q211 HydrophobicContact CG2-CG 4.42Å; L207-Q211 PolarHBondContact O-N 2.99Å |
| 212 | P | 58.4 | Low | 66.8 | Low | 81 Ų | 81 | 73.9 Ų | 73.9 | 53% | 0.526 | 38% | 0.378 | S | S | . | . | trans | -58.4 | 142.5 | -177.5 | 19.5 | -29 | 0 | 0 | 0 | 112.5 | S214 F215 | P212-S214 PolarHBondContact O-N 3.42Å; P212-F215 PolarHBondContact O-N 3.28Å | ||
| 213 | R | 52 | Low | 65 | Low | 242 Ų | 242 | 76.1 Ų | 76.1 | 91% | 0.913 | 40% | 0.401 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.6 | -5.2 | -165.5 | -68.9 | 178.1 | 178.2 | 129.9 | -1.5 | 116.4 | ||
| 214 | S | 47.1 | Very low | 63.6 | Low | 99 Ų | 99 | 75.8 Ų | 75.8 | 69% | 0.692 | 40% | 0.395 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87 | -18.7 | -178.4 | 51.3 | 0 | 0 | 0 | 0 | 114.7 | P212 | P212-S214 PolarHBondContact O-N 3.42Š|
| 215 | F | 47.7 | Very low | 63 | Low | 141 Ų | 141 | 79.1 Ų | 79.1 | 62% | 0.618 | 42% | 0.415 | S | S | * | . | S | Bend | trans | -107.4 | -6 | -171 | -91.8 | -87.6 | 0 | 0 | 0 | 115.8 | I134 P212 P217 | I134-F215 HydrophobicContact CG2-CB 4.28Å; P212-F215 PolarHBondContact O-N 3.28Å; F215-P217 VanDerWaalsContact C-CD 3.43Å; F215-P217 WeakPolarHBondContact O-CD 3.34Å |
| 216 | S | 49.8 | Very low | 62.7 | Low | 22 Ų | 22 | 80.1 Ų | 80.1 | 15% | 0.154 | 42% | 0.423 | C | S | . | . | trans | -125.1 | 68.9 | -179 | -171.6 | 0 | 0 | 0 | 0 | 112.6 | Y218 L219 M220 | S216-Y218 PolarHBondContact O-N 2.85Å; S216-Y218 VanDerWaalsContact O-N 3.15Å; S216-L219 PolarHBondContact O-N 3.15Å; S216-M220 PolarHBondContact O-N 3.02Å | ||
| 217 | P | 50.1 | Low | 62.4 | Low | 97 Ų | 97 | 83.2 Ų | 83.2 | 63% | 0.63 | 45% | 0.447 | S | S | * | . | H | α-helix | trans | -59.7 | -22 | 172.3 | 23 | -30.9 | 0 | 0 | 0 | 112.4 | F215 M220 S221 | F215-P217 VanDerWaalsContact C-CD 3.43Å; F215-P217 WeakPolarHBondContact O-CD 3.34Å; P217-M220 WeakPolarHBondContact O-CB 3.41Å; P217-M220 PolarHBondContact O-N 3Å; P217-S221 PolarHBondContact O-N 3.12Å |
| 218 | Y | 48.1 | Very low | 62.3 | Low | 73 Ų | 73 | 86.7 Ų | 86.7 | 29% | 0.286 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -65.7 | -46.4 | 179 | -173.5 | -105.2 | 0 | 0 | 0 | 113.3 | S216 M220 S221 F305 | S216-Y218 PolarHBondContact O-N 2.85Å; S216-Y218 VanDerWaalsContact O-N 3.15Å; Y218-M220 VanDerWaalsContact C-N 3.31Å; Y218-S221 PolarHBondContact O-OG 3.02Å; Y218-F305 HydrophobicContact CE1-CE1 4.12Å; Y218-F305 AromaticContact CE1-CZ 3.84Å; Y218-F305 HydrophobicContact CE1-CZ 3.84Å; Y218-F305 WeakPolarHBondContact OH-CE1 3.49Å; Y218-F305 WeakPolarHBondContact OH-CZ 3.23Å |
| 219 | L | 49.9 | Very low | 62.3 | Low | 30 Ų | 30 | 86.9 Ų | 86.9 | 16% | 0.157 | 46% | 0.456 | C | S | . | . | H | α-helix | trans | -74.8 | -24.3 | 175.4 | -72.9 | 173.8 | 0 | 0 | 0 | 112.3 | L208 T209 S216 K222 G223 | L208-L219 HydrophobicContact CB-CD1 4.44Å; L208-L219 HydrophobicContact CD2-CD1 4.17Å; L208-L219 HydrophobicContact CG-CD1 4.01Å; T209-L219 HydrophobicContact CG2-CD1 3.68Å; S216-L219 PolarHBondContact O-N 3.15Å; L219-K222 PolarHBondContact O-N 3.14Å; L219-G223 PolarHBondContact O-N 2.83Å |
| 220 | M | 41.8 | Very low | 62.6 | Low | 149 Ų | 149 | 87.6 Ų | 87.6 | 73% | 0.734 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -66.3 | -38.4 | 178.7 | -155 | 178.8 | 155.8 | 0 | 0 | 111.7 | S216 P217 Y218 K222 G223 | S216-M220 PolarHBondContact O-N 3.02Å; P217-M220 WeakPolarHBondContact O-CB 3.41Å; P217-M220 PolarHBondContact O-N 3Å; Y218-M220 VanDerWaalsContact C-N 3.31Å; M220-K222 PolarHBondContact O-N 3.42Å; M220-G223 PolarHBondContact O-N 3.44Å |
| 221 | S | 45 | Very low | 62.9 | Low | 73 Ų | 73 | 82.2 Ų | 82.2 | 51% | 0.51 | 46% | 0.456 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -65.5 | -20.8 | 176 | 74.5 | 0 | 0 | 0 | 0 | 114.6 | P217 Y218 | P217-S221 PolarHBondContact O-N 3.12Å; Y218-S221 PolarHBondContact O-OG 3.02Å |
| 222 | K | 52.8 | Low | 63.5 | Low | 62 Ų | 62 | 83.8 Ų | 83.8 | 27% | 0.27 | 47% | 0.466 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -105.1 | -1.6 | -177.8 | -84.6 | -174.1 | 174.3 | 160.5 | 0 | 114.3 | L219 M220 T224 F305 | L219-K222 PolarHBondContact O-N 3.14Å; M220-K222 PolarHBondContact O-N 3.42Å; K222-T224 PolarHBondContact O-N 3.25Å; K222-F305 HydrophobicContact CD-CE2 4.09Å |
| 223 | G | 54.7 | Low | 65 | Low | 56 Ų | 56 | 80.3 Ų | 80.3 | 58% | 0.577 | 45% | 0.445 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 58.5 | 32 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | L219 M220 T225 | L219-G223 PolarHBondContact O-N 2.83Å; M220-G223 PolarHBondContact O-N 3.44Å; G223-T225 PolarHBondContact O-N 3.36Å |
| 224 | T | 63.3 | Low | 66.9 | Low | 37 Ų | 37 | 70.7 Ų | 70.7 | 23% | 0.227 | 42% | 0.417 | C | S | . | . | trans | -80.6 | 113.4 | -171.9 | -37.4 | 0 | 0 | 0 | 0 | 110.8 | K222 R228 T229 | K222-T224 PolarHBondContact O-N 3.25Å; T224-R228 HydrophobicContact CG2-CB 4.47Å; T224-R228 HydrophobicContact CG2-CG 4.46Å; T224-T229 WeakPolarHBondContact CG2-OG1 3.37Å | ||
| 225 | T | 77 | Confident | 69.1 | Low | 83 Ų | 83 | 70.4 Ų | 70.4 | 51% | 0.509 | 41% | 0.411 | S | S | . | . | trans | -75.9 | 157 | 173 | 64.5 | 0 | 0 | 0 | 0 | 111.2 | G223 C227 R228 T229 | G223-T225 PolarHBondContact O-N 3.36Å; T225-C227 VanDerWaalsContact C-N 3.27Å; T225-C227 PolarHBondContact O-N 3.25Å; T225-R228 PolarHBondContact O-N 2.65Å; T225-R228 VanDerWaalsContact OG1-CB 3.27Å; T225-R228 WeakPolarHBondContact OG1-CB 3.33Å; T225-R228 PolarHBondContact OG1-N 2.97Å; T225-T229 PolarHBondContact O-N 3.43Å; T225-T229 PolarHBondContact O-OG1 2.94Å; T225-T229 VanDerWaalsContact O-OG1 3.05Å | ||
| 226 | V | 81.6 | Confident | 71.1 | Confident | 63 Ų | 63 | 65.8 Ų | 65.8 | 38% | 0.382 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -57.8 | -42.7 | 175.3 | 178.8 | 0 | 0 | 0 | 0 | 110.7 | L206 T229 A230 | L206-V226 HydrophobicContact CD2-CG1 4.24Å; V226-T229 PolarHBondContact O-N 3.23Å; V226-A230 WeakPolarHBondContact O-CB 3.5Å; V226-A230 PolarHBondContact O-N 3.46Å |
| 227 | C | 82.3 | Confident | 73.2 | Confident | 100 Ų | 100 | 67.1 Ų | 67.1 | 68% | 0.676 | 40% | 0.399 | S | S | * | . | H | α-helix | trans | -61.8 | -43.9 | 176.9 | -179.6 | 0 | 0 | 0 | 0 | 111.9 | T225 T229 A230 A231 | T225-C227 VanDerWaalsContact C-N 3.27Å; T225-C227 PolarHBondContact O-N 3.25Å; C227-T229 VanDerWaalsContact C-N 3.34Å; C227-T229 PolarHBondContact O-N 3.32Å; C227-A230 PolarHBondContact O-N 3.22Å; C227-A231 WeakPolarHBondContact O-CB 3.23Å; C227-A231 PolarHBondContact O-N 2.94Å |
| 228 | R | 84.6 | Confident | 75.3 | Confident | 143 Ų | 143 | 69.4 Ų | 69.4 | 54% | 0.54 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -63.2 | -40.3 | 176.7 | -173.3 | 177.8 | -175 | -175 | 3.2 | 111.9 | T224 T225 A231 L232 | T224-R228 HydrophobicContact CG2-CB 4.47Å; T224-R228 HydrophobicContact CG2-CG 4.46Å; T225-R228 PolarHBondContact O-N 2.65Å; T225-R228 VanDerWaalsContact OG1-CB 3.27Å; T225-R228 WeakPolarHBondContact OG1-CB 3.33Å; T225-R228 PolarHBondContact OG1-N 2.97Å; R228-A231 PolarHBondContact O-N 3.43Å; R228-L232 HydrophobicContact CG-CD1 4.32Å; R228-L232 WeakPolarHBondContact O-CB 3Å; R228-L232 VanDerWaalsContact O-CG 3.29Å; R228-L232 WeakPolarHBondContact O-CG 2.97Å; R228-L232 PolarHBondContact O-N 2.89Å |
| 229 | T | 84.9 | Confident | 77.4 | Confident | 12 Ų | 12 | 67.2 Ų | 67.2 | 7% | 0.074 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -67.9 | -41.1 | 176.8 | -52.5 | 0 | 0 | 0 | 0 | 111.6 | L205 L206 T209 T224 T225 V226 C227 L232 G233 | L205-T229 HydrophobicContact CB-CG2 3.74Å; L206-T229 HydrophobicContact CD2-CG2 4.33Å; T209-T229 HydrophobicContact CG2-CG2 3.95Å; T209-T229 WeakPolarHBondContact CG2-OG1 3.12Å; T224-T229 WeakPolarHBondContact CG2-OG1 3.37Å; T225-T229 PolarHBondContact O-N 3.43Å; T225-T229 PolarHBondContact O-OG1 2.94Å; T225-T229 VanDerWaalsContact O-OG1 3.05Å; V226-T229 PolarHBondContact O-N 3.23Å; C227-T229 VanDerWaalsContact C-N 3.34Å; C227-T229 PolarHBondContact O-N 3.32Å; T229-L232 PolarHBondContact O-N 2.83Å; T229-G233 PolarHBondContact O-N 2.69Å |
| 230 | A | 87.4 | Confident | 79.4 | Confident | 41 Ų | 41 | 66 Ų | 66 | 34% | 0.339 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -60.5 | -45.5 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | L206 V226 C227 G233 A234 | L206-A230 HydrophobicContact CD2-CB 3.85Å; V226-A230 WeakPolarHBondContact O-CB 3.5Å; V226-A230 PolarHBondContact O-N 3.46Å; C227-A230 PolarHBondContact O-N 3.22Å; A230-G233 PolarHBondContact O-N 2.97Å; A230-A234 WeakPolarHBondContact O-CB 3.47Å; A230-A234 PolarHBondContact O-N 3.45Å |
| 231 | A | 89 | Confident | 81.8 | Confident | 54 Ų | 54 | 64.1 Ų | 64.1 | 45% | 0.446 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -62.2 | -46 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | C227 R228 A234 V235 | C227-A231 WeakPolarHBondContact O-CB 3.23Å; C227-A231 PolarHBondContact O-N 2.94Å; R228-A231 PolarHBondContact O-N 3.43Å; A231-A234 PolarHBondContact O-N 3.43Å; A231-V235 VanDerWaalsContact O-CG2 3.32Å; A231-V235 WeakPolarHBondContact O-CG2 3.35Å; A231-V235 PolarHBondContact O-N 2.94Å |
| 232 | L | 87.1 | Confident | 84 | Confident | 102 Ų | 102 | 63 Ų | 63 | 53% | 0.534 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -61.6 | -44.1 | 175.7 | -73.1 | 171.2 | 0 | 0 | 0 | 111.9 | R228 T229 V235 V236 | R228-L232 HydrophobicContact CG-CD1 4.32Å; R228-L232 WeakPolarHBondContact O-CB 3Å; R228-L232 VanDerWaalsContact O-CG 3.29Å; R228-L232 WeakPolarHBondContact O-CG 2.97Å; R228-L232 PolarHBondContact O-N 2.89Å; T229-L232 PolarHBondContact O-N 2.83Å; L232-V235 PolarHBondContact O-N 3.44Å; L232-V236 WeakPolarHBondContact O-CG2 3.15Å; L232-V236 PolarHBondContact O-N 3.1Å |
| 233 | G | 88.8 | Confident | 85.6 | Confident | 7 Ų | 7 | 60.4 Ų | 60.4 | 7% | 0.072 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -60.6 | -44 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | T229 A230 V235 V236 I237 | T229-G233 PolarHBondContact O-N 2.69Å; A230-G233 PolarHBondContact O-N 2.97Å; G233-V235 PolarHBondContact O-N 3.02Å; G233-V236 PolarHBondContact O-N 3.24Å; G233-I237 VanDerWaalsContact O-CG1 3.32Å; G233-I237 WeakPolarHBondContact O-CG1 3.25Å; G233-I237 PolarHBondContact O-N 3.38Å |
| 234 | A | 92.8 | Very high | 87.2 | Confident | 40 Ų | 40 | 58.5 Ų | 58.5 | 33% | 0.331 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -61.5 | -43.8 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | A230 A231 V236 I237 F238 | A230-A234 WeakPolarHBondContact O-CB 3.47Å; A230-A234 PolarHBondContact O-N 3.45Å; A231-A234 PolarHBondContact O-N 3.43Å; A234-V236 VanDerWaalsContact C-N 3.33Å; A234-V236 PolarHBondContact O-N 3.42Å; A234-I237 PolarHBondContact O-N 3.4Å; A234-F238 HydrophobicContact CB-CD2 4.5Å; A234-F238 WeakPolarHBondContact O-CD2 3.36Å; A234-F238 PolarHBondContact O-N 3.15Å |
| 235 | V | 91.7 | Very high | 88.3 | Confident | 93 Ų | 93 | 59.3 Ų | 59.3 | 56% | 0.564 | 34% | 0.34 | S | S | * | . | H | α-helix | trans | -58.6 | -44.2 | 176.1 | 169 | 0 | 0 | 0 | 0 | 111.2 | A231 L232 G233 F238 L239 | A231-V235 VanDerWaalsContact O-CG2 3.32Å; A231-V235 WeakPolarHBondContact O-CG2 3.35Å; A231-V235 PolarHBondContact O-N 2.94Å; L232-V235 PolarHBondContact O-N 3.44Å; G233-V235 PolarHBondContact O-N 3.02Å; V235-F238 PolarHBondContact O-N 2.97Å; V235-L239 WeakPolarHBondContact O-CB 3.37Å; V235-L239 PolarHBondContact O-N 2.67Å |
| 236 | V | 90.8 | Very high | 88.7 | Confident | 45 Ų | 45 | 59.2 Ų | 59.2 | 27% | 0.273 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -64.9 | -42.3 | 178.1 | 176.8 | 0 | 0 | 0 | 0 | 111.3 | F120 A198 L232 G233 A234 L239 F240 | F120-V236 HydrophobicContact CZ-CG1 4.15Å; A198-V236 HydrophobicContact CB-CG1 4.05Å; L232-V236 WeakPolarHBondContact O-CG2 3.15Å; L232-V236 PolarHBondContact O-N 3.1Å; G233-V236 PolarHBondContact O-N 3.24Å; A234-V236 VanDerWaalsContact C-N 3.33Å; A234-V236 PolarHBondContact O-N 3.42Å; V236-L239 WeakPolarHBondContact O-CB 3.24Å; V236-L239 PolarHBondContact O-N 3.36Å; V236-F240 HydrophobicContact CG1-CD2 3.88Å; V236-F240 HydrophobicContact CG1-CE2 3.69Å; V236-F240 VanDerWaalsContact O-CD2 3.26Å; V236-F240 WeakPolarHBondContact O-CD2 3.49Å; V236-F240 PolarHBondContact O-N 2.92Å; V236-F240 VanDerWaalsContact O-N 3.15Å |
| 237 | I | 93.9 | Very high | 88.7 | Confident | 50 Ų | 50 | 56.6 Ų | 56.6 | 26% | 0.256 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -62 | -47.8 | 176.1 | -66.9 | 163.8 | 0 | 0 | 0 | 110.6 | A198 V199 A202 G233 A234 L239 F240 F241 | A198-I237 HydrophobicContact CB-CG1 4.1Å; V199-I237 HydrophobicContact CG2-CD1 4.05Å; V199-I237 HydrophobicContact CG2-CG1 4.14Å; A202-I237 HydrophobicContact CB-CD1 3.94Å; G233-I237 VanDerWaalsContact O-CG1 3.32Å; G233-I237 WeakPolarHBondContact O-CG1 3.25Å; G233-I237 PolarHBondContact O-N 3.38Å; A234-I237 PolarHBondContact O-N 3.4Å; I237-L239 VanDerWaalsContact C-N 3.28Å; I237-L239 PolarHBondContact O-N 2.94Å; I237-F240 PolarHBondContact O-N 3.43Å; I237-F241 VanDerWaalsContact O-CB 3.29Å; I237-F241 WeakPolarHBondContact O-CB 3.34Å; I237-F241 PolarHBondContact O-N 3.44Å |
| 238 | F | 94.5 | Very high | 88.7 | Confident | 144 Ų | 144 | 54.9 Ų | 54.9 | 63% | 0.632 | 30% | 0.299 | S | S | * | . | H | α-helix | trans | -62.6 | -35.6 | 177.7 | -81.8 | -63.1 | 0 | 0 | 0 | 112.4 | A234 V235 F241 S242 | A234-F238 HydrophobicContact CB-CD2 4.5Å; A234-F238 WeakPolarHBondContact O-CD2 3.36Å; A234-F238 PolarHBondContact O-N 3.15Å; V235-F238 PolarHBondContact O-N 2.97Å; F238-F241 PolarHBondContact O-N 2.83Å; F238-S242 VanDerWaalsContact O-CB 3.32Å; F238-S242 WeakPolarHBondContact O-CB 3.42Å; F238-S242 PolarHBondContact O-N 3.36Å; F238-S242 PolarHBondContact O-OG 2.94Å |
| 239 | L | 91.8 | Very high | 88.4 | Confident | 28 Ų | 28 | 52.4 Ų | 52.4 | 15% | 0.147 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -60.8 | -50.6 | 175.8 | -174.5 | 153.9 | 0 | 0 | 0 | 110.9 | V235 V236 I237 S242 R243 L297 | V235-L239 WeakPolarHBondContact O-CB 3.37Å; V235-L239 PolarHBondContact O-N 2.67Å; V236-L239 WeakPolarHBondContact O-CB 3.24Å; V236-L239 PolarHBondContact O-N 3.36Å; I237-L239 VanDerWaalsContact C-N 3.28Å; I237-L239 PolarHBondContact O-N 2.94Å; L239-S242 PolarHBondContact O-N 2.96Å; L239-S242 PolarHBondContact O-OG 3.42Å; L239-R243 PolarHBondContact O-N 3.31Å; L239-L297 HydrophobicContact CD1-CD2 4.09Å |
| 240 | F | 91.5 | Very high | 87.8 | Confident | 4 Ų | 4 | 53.9 Ų | 53.9 | 2% | 0.018 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -72.7 | -31.2 | 178.3 | -70.9 | -65.9 | 0 | 0 | 0 | 113.4 | F120 F194 I195 A198 V236 I237 R243 A244 | F120-F240 HydrophobicContact CD1-CZ 4.47Å; F120-F240 AromaticContact CE1-CE2 3.81Å; F120-F240 HydrophobicContact CE1-CE2 3.81Å; F120-F240 HydrophobicContact CE1-CZ 4.2Å; F120-F240 HydrophobicContact CE2-CE2 4.37Å; F120-F240 AromaticContact CZ-CE2 3.75Å; F120-F240 HydrophobicContact CZ-CE2 3.75Å; F120-F240 HydrophobicContact CZ-CZ 4.36Å; F194-F240 HydrophobicContact CB-CB 4.44Å; F194-F240 HydrophobicContact CB-CD1 3.75Å; F194-F240 HydrophobicContact CB-CE1 4.21Å; F194-F240 HydrophobicContact CB-CG 4.17Å; F194-F240 AromaticContact CD1-CD1 3.93Å; F194-F240 HydrophobicContact CD1-CD1 3.93Å; F194-F240 AromaticContact CD1-CE1 3.48Å; F194-F240 HydrophobicContact CD1-CE1 3.48Å; F194-F240 VanDerWaalsContact CD1-CE1 3.48Å; F194-F240 HydrophobicContact CD1-CZ 4.02Å; F194-F240 HydrophobicContact CE1-CE1 4.07Å; F194-F240 AromaticContact CG-CD1 4Å; F194-F240 HydrophobicContact CG-CD1 4Å; F194-F240 HydrophobicContact CG-CE1 4.02Å; I195-F240 HydrophobicContact CG1-CB 4.16Å; A198-F240 HydrophobicContact CB-CD2 3.65Å; A198-F240 HydrophobicContact CB-CE2 4.27Å; V236-F240 HydrophobicContact CG1-CD2 3.88Å; V236-F240 HydrophobicContact CG1-CE2 3.69Å; V236-F240 VanDerWaalsContact O-CD2 3.26Å; V236-F240 WeakPolarHBondContact O-CD2 3.49Å; V236-F240 PolarHBondContact O-N 2.92Å; V236-F240 VanDerWaalsContact O-N 3.15Å; I237-F240 PolarHBondContact O-N 3.43Å; F240-R243 WeakPolarHBondContact O-CB 3.34Å; F240-R243 PolarHBondContact O-N 3.41Å; F240-A244 PolarHBondContact O-N 3.48Å |
| 241 | F | 92.8 | Very high | 87.1 | Confident | 109 Ų | 109 | 51.9 Ų | 51.9 | 48% | 0.478 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -64 | -42 | 171.6 | -174.6 | -102.3 | 0 | 0 | 0 | 111.5 | I195 I237 F238 R243 A244 C245 | I195-F241 HydrophobicContact CD1-CD2 4.27Å; I237-F241 VanDerWaalsContact O-CB 3.29Å; I237-F241 WeakPolarHBondContact O-CB 3.34Å; I237-F241 PolarHBondContact O-N 3.44Å; F238-F241 PolarHBondContact O-N 2.83Å; F241-R243 VanDerWaalsContact C-N 3.31Å; F241-R243 PolarHBondContact O-N 3.45Å; F241-A244 WeakPolarHBondContact O-CB 3.14Å; F241-A244 PolarHBondContact O-N 3.21Å; F241-A244 VanDerWaalsContact O-N 3.16Å; F241-C245 WeakPolarHBondContact CE1-SG 3.37Å; F241-C245 PolarHBondContact O-N 2.93Å; F241-C245 PolarHBondContact O-SG 3.05Å; F241-C245 VanDerWaalsContact O-SG 3.42Å |
| 242 | S | 90.9 | Very high | 86.4 | Confident | 51 Ų | 51 | 53.8 Ų | 53.8 | 36% | 0.357 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -61.7 | -39.1 | 176.5 | 74.4 | 0 | 0 | 0 | 0 | 112.3 | F238 L239 C245 Y246 W294 | F238-S242 VanDerWaalsContact O-CB 3.32Å; F238-S242 WeakPolarHBondContact O-CB 3.42Å; F238-S242 PolarHBondContact O-N 3.36Å; F238-S242 PolarHBondContact O-OG 2.94Å; L239-S242 PolarHBondContact O-N 2.96Å; L239-S242 PolarHBondContact O-OG 3.42Å; S242-C245 PolarHBondContact O-N 3.46Å; S242-Y246 WeakPolarHBondContact O-CB 3.41Å; S242-Y246 PolarHBondContact O-N 2.94Å; S242-W294 PolarHBondContact OG-NE1 2.99Å |
| 243 | R | 86.8 | Confident | 85.5 | Confident | 7 Ų | 7 | 53.3 Ų | 53.3 | 3% | 0.026 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -59.6 | -48.5 | 172.2 | 179.6 | -176.5 | 178 | 147.2 | 13.3 | 111.2 | D191 L239 F240 F241 C245 Y246 N247 W294 | D191-R243 IonicContact OD1-NE 2.68Å; L239-R243 PolarHBondContact O-N 3.31Å; F240-R243 WeakPolarHBondContact O-CB 3.34Å; F240-R243 PolarHBondContact O-N 3.41Å; F241-R243 VanDerWaalsContact C-N 3.31Å; F241-R243 PolarHBondContact O-N 3.45Å; R243-C245 PolarHBondContact O-N 3.33Å; R243-Y246 PolarHBondContact O-N 3.45Å; R243-N247 WeakPolarHBondContact O-CB 3.4Å; R243-N247 VanDerWaalsContact O-CG 3.3Å; R243-N247 PolarHBondContact O-N 2.88Å; R243-N247 PolarHBondContact O-ND2 2.97Å; R243-W294 HydrophobicContact CB-CD2 3.7Å; R243-W294 HydrophobicContact CB-CE3 4.15Å; R243-W294 HydrophobicContact CB-CG 3.89Å; R243-W294 HydrophobicContact CB-CZ2 4.44Å; R243-W294 HydrophobicContact CG-CD2 3.88Å; R243-W294 HydrophobicContact CG-CE3 3.88Å; R243-W294 HydrophobicContact CG-CG 4.15Å |
| 244 | A | 87.9 | Confident | 84.4 | Confident | 16 Ų | 16 | 55.9 Ų | 55.9 | 13% | 0.132 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -60.4 | -46.2 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | D191 I195 F240 F241 L248 | D191-A244 HydrophobicContact CB-CB 3.68Å; I195-A244 HydrophobicContact CD1-CB 3.78Å; F240-A244 PolarHBondContact O-N 3.48Å; F241-A244 WeakPolarHBondContact O-CB 3.14Å; F241-A244 PolarHBondContact O-N 3.21Å; F241-A244 VanDerWaalsContact O-N 3.16Å; A244-L248 VanDerWaalsContact O-CB 3.25Å; A244-L248 WeakPolarHBondContact O-CB 3.44Å; A244-L248 PolarHBondContact O-N 3.39Å |
| 245 | C | 86.8 | Confident | 83 | Confident | 54 Ų | 54 | 58.7 Ų | 58.7 | 37% | 0.365 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -60.3 | -47 | 176.3 | -69.3 | 0 | 0 | 0 | 0 | 111.4 | F241 S242 R243 L248 T249 | F241-C245 WeakPolarHBondContact CE1-SG 3.37Å; F241-C245 PolarHBondContact O-N 2.93Å; F241-C245 PolarHBondContact O-SG 3.05Å; F241-C245 VanDerWaalsContact O-SG 3.42Å; S242-C245 PolarHBondContact O-N 3.46Å; R243-C245 PolarHBondContact O-N 3.33Å; C245-L248 PolarHBondContact O-N 2.98Å; C245-T249 WeakPolarHBondContact O-CB 3.22Å; C245-T249 PolarHBondContact O-N 2.86Å; C245-T249 PolarHBondContact O-OG1 3.19Å |
| 246 | Y | 83.9 | Confident | 81.4 | Confident | 81 Ų | 81 | 60.1 Ų | 60.1 | 32% | 0.318 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -60.7 | -50.8 | 179.1 | 177.4 | -94.1 | 0 | 0 | 0 | 112.1 | S242 R243 L248 T249 V250 I290 W294 | S242-Y246 WeakPolarHBondContact O-CB 3.41Å; S242-Y246 PolarHBondContact O-N 2.94Å; R243-Y246 PolarHBondContact O-N 3.45Å; Y246-L248 VanDerWaalsContact C-N 3.28Å; Y246-L248 PolarHBondContact O-N 2.85Å; Y246-T249 PolarHBondContact O-N 2.85Å; Y246-T249 VanDerWaalsContact O-N 3.17Å; Y246-V250 HydrophobicContact CD1-CG2 4.15Å; Y246-V250 HydrophobicContact CD2-CG2 4.33Å; Y246-V250 HydrophobicContact CE1-CG2 3.72Å; Y246-V250 HydrophobicContact CE2-CG2 3.91Å; Y246-V250 HydrophobicContact CG-CG2 4.43Å; Y246-V250 WeakPolarHBondContact O-CG2 3.35Å; Y246-V250 PolarHBondContact O-N 3.31Å; Y246-I290 HydrophobicContact CE1-CD1 3.73Å; Y246-I290 HydrophobicContact CE2-CD1 4.01Å; Y246-I290 WeakPolarHBondContact OH-CD1 3.38Å; Y246-W294 AromaticContact CD1-CH2 3.4Å; Y246-W294 HydrophobicContact CD1-CH2 3.4Å; Y246-W294 AromaticContact CD1-CZ3 3.43Å; Y246-W294 HydrophobicContact CD1-CZ3 3.43Å; Y246-W294 VanDerWaalsContact CD1-CZ3 3.43Å; Y246-W294 AromaticContact CD2-CH2 3.91Å; Y246-W294 HydrophobicContact CD2-CH2 3.91Å; Y246-W294 HydrophobicContact CE1-CH2 4.14Å; Y246-W294 AromaticContact CE1-CZ3 3.97Å; Y246-W294 HydrophobicContact CE1-CZ3 3.97Å; Y246-W294 AromaticContact CG-CH2 3.26Å; Y246-W294 HydrophobicContact CG-CH2 3.26Å; Y246-W294 HydrophobicContact CG-CZ2 4.26Å; Y246-W294 AromaticContact CG-CZ3 3.84Å; Y246-W294 HydrophobicContact CG-CZ3 3.84Å |
| 247 | N | 82.4 | Confident | 79.6 | Confident | 8 Ų | 8 | 65.7 Ų | 65.7 | 4% | 0.043 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -59.7 | -42.5 | -179.5 | -70.7 | -18.4 | 0 | 0 | 0 | 111.2 | V187 D191 R243 L251 V269 | V187-N247 HydrophobicContact CG1-CB 3.7Å; D191-N247 PolarHBondContact OD1-ND2 2.86Å; D191-N247 VanDerWaalsContact OD1-ND2 3.11Å; D191-N247 WeakPolarHBondContact OD2-CB 3.43Å; D191-N247 PolarHBondContact OD2-ND2 3.41Å; R243-N247 WeakPolarHBondContact O-CB 3.4Å; R243-N247 VanDerWaalsContact O-CG 3.3Å; R243-N247 PolarHBondContact O-N 2.88Å; R243-N247 PolarHBondContact O-ND2 2.97Å; N247-L251 VanDerWaalsContact O-CB 3.26Å; N247-L251 WeakPolarHBondContact O-CB 3.28Å; N247-L251 PolarHBondContact O-N 3.45Å; N247-V269 HydrophobicContact CB-CG1 4.2Å; N247-V269 WeakPolarHBondContact O-CG1 3.33Å |
| 248 | L | 82.3 | Confident | 77.2 | Confident | 64 Ų | 64 | 72.7 Ų | 72.7 | 34% | 0.335 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -64.9 | -43.8 | 177.4 | -168.9 | 65.1 | 0 | 0 | 0 | 111.7 | L184 A244 C245 Y246 L251 F252 | L184-L248 HydrophobicContact CD1-CD1 4.45Å; A244-L248 VanDerWaalsContact O-CB 3.25Å; A244-L248 WeakPolarHBondContact O-CB 3.44Å; A244-L248 PolarHBondContact O-N 3.39Å; C245-L248 PolarHBondContact O-N 2.98Å; Y246-L248 VanDerWaalsContact C-N 3.28Å; Y246-L248 PolarHBondContact O-N 2.85Å; L248-L251 PolarHBondContact O-N 3.03Å; L248-F252 HydrophobicContact CD1-CD2 3.9Å; L248-F252 HydrophobicContact CD1-CE2 3.42Å; L248-F252 VanDerWaalsContact CD1-CE2 3.42Å; L248-F252 HydrophobicContact CD1-CZ 4.33Å; L248-F252 HydrophobicContact CD2-CE2 4.12Å; L248-F252 HydrophobicContact CG-CD2 3.76Å; L248-F252 HydrophobicContact CG-CE2 3.57Å; L248-F252 WeakPolarHBondContact O-CD2 3.36Å; L248-F252 PolarHBondContact O-N 2.94Å |
| 249 | T | 77.6 | Confident | 74.4 | Confident | 90 Ų | 90 | 69.4 Ų | 69.4 | 55% | 0.552 | 35% | 0.353 | S | S | * | . | H | α-helix | trans | -61.1 | -48.2 | 177.4 | -64.1 | 0 | 0 | 0 | 0 | 111.6 | C245 Y246 L251 F252 L253 | C245-T249 WeakPolarHBondContact O-CB 3.22Å; C245-T249 PolarHBondContact O-N 2.86Å; C245-T249 PolarHBondContact O-OG1 3.19Å; Y246-T249 PolarHBondContact O-N 2.85Å; Y246-T249 VanDerWaalsContact O-N 3.17Å; T249-L251 VanDerWaalsContact C-N 3.31Å; T249-L251 PolarHBondContact O-N 2.89Å; T249-F252 PolarHBondContact O-N 3.32Å; T249-L253 VanDerWaalsContact O-CB 3.27Å; T249-L253 WeakPolarHBondContact O-CB 3.24Å; T249-L253 PolarHBondContact O-N 2.77Å |
| 250 | V | 72.6 | Confident | 71.4 | Confident | 43 Ų | 43 | 76.6 Ų | 76.6 | 26% | 0.261 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -63.4 | -39.8 | 179.4 | 172.1 | 0 | 0 | 0 | 0 | 111 | Y246 L253 S254 V269 | Y246-V250 HydrophobicContact CD1-CG2 4.15Å; Y246-V250 HydrophobicContact CD2-CG2 4.33Å; Y246-V250 HydrophobicContact CE1-CG2 3.72Å; Y246-V250 HydrophobicContact CE2-CG2 3.91Å; Y246-V250 HydrophobicContact CG-CG2 4.43Å; Y246-V250 WeakPolarHBondContact O-CG2 3.35Å; Y246-V250 PolarHBondContact O-N 3.31Å; V250-L253 PolarHBondContact O-N 2.83Å; V250-S254 WeakPolarHBondContact O-CB 3.14Å; V250-S254 PolarHBondContact O-N 3.3Å; V250-V269 HydrophobicContact CB-CG1 3.64Å; V250-V269 HydrophobicContact CG1-CB 4.29Å; V250-V269 HydrophobicContact CG1-CG1 3.61Å; V250-V269 HydrophobicContact CG1-CG2 4.12Å |
| 251 | L | 73.4 | Confident | 68.2 | Low | 0 Ų | 0 | 82.1 Ų | 82.1 | 0% | 0 | 43% | 0.425 | C | S | . | . | H | α-helix | trans | -63.5 | -44.2 | 177.2 | -167.6 | 77.6 | 0 | 0 | 0 | 112.7 | V183 L184 V187 N247 L248 T249 Q255 W266 V269 | V183-L251 HydrophobicContact CG1-CD1 3.99Å; L184-L251 HydrophobicContact CB-CD2 3.95Å; L184-L251 HydrophobicContact CD1-CD2 3.35Å; L184-L251 HydrophobicContact CG-CD2 4.26Å; V187-L251 HydrophobicContact CB-CD2 4.46Å; V187-L251 HydrophobicContact CG2-CD2 4.5Å; N247-L251 VanDerWaalsContact O-CB 3.26Å; N247-L251 WeakPolarHBondContact O-CB 3.28Å; N247-L251 PolarHBondContact O-N 3.45Å; L248-L251 PolarHBondContact O-N 3.03Å; T249-L251 VanDerWaalsContact C-N 3.31Å; T249-L251 PolarHBondContact O-N 2.89Å; L251-Q255 PolarHBondContact O-N 3.35Å; L251-W266 HydrophobicContact CD1-CH2 3.15Å; L251-W266 HydrophobicContact CD1-CZ2 3.62Å; L251-W266 HydrophobicContact CD1-CZ3 3.95Å; L251-W266 HydrophobicContact CG-CH2 4.03Å; L251-V269 HydrophobicContact CD1-CG2 3.88Å |
| 252 | F | 73.8 | Confident | 65.2 | Low | 93 Ų | 93 | 79.7 Ų | 79.7 | 41% | 0.408 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -70.5 | -34.9 | 176.2 | -82.1 | -62.7 | 0 | 0 | 0 | 112.5 | L248 T249 S254 Q255 N256 | L248-F252 HydrophobicContact CD1-CD2 3.9Å; L248-F252 HydrophobicContact CD1-CE2 3.42Å; L248-F252 VanDerWaalsContact CD1-CE2 3.42Å; L248-F252 HydrophobicContact CD1-CZ 4.33Å; L248-F252 HydrophobicContact CD2-CE2 4.12Å; L248-F252 HydrophobicContact CG-CD2 3.76Å; L248-F252 HydrophobicContact CG-CE2 3.57Å; L248-F252 WeakPolarHBondContact O-CD2 3.36Å; L248-F252 PolarHBondContact O-N 2.94Å; T249-F252 PolarHBondContact O-N 3.32Å; F252-S254 VanDerWaalsContact C-N 3.33Å; F252-Q255 WeakPolarHBondContact O-CB 3.4Å; F252-Q255 PolarHBondContact O-N 2.9Å; F252-N256 PolarHBondContact O-N 3.28Å; F252-N256 PolarHBondContact O-ND2 2.95Å |
| 253 | L | 69.6 | Low | 62.1 | Low | 93 Ų | 93 | 85 Ų | 85 | 49% | 0.487 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -65 | -41.4 | 176.7 | -164.9 | 68.7 | 0 | 0 | 0 | 110.9 | T249 V250 Q255 N256 Y257 | T249-L253 VanDerWaalsContact O-CB 3.27Å; T249-L253 WeakPolarHBondContact O-CB 3.24Å; T249-L253 PolarHBondContact O-N 2.77Å; V250-L253 PolarHBondContact O-N 2.83Å; L253-Q255 PolarHBondContact O-N 3.27Å; L253-N256 PolarHBondContact O-N 3.45Å; L253-N256 VanDerWaalsContact O-N 3.15Å; L253-Y257 HydrophobicContact CD1-CD2 3.64Å; L253-Y257 HydrophobicContact CD1-CE2 3.41Å; L253-Y257 VanDerWaalsContact CD1-CE2 3.41Å; L253-Y257 HydrophobicContact CG-CD2 4.02Å; L253-Y257 HydrophobicContact CG-CE2 4.28Å; L253-Y257 PolarHBondContact O-N 3.43Å; L253-Y257 VanDerWaalsContact O-N 3.14Å |
| 254 | S | 63.8 | Low | 59.5 | Low | 61 Ų | 61 | 88.7 Ų | 88.7 | 43% | 0.427 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -58.7 | -28.5 | 173.8 | 170 | 0 | 0 | 0 | 0 | 113.3 | V250 F252 | V250-S254 WeakPolarHBondContact O-CB 3.14Å; V250-S254 PolarHBondContact O-N 3.3Å; F252-S254 VanDerWaalsContact C-N 3.33Å |
| 255 | Q | 64.7 | Low | 57 | Low | 99 Ų | 99 | 92.9 Ų | 92.9 | 46% | 0.463 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -77.8 | -36.5 | 176.2 | -171.9 | -178.5 | -1.2 | 0 | 0 | 113 | L251 F252 L253 | L251-Q255 PolarHBondContact O-N 3.35Å; F252-Q255 WeakPolarHBondContact O-CB 3.4Å; F252-Q255 PolarHBondContact O-N 2.9Å; L253-Q255 PolarHBondContact O-N 3.27Å |
| 256 | N | 57.8 | Low | 54.8 | Low | 123 Ų | 123 | 92.4 Ų | 92.4 | 66% | 0.658 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -82.6 | -32.7 | -172.8 | -72.3 | -56.5 | 0 | 0 | 0 | 113.2 | F252 L253 | F252-N256 PolarHBondContact O-N 3.28Å; F252-N256 PolarHBondContact O-ND2 2.95Å; L253-N256 PolarHBondContact O-N 3.45Å; L253-N256 VanDerWaalsContact O-N 3.15Å |
| 257 | Y | 52.8 | Low | 52.6 | Low | 162 Ų | 162 | 89.2 Ų | 89.2 | 64% | 0.635 | 45% | 0.451 | S | S | * | . | trans | -103.1 | 91.7 | 174.8 | -63.7 | -87 | 0 | 0 | 0 | 108.7 | L253 V259 | L253-Y257 HydrophobicContact CD1-CD2 3.64Å; L253-Y257 HydrophobicContact CD1-CE2 3.41Å; L253-Y257 VanDerWaalsContact CD1-CE2 3.41Å; L253-Y257 HydrophobicContact CG-CD2 4.02Å; L253-Y257 HydrophobicContact CG-CE2 4.28Å; L253-Y257 PolarHBondContact O-N 3.43Å; L253-Y257 VanDerWaalsContact O-N 3.14Å; Y257-V259 PolarHBondContact O-N 3.41Å | ||
| 258 | K | 42.7 | Very low | 50.7 | Low | 197 Ų | 197 | 89.3 Ų | 89.3 | 86% | 0.857 | 45% | 0.452 | S | S | * | . | trans | -66.6 | 86.8 | 164 | -99.4 | -171 | 173.5 | -173.8 | 0 | 107.4 | E260 | K258-E260 PolarHBondContact O-N 3.21Š| ||
| 259 | V | 35.9 | Very low | 48.7 | Very low | 74 Ų | 74 | 87.2 Ų | 87.2 | 45% | 0.448 | 44% | 0.442 | S | S | . | . | trans | -67.9 | 104.4 | 168.3 | -169.5 | 0 | 0 | 0 | 0 | 106.2 | Y257 S261 F262 | Y257-V259 PolarHBondContact O-N 3.41Å; V259-S261 PolarHBondContact O-N 3.42Å; V259-F262 HydrophobicContact CB-CD2 3.92Å; V259-F262 HydrophobicContact CB-CE2 4.42Å; V259-F262 HydrophobicContact CG1-CD2 3.55Å; V259-F262 HydrophobicContact CG1-CE2 3.68Å | ||
| 260 | E | 29.6 | Very low | 47 | Very low | 179 Ų | 179 | 84 Ų | 84 | 84% | 0.836 | 42% | 0.423 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.4 | 126.8 | 172.5 | -70.7 | -166.2 | 149.5 | 0 | 0 | 108.3 | K258 | K258-E260 PolarHBondContact O-N 3.21Š|
| 261 | S | 25.1 | Very low | 45.6 | Very low | 120 Ų | 120 | 82.1 Ų | 82.1 | 84% | 0.839 | 41% | 0.411 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 90.4 | 20.3 | 177.8 | 79.3 | 0 | 0 | 0 | 0 | 120.3 | V259 D263 | V259-S261 PolarHBondContact O-N 3.42Å; S261-D263 PolarHBondContact O-N 3.03Å |
| 262 | F | 29.6 | Very low | 44.1 | Very low | 59 Ų | 59 | 83.4 Ų | 83.4 | 26% | 0.259 | 42% | 0.417 | S | S | . | . | trans | -95.6 | 89.2 | 161.8 | -81.7 | -83.2 | 0 | 0 | 0 | 112 | V259 Y264 L275 S277 | V259-F262 HydrophobicContact CB-CD2 3.92Å; V259-F262 HydrophobicContact CB-CE2 4.42Å; V259-F262 HydrophobicContact CG1-CD2 3.55Å; V259-F262 HydrophobicContact CG1-CE2 3.68Å; F262-Y264 HydrophobicContact CD1-CD2 4.06Å; F262-Y264 PolarHBondContact O-N 3.45Å; F262-L275 HydrophobicContact CB-CD2 3.78Å; F262-L275 HydrophobicContact CD1-CD2 3.18Å; F262-L275 HydrophobicContact CD1-CG 3.93Å; F262-L275 HydrophobicContact CD2-CD2 3.49Å; F262-L275 VanDerWaalsContact CD2-CD2 3.49Å; F262-L275 HydrophobicContact CE1-CD2 3.47Å; F262-L275 VanDerWaalsContact CE1-CD2 3.47Å; F262-L275 HydrophobicContact CE1-CG 4.01Å; F262-L275 HydrophobicContact CE2-CD2 3.75Å; F262-L275 HydrophobicContact CG-CD2 3.17Å; F262-L275 HydrophobicContact CG-CG 4.36Å; F262-L275 HydrophobicContact CZ-CD2 3.73Å; F262-S277 VanDerWaalsContact CZ-OG 3.29Å; F262-S277 WeakPolarHBondContact CZ-OG 3.25Å | ||
| 263 | D | 26.1 | Very low | 42.5 | Very low | 161 Ų | 161 | 80.5 Ų | 80.5 | 86% | 0.861 | 41% | 0.411 | S | S | * | . | trans | -75.5 | 53 | 166.3 | -150.4 | 18.9 | 0 | 0 | 0 | 110.1 | S261 | S261-D263 PolarHBondContact O-N 3.03Š| ||
| 264 | Y | 30.3 | Very low | 41.1 | Very low | 86 Ų | 86 | 80 Ų | 80 | 34% | 0.337 | 41% | 0.409 | S | S | . | . | trans | -118.8 | 113.1 | 177.6 | -92.7 | -77.6 | 0 | 0 | 0 | 110.6 | F262 W266 Q272 | F262-Y264 HydrophobicContact CD1-CD2 4.06Å; F262-Y264 PolarHBondContact O-N 3.45Å; Y264-W266 VanDerWaalsContact C-N 3.31Å; Y264-W266 PolarHBondContact O-N 2.84Å; Y264-Q272 VanDerWaalsContact CE1-NE2 3.27Å | ||
| 265 | D | 36.9 | Very low | 39.9 | Very low | 103 Ų | 103 | 80.8 Ų | 80.8 | 55% | 0.551 | 41% | 0.408 | S | S | * | . | trans | -53.3 | 86.4 | 165.9 | -80 | -38.9 | 0 | 0 | 0 | 111.2 | Y267 | D265-Y267 PolarHBondContact O-N 3.2Š| ||
| 266 | W | 39.1 | Very low | 38.6 | Very low | 45 Ų | 45 | 80 Ų | 80 | 17% | 0.17 | 40% | 0.404 | C | S | . | . | S | Bend | 42 | -2.7 | 127 | -167.5 | -114.4 | 0 | 0 | 0 | 122.5 | T179 W180 V183 L251 Y264 N268 | T179-W266 HydrophobicContact CG2-CB 4.07Å; T179-W266 HydrophobicContact CG2-CG 3.75Å; T179-W266 PolarHBondContact O-NE1 3.37Å; W180-W266 VanDerWaalsContact CA-CE2 3.47Å; W180-W266 HydrophobicContact CB-CH2 4.3Å; W180-W266 HydrophobicContact CB-CZ2 4.05Å; W180-W266 AromaticContact CD1-CH2 2.97Å; W180-W266 AromaticContact CD1-CZ2 3.56Å; W180-W266 AromaticContact CD1-CZ3 3.5Å; W180-W266 AromaticContact CG-CH2 3.74Å; W180-W266 HydrophobicContact CG-CH2 3.74Å; W180-W266 AromaticContact CG-CZ2 3.85Å; W180-W266 HydrophobicContact CG-CZ2 3.85Å; W180-W266 HydrophobicContact CG-CZ3 4.45Å; W180-W266 AromaticContact NE1-CH2 3.41Å; W180-W266 WeakPolarHBondContact O-CZ2 3.39Å; V183-W266 HydrophobicContact CB-CD2 4.33Å; V183-W266 HydrophobicContact CB-CZ2 3.47Å; V183-W266 VanDerWaalsContact CB-CZ2 3.47Å; V183-W266 HydrophobicContact CG1-CZ2 3.78Å; V183-W266 HydrophobicContact CG2-CD2 4.4Å; V183-W266 HydrophobicContact CG2-CG 4.07Å; V183-W266 HydrophobicContact CG2-CZ2 4.36Å; L251-W266 HydrophobicContact CD1-CH2 3.15Å; L251-W266 HydrophobicContact CD1-CZ2 3.62Å; L251-W266 HydrophobicContact CD1-CZ3 3.95Å; L251-W266 HydrophobicContact CG-CH2 4.03Å; Y264-W266 VanDerWaalsContact C-N 3.31Å; Y264-W266 PolarHBondContact O-N 2.84Å; W266-N268 PolarHBondContact O-N 2.94Å; W266-N268 VanDerWaalsContact O-N 3.15Å | |
| 267 | Y | 37.9 | Very low | 37.7 | Very low | 14 Ų | 14 | 78.7 Ų | 78.7 | 6% | 0.055 | 40% | 0.404 | C | S | . | . | trans | -79.3 | 2.3 | -172.1 | -135.4 | -100 | 0 | 0 | 0 | 115.7 | F105 C110 N160 C163 A164 R186 D265 | F105-Y267 AromaticContact CE1-CD1 3.59Å; F105-Y267 HydrophobicContact CE1-CD1 3.59Å; F105-Y267 HydrophobicContact CE1-CE1 4.49Å; F105-Y267 AromaticContact CE1-CG 3.64Å; F105-Y267 HydrophobicContact CE1-CG 3.64Å; F105-Y267 HydrophobicContact CZ-CD1 4.27Å; F105-Y267 HydrophobicContact CZ-CG 4.26Å; C110-Y267 HydrophobicContact CB-CE1 3.94Å; N160-Y267 PolarHBondContact O-OH 3.46Å; C163-Y267 HydrophobicContact CB-CE2 3.92Å; C163-Y267 VanDerWaalsContact CB-OH 3.32Å; C163-Y267 WeakPolarHBondContact CB-OH 3.08Å; C163-Y267 WeakPolarHBondContact O-CE2 3.37Å; A164-Y267 VanDerWaalsContact CA-CZ 3.48Å; A164-Y267 VanDerWaalsContact CA-OH 3.24Å; A164-Y267 WeakPolarHBondContact CA-OH 3.22Å; A164-Y267 HydrophobicContact CB-CE1 4.42Å; A164-Y267 HydrophobicContact CB-CE2 3.96Å; A164-Y267 VanDerWaalsContact CB-OH 3.24Å; A164-Y267 WeakPolarHBondContact CB-OH 3.48Å; A164-Y267 PolarHBondContact N-OH 3.47Å; R186-Y267 PolarHBondContact NH1-O 3.03Å; D265-Y267 PolarHBondContact O-N 3.2Å | ||
| 268 | N | 43 | Very low | 36.9 | Very low | 10 Ų | 10 | 79 Ų | 79 | 5% | 0.053 | 41% | 0.411 | C | S | . | . | -139.4 | 32 | -126.3 | -120.7 | -18.9 | 0 | 0 | 0 | 116.2 | W266 S270 D271 Q272 | W266-N268 PolarHBondContact O-N 2.94Å; W266-N268 VanDerWaalsContact O-N 3.15Å; N268-S270 VanDerWaalsContact C-N 3.31Å; N268-D271 WeakPolarHBondContact OD1-CA 3.41Å; N268-D271 WeakPolarHBondContact OD1-CB 3.43Å; N268-D271 PolarHBondContact OD1-O 3.17Å; N268-Q272 HydrophobicContact CB-CB 3.62Å; N268-Q272 HydrophobicContact CB-CG 3.92Å; N268-Q272 WeakPolarHBondContact ND2-CG 3.25Å; N268-Q272 PolarHBondContact ND2-NE2 3.02Å; N268-Q272 PolarHBondContact ND2-OE1 2.86Å; N268-Q272 PolarHBondContact O-N 2.84Å; N268-Q272 PolarHBondContact OD1-N 3.15Å | |||
| 269 | V | 40.5 | Very low | 36.7 | Very low | 19 Ų | 19 | 73.8 Ų | 73.8 | 12% | 0.115 | 39% | 0.393 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -82.5 | -8.7 | 176.6 | 174.5 | 0 | 0 | 0 | 0 | 113.3 | N247 V250 L251 | N247-V269 HydrophobicContact CB-CG1 4.2Å; N247-V269 WeakPolarHBondContact O-CG1 3.33Å; V250-V269 HydrophobicContact CB-CG1 3.64Å; V250-V269 HydrophobicContact CG1-CB 4.29Å; V250-V269 HydrophobicContact CG1-CG1 3.61Å; V250-V269 HydrophobicContact CG1-CG2 4.12Å; L251-V269 HydrophobicContact CD1-CG2 3.88Å |
| 270 | S | 41.7 | Very low | 37.3 | Very low | 24 Ų | 24 | 72.3 Ų | 72.3 | 17% | 0.168 | 39% | 0.393 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -119.8 | -6.2 | 167 | -169.3 | 0 | 0 | 0 | 0 | 113.6 | N268 | N268-S270 VanDerWaalsContact C-N 3.31Š|
| 271 | D | 42.9 | Very low | 38.4 | Very low | 2 Ų | 2 | 66 Ų | 66 | 1% | 0.011 | 37% | 0.365 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -128.3 | -5.4 | -168 | -80.1 | -38.8 | 0 | 0 | 0 | 114 | R83 Y109 N268 | R83-D271 IonicContact NH1-OD1 3.72Å; R83-D271 IonicContact NH2-OD1 2.81Å; Y109-D271 HydrophobicContact CD1-CB 3.92Å; N268-D271 WeakPolarHBondContact OD1-CA 3.41Å; N268-D271 WeakPolarHBondContact OD1-CB 3.43Å; N268-D271 PolarHBondContact OD1-O 3.17Å |
| 272 | Q | 41.7 | Very low | 39.7 | Very low | 27 Ų | 27 | 69.8 Ų | 69.8 | 13% | 0.126 | 36% | 0.36 | C | S | . | . | trans | -130.5 | 107.8 | 167.3 | -93.3 | 167.7 | -19.4 | 0 | 0 | 109.8 | Y264 N268 D274 | Y264-Q272 VanDerWaalsContact CE1-NE2 3.27Å; N268-Q272 HydrophobicContact CB-CB 3.62Å; N268-Q272 HydrophobicContact CB-CG 3.92Å; N268-Q272 WeakPolarHBondContact ND2-CG 3.25Å; N268-Q272 PolarHBondContact ND2-NE2 3.02Å; N268-Q272 PolarHBondContact ND2-OE1 2.86Å; N268-Q272 PolarHBondContact O-N 2.84Å; N268-Q272 PolarHBondContact OD1-N 3.15Å; Q272-D274 HydrophobicContact CB-CB 4.46Å; Q272-D274 HydrophobicContact CG-CB 4.09Å | ||
| 273 | A | 40.8 | Very low | 41 | Very low | 33 Ų | 33 | 67.3 Ų | 67.3 | 27% | 0.273 | 35% | 0.352 | S | S | . | . | trans | -91.1 | 20 | 148.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | L275 G283 F287 | A273-L275 PolarHBondContact O-N 2.83Å; A273-G283 VanDerWaalsContact CB-O 3.25Å; A273-G283 WeakPolarHBondContact CB-O 3.47Å; A273-F287 HydrophobicContact CB-CB 3.68Å; A273-F287 HydrophobicContact CB-CD2 4.47Å; A273-F287 HydrophobicContact CB-CG 4.44Å | ||
| 274 | D | 40.2 | Very low | 42.4 | Very low | 82 Ų | 82 | 61.9 Ų | 61.9 | 44% | 0.439 | 32% | 0.319 | S | S | . | . | trans | -81.5 | 0.3 | 178.3 | -140.9 | 17.2 | 0 | 0 | 0 | 112.6 | N98 Q272 Q276 | N98-D274 PolarHBondContact ND2-OD2 2.93Å; Q272-D274 HydrophobicContact CB-CB 4.46Å; Q272-D274 HydrophobicContact CG-CB 4.09Å; D274-Q276 PolarHBondContact O-N 2.89Å | ||
| 275 | L | 39 | Very low | 43.9 | Very low | 78 Ų | 78 | 61.3 Ų | 61.3 | 41% | 0.408 | 32% | 0.322 | S | S | . | . | trans | -85.6 | 52.3 | 174.7 | -96.7 | 155.6 | 0 | 0 | 0 | 111.5 | F262 A273 | F262-L275 HydrophobicContact CB-CD2 3.78Å; F262-L275 HydrophobicContact CD1-CD2 3.18Å; F262-L275 HydrophobicContact CD1-CG 3.93Å; F262-L275 HydrophobicContact CD2-CD2 3.49Å; F262-L275 VanDerWaalsContact CD2-CD2 3.49Å; F262-L275 HydrophobicContact CE1-CD2 3.47Å; F262-L275 VanDerWaalsContact CE1-CD2 3.47Å; F262-L275 HydrophobicContact CE1-CG 4.01Å; F262-L275 HydrophobicContact CE2-CD2 3.75Å; F262-L275 HydrophobicContact CG-CD2 3.17Å; F262-L275 HydrophobicContact CG-CG 4.36Å; F262-L275 HydrophobicContact CZ-CD2 3.73Å; A273-L275 PolarHBondContact O-N 2.83Å | ||
| 276 | Q | 36 | Very low | 45.2 | Very low | 83 Ų | 83 | 58.5 Ų | 58.5 | 39% | 0.388 | 31% | 0.313 | S | S | . | . | trans | -155.1 | 74.8 | 160.4 | -112.6 | 160.2 | 10 | 0 | 0 | 111.4 | D274 E278 L279 G280 | D274-Q276 PolarHBondContact O-N 2.89Å; Q276-E278 PolarHBondContact O-N 2.69Å; Q276-E278 VanDerWaalsContact O-N 3.13Å; Q276-L279 HydrophobicContact CB-CB 3.73Å; Q276-L279 HydrophobicContact CG-CB 3.56Å; Q276-L279 HydrophobicContact CG-CD1 3.63Å; Q276-L279 HydrophobicContact CG-CG 4.01Å; Q276-L279 PolarHBondContact O-N 2.86Å; Q276-L279 VanDerWaalsContact OE1-CG 3.31Å; Q276-G280 PolarHBondContact O-N 3.47Å | ||
| 277 | S | 38.9 | Very low | 46.4 | Very low | 95 Ų | 95 | 57.2 Ų | 57.2 | 66% | 0.664 | 31% | 0.309 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.7 | -11.9 | 150 | 52.1 | 0 | 0 | 0 | 0 | 112.3 | F262 | F262-S277 VanDerWaalsContact CZ-OG 3.29Å; F262-S277 WeakPolarHBondContact CZ-OG 3.25Å |
| 278 | E | 36.5 | Very low | 47.8 | Very low | 167 Ų | 167 | 56.8 Ų | 56.8 | 78% | 0.78 | 31% | 0.308 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -104 | -11.2 | 175.5 | -89.9 | -174.4 | 153.4 | 0 | 0 | 117 | Q276 | Q276-E278 PolarHBondContact O-N 2.69Å; Q276-E278 VanDerWaalsContact O-N 3.13Å |
| 279 | L | 38.1 | Very low | 49 | Very low | 89 Ų | 89 | 58.5 Ų | 58.5 | 47% | 0.466 | 32% | 0.324 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -116 | -2.1 | 177.3 | -92.9 | 69.8 | 0 | 0 | 0 | 115.3 | Q276 D281 | Q276-L279 HydrophobicContact CB-CB 3.73Å; Q276-L279 HydrophobicContact CG-CB 3.56Å; Q276-L279 HydrophobicContact CG-CD1 3.63Å; Q276-L279 HydrophobicContact CG-CG 4.01Å; Q276-L279 PolarHBondContact O-N 2.86Å; Q276-L279 VanDerWaalsContact OE1-CG 3.31Å; L279-D281 PolarHBondContact O-N 2.95Å |
| 280 | G | 49.4 | Very low | 50.6 | Low | 43 Ų | 43 | 58.5 Ų | 58.5 | 44% | 0.443 | 32% | 0.323 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 53.4 | -135.1 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | Q276 R282 G283 | Q276-G280 PolarHBondContact O-N 3.47Å; G280-R282 PolarHBondContact O-N 3.47Å; G280-G283 PolarHBondContact O-N 3.26Å |
| 281 | D | 53.3 | Low | 52.3 | Low | 47 Ų | 47 | 57.4 Ų | 57.4 | 25% | 0.251 | 32% | 0.315 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -67.5 | -7.9 | -160.1 | -45.3 | -69.1 | 0 | 0 | 0 | 116.3 | A27 V28 L279 | A27-D281 WeakPolarHBondContact CB-OD2 3.34Å; V28-D281 HydrophobicContact CB-CB 3.88Å; V28-D281 WeakPolarHBondContact CB-OD1 3.34Å; V28-D281 HydrophobicContact CG2-CB 3.45Å; V28-D281 VanDerWaalsContact CG2-CB 3.45Å; V28-D281 WeakPolarHBondContact CG2-OD2 3.21Å; V28-D281 PolarHBondContact N-OD1 3.11Å; V28-D281 PolarHBondContact N-OD2 3.07Å; V28-D281 VanDerWaalsContact N-OD2 3.08Å; L279-D281 PolarHBondContact O-N 2.95Å |
| 282 | R | 52.4 | Low | 54 | Low | 199 Ų | 199 | 61.4 Ų | 61.4 | 75% | 0.751 | 33% | 0.333 | S | S | * | . | H | α-helix | trans | -79 | -28.9 | 178 | -65.2 | -172.6 | -171.3 | -131.1 | 3.1 | 113.2 | G280 A286 | G280-R282 PolarHBondContact O-N 3.47Å; R282-A286 WeakPolarHBondContact O-CB 3.47Å; R282-A286 PolarHBondContact O-N 3.45Å |
| 283 | G | 55.1 | Low | 56.1 | Low | 7 Ų | 7 | 64 Ų | 64 | 7% | 0.072 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -66.1 | -43.5 | -179.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | A273 G280 A286 F287 | A273-G283 VanDerWaalsContact CB-O 3.25Å; A273-G283 WeakPolarHBondContact CB-O 3.47Å; G280-G283 PolarHBondContact O-N 3.26Å; G283-A286 PolarHBondContact O-N 3.41Å; G283-F287 PolarHBondContact O-N 2.86Å |
| 284 | Y | 56.9 | Low | 58.3 | Low | 46 Ų | 46 | 63.3 Ų | 63.3 | 18% | 0.18 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -65.9 | -40.3 | 178.5 | -173.7 | -94.8 | 0 | 0 | 0 | 112.8 | Q33 F36 T37 F287 G288 | Q33-Y284 HydrophobicContact CG-CD1 4.09Å; Q33-Y284 HydrophobicContact CG-CE1 3.94Å; Q33-Y284 HydrophobicContact CG-CE2 4.47Å; Q33-Y284 HydrophobicContact CG-CG 4.44Å; F36-Y284 HydrophobicContact CB-CE1 4.02Å; T37-Y284 PolarHBondContact OG1-OH 3.34Å; Y284-F287 WeakPolarHBondContact O-CB 3.5Å; Y284-F287 PolarHBondContact O-N 3.32Å; Y284-G288 PolarHBondContact O-N 3.45Å |
| 285 | L | 60.9 | Low | 60.4 | Low | 74 Ų | 74 | 59.5 Ų | 59.5 | 39% | 0.387 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -65.4 | -41.4 | 175.1 | -73.6 | 169.8 | 0 | 0 | 0 | 111.9 | F36 G288 A289 | F36-L285 HydrophobicContact CD1-CD2 4.35Å; F36-L285 HydrophobicContact CD2-CD2 3.72Å; F36-L285 HydrophobicContact CE1-CD2 4.01Å; F36-L285 HydrophobicContact CE2-CD2 3.33Å; F36-L285 HydrophobicContact CG-CD2 4.22Å; F36-L285 HydrophobicContact CZ-CD2 3.49Å; F36-L285 VanDerWaalsContact CZ-CD2 3.49Å; L285-G288 PolarHBondContact O-N 3.49Å; L285-A289 WeakPolarHBondContact O-CB 3.18Å; L285-A289 PolarHBondContact O-N 2.89Å |
| 286 | A | 64.1 | Low | 62.6 | Low | 45 Ų | 45 | 56 Ų | 56 | 37% | 0.372 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -61.9 | -43.5 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | R282 G283 A289 I290 | R282-A286 WeakPolarHBondContact O-CB 3.47Å; R282-A286 PolarHBondContact O-N 3.45Å; G283-A286 PolarHBondContact O-N 3.41Å; A286-A289 PolarHBondContact O-N 3.45Å; A286-I290 WeakPolarHBondContact O-CB 3.28Å; A286-I290 VanDerWaalsContact O-CD1 3.31Å; A286-I290 WeakPolarHBondContact O-CD1 3.28Å; A286-I290 WeakPolarHBondContact O-CG1 3.4Å; A286-I290 PolarHBondContact O-N 3.13Å |
| 287 | F | 65.4 | Low | 65.1 | Low | 18 Ų | 18 | 55.2 Ų | 55.2 | 8% | 0.079 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -57.7 | -48.5 | 174.8 | 175.6 | -108.3 | 0 | 0 | 0 | 113 | F87 A273 G283 Y284 A289 I290 L291 | F87-F287 HydrophobicContact CE1-CE1 4.33Å; A273-F287 HydrophobicContact CB-CB 3.68Å; A273-F287 HydrophobicContact CB-CD2 4.47Å; A273-F287 HydrophobicContact CB-CG 4.44Å; G283-F287 PolarHBondContact O-N 2.86Å; Y284-F287 WeakPolarHBondContact O-CB 3.5Å; Y284-F287 PolarHBondContact O-N 3.32Å; F287-A289 PolarHBondContact O-N 3.3Å; F287-I290 WeakPolarHBondContact O-CB 3.23Å; F287-I290 PolarHBondContact O-N 2.94Å; F287-L291 HydrophobicContact CD1-CD1 4.14Å; F287-L291 HydrophobicContact CD2-CD1 4.48Å; F287-L291 HydrophobicContact CE1-CD1 3.5Å; F287-L291 VanDerWaalsContact CE1-CD1 3.5Å; F287-L291 HydrophobicContact CE1-CG 4.45Å; F287-L291 HydrophobicContact CE2-CD1 3.88Å; F287-L291 HydrophobicContact CE2-CG 4.16Å; F287-L291 HydrophobicContact CZ-CD1 3.37Å; F287-L291 HydrophobicContact CZ-CG 4.15Å; F287-L291 PolarHBondContact O-N 2.75Å |
| 288 | G | 66 | Low | 67.3 | Low | 4 Ų | 4 | 51.6 Ų | 51.6 | 4% | 0.041 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -57.8 | -49.2 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | Y40 Y284 L285 I290 L291 F292 | Y40-G288 WeakPolarHBondContact OH-CA 3.46Å; Y40-G288 PolarHBondContact OH-O 3.44Å; Y284-G288 PolarHBondContact O-N 3.45Å; L285-G288 PolarHBondContact O-N 3.49Å; G288-I290 VanDerWaalsContact C-N 3.3Å; G288-I290 PolarHBondContact O-N 2.89Å; G288-L291 PolarHBondContact O-N 2.82Å; G288-F292 WeakPolarHBondContact O-CB 3.27Å; G288-F292 PolarHBondContact O-N 3.26Å |
| 289 | A | 68.7 | Low | 69.6 | Low | 46 Ų | 46 | 43.8 Ų | 43.8 | 38% | 0.38 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -60.1 | -40.7 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | L285 A286 F287 F292 I293 | L285-A289 WeakPolarHBondContact O-CB 3.18Å; L285-A289 PolarHBondContact O-N 2.89Å; A286-A289 PolarHBondContact O-N 3.45Å; F287-A289 PolarHBondContact O-N 3.3Å; A289-F292 PolarHBondContact O-N 3.3Å; A289-I293 WeakPolarHBondContact O-CB 3.29Å; A289-I293 VanDerWaalsContact O-CG1 3.24Å; A289-I293 WeakPolarHBondContact O-CG1 3.28Å; A289-I293 PolarHBondContact O-N 2.85Å |
| 290 | I | 74.6 | Confident | 71.8 | Confident | 20 Ų | 20 | 40.8 Ų | 40.8 | 10% | 0.103 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -59.9 | -52 | 175.9 | -77.9 | 161.8 | 0 | 0 | 0 | 111.1 | Y246 A286 F287 G288 F292 I293 W294 | Y246-I290 HydrophobicContact CE1-CD1 3.73Å; Y246-I290 HydrophobicContact CE2-CD1 4.01Å; Y246-I290 WeakPolarHBondContact OH-CD1 3.38Å; A286-I290 WeakPolarHBondContact O-CB 3.28Å; A286-I290 VanDerWaalsContact O-CD1 3.31Å; A286-I290 WeakPolarHBondContact O-CD1 3.28Å; A286-I290 WeakPolarHBondContact O-CG1 3.4Å; A286-I290 PolarHBondContact O-N 3.13Å; F287-I290 WeakPolarHBondContact O-CB 3.23Å; F287-I290 PolarHBondContact O-N 2.94Å; G288-I290 VanDerWaalsContact C-N 3.3Å; G288-I290 PolarHBondContact O-N 2.89Å; I290-F292 VanDerWaalsContact C-N 3.28Å; I290-F292 PolarHBondContact O-N 2.91Å; I290-I293 PolarHBondContact O-N 3.37Å; I290-W294 HydrophobicContact CB-CE3 4.3Å; I290-W294 HydrophobicContact CB-CZ3 4.06Å; I290-W294 HydrophobicContact CD1-CZ3 4.46Å; I290-W294 HydrophobicContact CG1-CE3 4.49Å; I290-W294 HydrophobicContact CG1-CH2 4.02Å; I290-W294 HydrophobicContact CG1-CZ3 3.8Å; I290-W294 HydrophobicContact CG2-CD2 4.5Å; I290-W294 HydrophobicContact CG2-CE3 3.46Å; I290-W294 VanDerWaalsContact CG2-CE3 3.46Å; I290-W294 HydrophobicContact CG2-CH2 4.4Å; I290-W294 HydrophobicContact CG2-CZ3 3.38Å; I290-W294 PolarHBondContact O-N 3.45Å |
| 291 | L | 76.8 | Confident | 73.5 | Confident | 1 Ų | 1 | 43.7 Ų | 43.7 | 1% | 0.005 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -62.7 | -37.7 | 177.2 | -71.4 | -177.7 | 0 | 0 | 0 | 111.9 | F87 F287 G288 E295 L296 | F87-L291 HydrophobicContact CE2-CD1 4.42Å; F87-L291 HydrophobicContact CZ-CD1 3.64Å; F287-L291 HydrophobicContact CD1-CD1 4.14Å; F287-L291 HydrophobicContact CD2-CD1 4.48Å; F287-L291 HydrophobicContact CE1-CD1 3.5Å; F287-L291 VanDerWaalsContact CE1-CD1 3.5Å; F287-L291 HydrophobicContact CE1-CG 4.45Å; F287-L291 HydrophobicContact CE2-CD1 3.88Å; F287-L291 HydrophobicContact CE2-CG 4.16Å; F287-L291 HydrophobicContact CZ-CD1 3.37Å; F287-L291 HydrophobicContact CZ-CG 4.15Å; F287-L291 PolarHBondContact O-N 2.75Å; G288-L291 PolarHBondContact O-N 2.82Å; L291-E295 HydrophobicContact CD2-CG 4.17Å; L291-E295 WeakPolarHBondContact O-CA 3.3Å; L291-E295 VanDerWaalsContact O-CB 3.29Å; L291-E295 WeakPolarHBondContact O-CB 3.23Å; L291-E295 PolarHBondContact O-N 3Å; L291-L296 PolarHBondContact O-N 2.93Å |
| 292 | F | 79.9 | Confident | 74.9 | Confident | 86 Ų | 86 | 42.9 Ų | 42.9 | 38% | 0.377 | 22% | 0.221 | S | C | . | . | I | π-helix | trans | -62.2 | -52.2 | 177.4 | -176.5 | -88.4 | 0 | 0 | 0 | 111.3 | G288 A289 I290 L296 L297 | G288-F292 WeakPolarHBondContact O-CB 3.27Å; G288-F292 PolarHBondContact O-N 3.26Å; A289-F292 PolarHBondContact O-N 3.3Å; I290-F292 VanDerWaalsContact C-N 3.28Å; I290-F292 PolarHBondContact O-N 2.91Å; F292-L296 HydrophobicContact CD2-CB 4.46Å; F292-L296 HydrophobicContact CD2-CD2 3.66Å; F292-L296 HydrophobicContact CE2-CD2 3.93Å; F292-L296 PolarHBondContact O-N 3.46Å; F292-L297 HydrophobicContact CE1-CD1 4.16Å; F292-L297 VanDerWaalsContact O-CB 3.24Å; F292-L297 WeakPolarHBondContact O-CB 3.4Å; F292-L297 PolarHBondContact O-N 3.06Å |
| 293 | I | 85.1 | Confident | 76.4 | Confident | 81 Ų | 81 | 33.5 Ų | 33.5 | 42% | 0.415 | 19% | 0.186 | S | C | . | . | I | π-helix | trans | -70.2 | -46 | -174.2 | -66.1 | 167.6 | 0 | 0 | 0 | 111.1 | A289 I290 P298 | A289-I293 WeakPolarHBondContact O-CB 3.29Å; A289-I293 VanDerWaalsContact O-CG1 3.24Å; A289-I293 WeakPolarHBondContact O-CG1 3.28Å; A289-I293 PolarHBondContact O-N 2.85Å; I290-I293 PolarHBondContact O-N 3.37Å; I293-P298 WeakPolarHBondContact O-CD 3.4Å |
| 294 | W | 86 | Confident | 77.5 | Confident | 19 Ų | 19 | 38.6 Ų | 38.6 | 7% | 0.072 | 21% | 0.211 | C | C | . | . | I | π-helix | trans | -94.6 | -15.6 | -171.8 | -63.1 | -32.7 | 0 | 0 | 0 | 115.1 | Q116 S242 R243 Y246 I290 P298 | Q116-W294 PolarHBondContact NE2-O 3.48Å; S242-W294 PolarHBondContact OG-NE1 2.99Å; R243-W294 HydrophobicContact CB-CD2 3.7Å; R243-W294 HydrophobicContact CB-CE3 4.15Å; R243-W294 HydrophobicContact CB-CG 3.89Å; R243-W294 HydrophobicContact CB-CZ2 4.44Å; R243-W294 HydrophobicContact CG-CD2 3.88Å; R243-W294 HydrophobicContact CG-CE3 3.88Å; R243-W294 HydrophobicContact CG-CG 4.15Å; Y246-W294 AromaticContact CD1-CH2 3.4Å; Y246-W294 HydrophobicContact CD1-CH2 3.4Å; Y246-W294 AromaticContact CD1-CZ3 3.43Å; Y246-W294 HydrophobicContact CD1-CZ3 3.43Å; Y246-W294 VanDerWaalsContact CD1-CZ3 3.43Å; Y246-W294 AromaticContact CD2-CH2 3.91Å; Y246-W294 HydrophobicContact CD2-CH2 3.91Å; Y246-W294 HydrophobicContact CE1-CH2 4.14Å; Y246-W294 AromaticContact CE1-CZ3 3.97Å; Y246-W294 HydrophobicContact CE1-CZ3 3.97Å; Y246-W294 AromaticContact CG-CH2 3.26Å; Y246-W294 HydrophobicContact CG-CH2 3.26Å; Y246-W294 HydrophobicContact CG-CZ2 4.26Å; Y246-W294 AromaticContact CG-CZ3 3.84Å; Y246-W294 HydrophobicContact CG-CZ3 3.84Å; I290-W294 HydrophobicContact CB-CE3 4.3Å; I290-W294 HydrophobicContact CB-CZ3 4.06Å; I290-W294 HydrophobicContact CD1-CZ3 4.46Å; I290-W294 HydrophobicContact CG1-CE3 4.49Å; I290-W294 HydrophobicContact CG1-CH2 4.02Å; I290-W294 HydrophobicContact CG1-CZ3 3.8Å; I290-W294 HydrophobicContact CG2-CD2 4.5Å; I290-W294 HydrophobicContact CG2-CE3 3.46Å; I290-W294 VanDerWaalsContact CG2-CE3 3.46Å; I290-W294 HydrophobicContact CG2-CH2 4.4Å; I290-W294 HydrophobicContact CG2-CZ3 3.38Å; I290-W294 PolarHBondContact O-N 3.45Å; W294-P298 VanDerWaalsContact O-CG 3.32Å; W294-P298 WeakPolarHBondContact O-CG 3.25Å |
| 295 | E | 85.7 | Confident | 78.3 | Confident | 1 Ų | 1 | 40 Ų | 40 | 1% | 0.005 | 22% | 0.218 | C | C | . | . | I | π-helix | trans | -123 | -55.3 | -179.2 | -50.7 | -162.5 | 174.3 | 0 | 0 | 113.7 | W79 R83 L291 T299 | W79-E295 HydrophobicContact CZ2-CB 4.16Å; R83-E295 IonicContact CZ-OE1 2.88Å; R83-E295 IonicContact CZ-OE2 3.99Å; R83-E295 IonicContact NE-OE2 3.77Å; R83-E295 PolarHBondContact NE-OE2 3.4Å; R83-E295 IonicContact NH2-OE1 3.06Å; R83-E295 PolarHBondContact NH2-OE1 2.88Å; R83-E295 IonicContact NH2-OE2 3.87Å; R83-E295 PolarHBondContact NH2-OE2 3.4Å; L291-E295 HydrophobicContact CD2-CG 4.17Å; L291-E295 WeakPolarHBondContact O-CA 3.3Å; L291-E295 VanDerWaalsContact O-CB 3.29Å; L291-E295 WeakPolarHBondContact O-CB 3.23Å; L291-E295 PolarHBondContact O-N 3Å; E295-T299 VanDerWaalsContact O-CB 3.28Å; E295-T299 WeakPolarHBondContact O-CB 3.46Å; E295-T299 PolarHBondContact O-N 3.39Å; E295-T299 PolarHBondContact O-OG1 3.37Å |
| 296 | L | 85.5 | Confident | 78.5 | Confident | 5 Ų | 5 | 38.1 Ų | 38.1 | 3% | 0.026 | 21% | 0.207 | C | C | . | . | I | π-helix | trans | -68.3 | -49.6 | -173.2 | -172.4 | 64 | 0 | 0 | 0 | 111.7 | L43 Y44 L47 W79 L291 F292 S300 | L43-L296 HydrophobicContact CB-CD2 4.23Å; L43-L296 HydrophobicContact CD1-CD2 3.93Å; Y44-L296 HydrophobicContact CD1-CD1 3.91Å; Y44-L296 HydrophobicContact CE1-CD1 3.59Å; L47-L296 HydrophobicContact CD1-CD1 3.32Å; W79-L296 HydrophobicContact CH2-CD1 4.02Å; L291-L296 PolarHBondContact O-N 2.93Å; F292-L296 HydrophobicContact CD2-CB 4.46Å; F292-L296 HydrophobicContact CD2-CD2 3.66Å; F292-L296 HydrophobicContact CE2-CD2 3.93Å; F292-L296 PolarHBondContact O-N 3.46Å; L296-S300 WeakPolarHBondContact O-CB 3.49Å; L296-S300 PolarHBondContact O-N 2.79Å; L296-S300 PolarHBondContact O-OG 3.33Å |
| 297 | L | 87.3 | Confident | 78.8 | Confident | 66 Ų | 66 | 43.3 Ų | 43.3 | 35% | 0.346 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -59 | -55.5 | -178.4 | -177 | 149.7 | 0 | 0 | 0 | 112.3 | L239 F292 T299 S300 L301 | L239-L297 HydrophobicContact CD1-CD2 4.09Å; F292-L297 HydrophobicContact CE1-CD1 4.16Å; F292-L297 VanDerWaalsContact O-CB 3.24Å; F292-L297 WeakPolarHBondContact O-CB 3.4Å; F292-L297 PolarHBondContact O-N 3.06Å; L297-T299 PolarHBondContact O-N 3.03Å; L297-S300 PolarHBondContact O-N 2.95Å; L297-L301 HydrophobicContact CD2-CD1 3.69Å; L297-L301 HydrophobicContact CG-CD1 4.31Å; L297-L301 VanDerWaalsContact O-CG 3.28Å; L297-L301 WeakPolarHBondContact O-CG 3.19Å; L297-L301 PolarHBondContact O-N 3.22Å |
| 298 | P | 85.1 | Confident | 78.2 | Confident | 20 Ų | 20 | 44.3 Ų | 44.3 | 13% | 0.13 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -62.3 | -43 | -179.6 | 21 | -31.3 | 0 | 0 | 0 | 111.9 | I293 W294 L301 L302 | I293-P298 WeakPolarHBondContact O-CD 3.4Å; W294-P298 VanDerWaalsContact O-CG 3.32Å; W294-P298 WeakPolarHBondContact O-CG 3.25Å; P298-L301 PolarHBondContact O-N 2.88Å; P298-L302 VanDerWaalsContact O-CG 3.32Å; P298-L302 WeakPolarHBondContact O-CG 3.29Å; P298-L302 PolarHBondContact O-N 2.88Å; P298-L302 VanDerWaalsContact O-N 3.13Å |
| 299 | T | 86.1 | Confident | 77.5 | Confident | 3 Ų | 3 | 51.7 Ų | 51.7 | 2% | 0.018 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -67.8 | -40.9 | -178.3 | -47.7 | 0 | 0 | 0 | 0 | 111.8 | W79 E295 L297 L301 L302 I303 | W79-T299 HydrophobicContact CD2-CG2 4.3Å; W79-T299 HydrophobicContact CE3-CG2 3.92Å; W79-T299 HydrophobicContact CH2-CG2 3.96Å; W79-T299 HydrophobicContact CZ2-CG2 4.37Å; W79-T299 HydrophobicContact CZ3-CG2 3.75Å; E295-T299 VanDerWaalsContact O-CB 3.28Å; E295-T299 WeakPolarHBondContact O-CB 3.46Å; E295-T299 PolarHBondContact O-N 3.39Å; E295-T299 PolarHBondContact O-OG1 3.37Å; L297-T299 PolarHBondContact O-N 3.03Å; T299-L301 PolarHBondContact O-N 2.86Å; T299-L302 PolarHBondContact O-N 3.37Å; T299-I303 HydrophobicContact CG2-CD1 4.09Å; T299-I303 WeakPolarHBondContact O-CG1 3.31Å; T299-I303 PolarHBondContact O-N 2.99Å |
| 300 | S | 84.2 | Confident | 75.9 | Confident | 25 Ų | 25 | 58.9 Ų | 58.9 | 18% | 0.175 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -62.6 | -42.5 | 176.4 | -59.3 | 0 | 0 | 0 | 0 | 111.8 | L47 L296 L297 L302 I303 L304 | L47-S300 WeakPolarHBondContact CD1-OG 3.45Å; L296-S300 WeakPolarHBondContact O-CB 3.49Å; L296-S300 PolarHBondContact O-N 2.79Å; L296-S300 PolarHBondContact O-OG 3.33Å; L297-S300 PolarHBondContact O-N 2.95Å; S300-L302 VanDerWaalsContact C-N 3.32Å; S300-L302 PolarHBondContact O-N 3.2Å; S300-I303 PolarHBondContact O-N 2.94Å; S300-L304 WeakPolarHBondContact O-CB 3.35Å; S300-L304 VanDerWaalsContact O-CG 3.29Å; S300-L304 WeakPolarHBondContact O-CG 3.23Å; S300-L304 PolarHBondContact O-N 3.32Å |
| 301 | L | 84.6 | Confident | 74 | Confident | 104 Ų | 104 | 61.5 Ų | 61.5 | 55% | 0.545 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -61.4 | -40.4 | 176.4 | -71.6 | 174.1 | 0 | 0 | 0 | 111.8 | L297 P298 T299 L304 F305 | L297-L301 HydrophobicContact CD2-CD1 3.69Å; L297-L301 HydrophobicContact CG-CD1 4.31Å; L297-L301 VanDerWaalsContact O-CG 3.28Å; L297-L301 WeakPolarHBondContact O-CG 3.19Å; L297-L301 PolarHBondContact O-N 3.22Å; P298-L301 PolarHBondContact O-N 2.88Å; T299-L301 PolarHBondContact O-N 2.86Å; L301-L304 PolarHBondContact O-N 3.36Å; L301-F305 VanDerWaalsContact O-CB 3.31Å; L301-F305 WeakPolarHBondContact O-CB 3.35Å; L301-F305 PolarHBondContact O-N 3.19Å |
| 302 | L | 82.5 | Confident | 71.9 | Confident | 30 Ų | 30 | 64 Ų | 64 | 16% | 0.157 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -64.7 | -47.1 | 175.9 | -64.8 | 172.5 | 0 | 0 | 0 | 111.2 | F72 F120 I123 P298 T299 S300 L304 F305 F306 | F72-L302 HydrophobicContact CE2-CB 4.33Å; F72-L302 HydrophobicContact CZ-CB 4.01Å; F120-L302 HydrophobicContact CD2-CD1 4.28Å; I123-L302 HydrophobicContact CD1-CB 4.03Å; I123-L302 HydrophobicContact CD1-CD1 3.58Å; I123-L302 HydrophobicContact CD1-CD2 3.76Å; I123-L302 HydrophobicContact CD1-CG 3.95Å; P298-L302 VanDerWaalsContact O-CG 3.32Å; P298-L302 WeakPolarHBondContact O-CG 3.29Å; P298-L302 PolarHBondContact O-N 2.88Å; P298-L302 VanDerWaalsContact O-N 3.13Å; T299-L302 PolarHBondContact O-N 3.37Å; S300-L302 VanDerWaalsContact C-N 3.32Å; S300-L302 PolarHBondContact O-N 3.2Å; L302-L304 VanDerWaalsContact C-N 3.3Å; L302-L304 PolarHBondContact O-N 3.4Å; L302-F305 PolarHBondContact O-N 3.38Å; L302-F305 VanDerWaalsContact O-N 3.14Å; L302-F306 HydrophobicContact CD2-CE2 4.4Å; L302-F306 VanDerWaalsContact O-CD2 3.25Å; L302-F306 WeakPolarHBondContact O-CD2 3.27Å; L302-F306 PolarHBondContact O-N 3.08Å |
| 303 | I | 83.3 | Confident | 69.6 | Low | 2 Ų | 2 | 68.3 Ų | 68.3 | 1% | 0.01 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -59.4 | -42.2 | 177.4 | -67.1 | 163.8 | 0 | 0 | 0 | 111.1 | L47 V51 F72 C76 T299 S300 R307 | L47-I303 HydrophobicContact CD2-CD1 4.09Å; V51-I303 HydrophobicContact CG2-CD1 3.87Å; V51-I303 HydrophobicContact CG2-CG1 4.27Å; V51-I303 HydrophobicContact CG2-CG2 3.93Å; F72-I303 HydrophobicContact CE1-CG1 4.48Å; F72-I303 HydrophobicContact CZ-CG1 4.24Å; C76-I303 HydrophobicContact CB-CD1 4.1Å; C76-I303 HydrophobicContact CB-CG1 4.27Å; T299-I303 HydrophobicContact CG2-CD1 4.09Å; T299-I303 WeakPolarHBondContact O-CG1 3.31Å; T299-I303 PolarHBondContact O-N 2.99Å; S300-I303 PolarHBondContact O-N 2.94Å; I303-R307 PolarHBondContact O-N 3.16Å |
| 304 | L | 78.3 | Confident | 67.2 | Low | 114 Ų | 114 | 71.6 Ų | 71.6 | 60% | 0.597 | 34% | 0.342 | S | S | * | . | H | α-helix | trans | -67.5 | -37.5 | 176.7 | -70.7 | 174.4 | 0 | 0 | 0 | 112.3 | S300 L301 L302 R307 | S300-L304 WeakPolarHBondContact O-CB 3.35Å; S300-L304 VanDerWaalsContact O-CG 3.29Å; S300-L304 WeakPolarHBondContact O-CG 3.23Å; S300-L304 PolarHBondContact O-N 3.32Å; L301-L304 PolarHBondContact O-N 3.36Å; L302-L304 VanDerWaalsContact C-N 3.3Å; L302-L304 PolarHBondContact O-N 3.4Å; L304-R307 WeakPolarHBondContact O-CB 3.3Å |
| 305 | F | 73.4 | Confident | 64.8 | Low | 75 Ų | 75 | 76.4 Ų | 76.4 | 33% | 0.329 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -66.8 | -41.8 | 178.7 | -176.5 | -89.7 | 0 | 0 | 0 | 112.4 | F127 Y218 K222 L301 L302 | F127-F305 AromaticContact CZ-CE1 3.99Å; F127-F305 HydrophobicContact CZ-CE1 3.99Å; F127-F305 HydrophobicContact CZ-CZ 4.44Å; Y218-F305 HydrophobicContact CE1-CE1 4.12Å; Y218-F305 AromaticContact CE1-CZ 3.84Å; Y218-F305 HydrophobicContact CE1-CZ 3.84Å; Y218-F305 WeakPolarHBondContact OH-CE1 3.49Å; Y218-F305 WeakPolarHBondContact OH-CZ 3.23Å; K222-F305 HydrophobicContact CD-CE2 4.09Å; L301-F305 VanDerWaalsContact O-CB 3.31Å; L301-F305 WeakPolarHBondContact O-CB 3.35Å; L301-F305 PolarHBondContact O-N 3.19Å; L302-F305 PolarHBondContact O-N 3.38Å; L302-F305 VanDerWaalsContact O-N 3.14Å |
| 306 | F | 66.6 | Low | 62.3 | Low | 36 Ų | 36 | 81.6 Ų | 81.6 | 16% | 0.158 | 41% | 0.41 | C | S | . | . | S | Bend | trans | -94.5 | 7.4 | -178 | -69.8 | -72.8 | 0 | 0 | 0 | 114.1 | F72 I123 Y126 F127 L302 V308 | F72-F306 HydrophobicContact CD1-CB 4.41Å; F72-F306 HydrophobicContact CE1-CB 3.97Å; F72-F306 HydrophobicContact CE1-CD2 4.34Å; F72-F306 HydrophobicContact CE1-CG 4.47Å; F72-F306 HydrophobicContact CZ-CD2 4.24Å; I123-F306 HydrophobicContact CD1-CD2 4.23Å; I123-F306 HydrophobicContact CD1-CE2 3.72Å; I123-F306 HydrophobicContact CG1-CE2 3.78Å; I123-F306 HydrophobicContact CG1-CZ 4.18Å; I123-F306 HydrophobicContact CG2-CE2 4Å; I123-F306 HydrophobicContact CG2-CZ 3.99Å; Y126-F306 HydrophobicContact CE1-CE1 4.36Å; F127-F306 AromaticContact CE2-CZ 3.78Å; F127-F306 HydrophobicContact CE2-CZ 3.78Å; F127-F306 HydrophobicContact CZ-CE1 4.35Å; F127-F306 AromaticContact CZ-CZ 3.79Å; F127-F306 HydrophobicContact CZ-CZ 3.79Å; L302-F306 HydrophobicContact CD2-CE2 4.4Å; L302-F306 VanDerWaalsContact O-CD2 3.25Å; L302-F306 WeakPolarHBondContact O-CD2 3.27Å; L302-F306 PolarHBondContact O-N 3.08Å; F306-V308 PolarHBondContact O-N 3.42Å |
| 307 | R | 69.2 | Low | 59.8 | Low | 153 Ų | 153 | 86.2 Ų | 86.2 | 58% | 0.577 | 44% | 0.443 | S | S | * | . | trans | -52.3 | 128.4 | 177.3 | 178.7 | 176.7 | 176 | -174.6 | 0.4 | 110.1 | I303 L304 R309 | I303-R307 PolarHBondContact O-N 3.16Å; L304-R307 WeakPolarHBondContact O-CB 3.3Å; R307-R309 PolarHBondContact O-N 3.46Å | ||
| 308 | V | 53.6 | Low | 57.2 | Low | 39 Ų | 39 | 91.2 Ų | 91.2 | 24% | 0.236 | 47% | 0.469 | C | S | . | . | trans | -53 | 108.7 | 170.5 | -177.8 | 0 | 0 | 0 | 0 | 107.9 | Q54 Q69 F306 | Q54-V308 HydrophobicContact CB-CG2 4.42Å; Q69-V308 VanDerWaalsContact NE2-CG2 3.32Å; F306-V308 PolarHBondContact O-N 3.42Å | ||
| 309 | R | 50.2 | Low | 55 | Low | 160 Ų | 160 | 97.8 Ų | 97.8 | 60% | 0.604 | 50% | 0.503 | S | S | * | . | trans | -77.4 | 129.9 | 173.5 | -71.6 | -178.9 | 176.8 | -173.3 | -6.5 | 108 | R307 | R307-R309 PolarHBondContact O-N 3.46Š| ||
| 310 | W | 35.1 | Very low | 52.7 | Low | 197 Ų | 197 | 104.7 Ų | 104.7 | 75% | 0.746 | 54% | 0.539 | S | S | * | . | trans | -58.7 | 130.6 | 174.6 | -160 | -42.7 | 0 | 0 | 0 | 108.6 | A312 | W310-A312 PolarHBondContact O-N 2.95Š| ||
| 311 | P | 36.3 | Very low | 50.3 | Low | 75 Ų | 75 | 110.9 Ų | 110.9 | 49% | 0.487 | 57% | 0.569 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -61.2 | 5 | -179.8 | 24.5 | -37.7 | 0 | 0 | 0 | 116.4 | Y329 | P311-Y329 WeakPolarHBondContact CB-OH 3.41Å; P311-Y329 VanDerWaalsContact CG-OH 3.25Å; P311-Y329 WeakPolarHBondContact CG-OH 3.45Å |
| 312 | A | 31.2 | Very low | 48.2 | Very low | 54 Ų | 54 | 113.7 Ų | 113.7 | 45% | 0.446 | 59% | 0.585 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -94.8 | -16.4 | -173.4 | 0 | 0 | 0 | 0 | 0 | 114.8 | W310 E314 T315 | W310-A312 PolarHBondContact O-N 2.95Å; A312-E314 PolarHBondContact O-N 3.28Å; A312-T315 PolarHBondContact O-OG1 3.28Å |
| 313 | Q | 32.6 | Very low | 46 | Very low | 176 Ų | 176 | 122.9 Ų | 122.9 | 82% | 0.822 | 62% | 0.618 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98 | 35.4 | -170.9 | -152 | 168 | 27.9 | 0 | 0 | 114.3 | ||
| 314 | E | 35 | Very low | 44 | Very low | 149 Ų | 149 | 129.9 Ų | 129.9 | 70% | 0.696 | 66% | 0.661 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -130.1 | 26.8 | 166.1 | -69 | -81.1 | 157.7 | 0 | 0 | 109.7 | A312 | A312-E314 PolarHBondContact O-N 3.28Š|
| 315 | T | 36 | Very low | 42.2 | Very low | 121 Ų | 121 | 130.9 Ų | 130.9 | 74% | 0.742 | 67% | 0.666 | S | S | * | * | trans | -117.6 | 28.3 | 179.8 | 55.5 | 0 | 0 | 0 | 0 | 113.3 | A312 | A312-T315 PolarHBondContact O-OG1 3.28Š| ||
| 316 | S | 32.1 | Very low | 40.4 | Very low | 110 Ų | 110 | 133.2 Ų | 133.2 | 77% | 0.769 | 69% | 0.688 | S | S | * | * | S | Bend | trans | -128 | 46.6 | 172.3 | 70.4 | 0 | 0 | 0 | 0 | 112.4 | ||
| 317 | S | 32.8 | Very low | 39.3 | Very low | 102 Ų | 102 | 141.4 Ų | 141.4 | 71% | 0.713 | 72% | 0.718 | S | S | * | * | S | Bend | trans | -166.7 | 124.4 | 146.5 | 50.6 | 0 | 0 | 0 | 0 | 107.8 | ||
| 318 | L | 33.9 | Very low | 37.9 | Very low | 171 Ų | 171 | 139.4 Ų | 139.4 | 90% | 0.895 | 73% | 0.725 | S | S | * | * | trans | 87.2 | 70.5 | -176.2 | -48.1 | 169.3 | 0 | 0 | 0 | 114.4 | I320 | L318-I320 PolarHBondContact O-N 3.35Š| ||
| 319 | D | 37.4 | Very low | 37.6 | Very low | 158 Ų | 158 | 142.3 Ų | 142.3 | 85% | 0.845 | 73% | 0.732 | S | S | * | * | trans | -52.5 | 124.1 | 134.7 | -98.8 | -33.8 | 0 | 0 | 0 | 108.2 | ||||
| 320 | I | 38.2 | Very low | 37.4 | Very low | 148 Ų | 148 | 141 Ų | 141 | 76% | 0.759 | 73% | 0.731 | S | S | * | * | trans | 176 | 123.5 | 134 | -83.1 | 149.7 | 0 | 0 | 0 | 108.2 | L318 | L318-I320 PolarHBondContact O-N 3.35Š| ||
| 321 | N | 33.4 | Very low | 37.7 | Very low | 154 Ų | 154 | 134.9 Ų | 134.9 | 82% | 0.824 | 71% | 0.71 | S | S | * | * | trans | 93.4 | 98.6 | 165.1 | -68.6 | -26.1 | 0 | 0 | 0 | 119.7 | R323 | N321-R323 PolarHBondContact O-N 3.46Š| ||
| 322 | N | 42 | Very low | 37.9 | Very low | 164 Ų | 164 | 134.9 Ų | 134.9 | 88% | 0.877 | 71% | 0.706 | S | S | * | * | trans | -45.2 | 96.3 | 155.9 | -81.4 | -17 | 0 | 0 | 0 | 113.3 | ||||
| 323 | R | 36.2 | Very low | 38.3 | Very low | 222 Ų | 222 | 136.7 Ų | 136.7 | 84% | 0.838 | 71% | 0.708 | S | S | * | * | trans | -147.3 | 111.1 | 136.6 | -73.7 | -165.6 | 175.3 | 160.6 | -3 | 107.5 | N321 L325 | N321-R323 PolarHBondContact O-N 3.46Å; R323-L325 VanDerWaalsContact C-N 3.26Å; R323-L325 HydrophobicContact CB-CD1 4.2Å; R323-L325 PolarHBondContact O-N 3.32Å | ||
| 324 | V | 40.1 | Very low | 38.7 | Very low | 150 Ų | 150 | 132.9 Ų | 132.9 | 91% | 0.909 | 70% | 0.699 | S | S | * | * | trans | -71.1 | 86.7 | 172.8 | -179.9 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 325 | L | 40.2 | Very low | 39.1 | Very low | 134 Ų | 134 | 133.7 Ų | 133.7 | 70% | 0.702 | 70% | 0.703 | S | S | * | * | trans | -78.3 | 138.6 | 158.1 | -96.8 | 79.8 | 0 | 0 | 0 | 107.9 | R323 R327 | R323-L325 VanDerWaalsContact C-N 3.26Å; R323-L325 HydrophobicContact CB-CD1 4.2Å; R323-L325 PolarHBondContact O-N 3.32Å; L325-R327 PolarHBondContact O-N 3.02Å | ||
| 326 | P | 36.3 | Very low | 39.2 | Very low | 124 Ų | 124 | 130.9 Ų | 130.9 | 81% | 0.805 | 70% | 0.698 | S | S | * | * | trans | -64.4 | 106.7 | 169.8 | 28.8 | -32 | 0 | 0 | 0 | 107.2 | P328 | P326-P328 WeakPolarHBondContact O-CD 3.3Š| ||
| 327 | R | 44.4 | Very low | 39.4 | Very low | 209 Ų | 209 | 129.6 Ų | 129.6 | 79% | 0.789 | 69% | 0.688 | S | S | * | * | P | Polyproline II helix | trans | -66.6 | 117.9 | 177.2 | -152.1 | 177.8 | -150.8 | -168.4 | 6.4 | 106.9 | L325 Y329 | L325-R327 PolarHBondContact O-N 3.02Å; R327-Y329 PolarHBondContact O-N 3.49Å |
| 328 | P | 40 | Very low | 39.7 | Very low | 110 Ų | 110 | 132.8 Ų | 132.8 | 71% | 0.714 | 70% | 0.698 | S | S | * | * | P | Polyproline II helix | trans | -64.3 | 130 | -176.9 | 26.2 | -34 | 0 | 0 | 0 | 109.3 | P326 | P326-P328 WeakPolarHBondContact O-CD 3.3Š|
| 329 | Y | 45.8 | Very low | 40 | Very low | 101 Ų | 101 | 130.5 Ų | 130.5 | 40% | 0.396 | 69% | 0.686 | S | S | . | * | P | Polyproline II helix | trans | -71 | 150.2 | 175 | -94.1 | -98.9 | 0 | 0 | 0 | 110.1 | H63 P311 R327 F331 D332 | H63-Y329 AromaticContact CE1-CD1 3.58Å; H63-Y329 AromaticContact CE1-CD2 3.99Å; H63-Y329 AromaticContact CE1-CG 3.5Å; H63-Y329 AromaticContact NE2-CD1 3.84Å; H63-Y329 AromaticContact NE2-CE1 3.93Å; P311-Y329 WeakPolarHBondContact CB-OH 3.41Å; P311-Y329 VanDerWaalsContact CG-OH 3.25Å; P311-Y329 WeakPolarHBondContact CG-OH 3.45Å; R327-Y329 PolarHBondContact O-N 3.49Å; Y329-F331 PolarHBondContact O-N 2.91Å; Y329-D332 PolarHBondContact O-N 3.24Å |
| 330 | F | 45.9 | Very low | 40.2 | Very low | 131 Ų | 131 | 132.2 Ų | 132.2 | 58% | 0.575 | 69% | 0.689 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -50.3 | -9.9 | -175.1 | -178.4 | -106.7 | 0 | 0 | 0 | 116.9 | Y126 | Y126-F330 WeakPolarHBondContact OH-CE1 3.25Å; Y126-F330 WeakPolarHBondContact OH-CZ 3.46Å |
| 331 | F | 41.8 | Very low | 40.4 | Very low | 69 Ų | 69 | 132.3 Ų | 132.3 | 30% | 0.303 | 69% | 0.69 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -127.8 | 2.9 | 179.3 | -76.6 | -71.6 | 0 | 0 | 0 | 114.9 | Q69 Y126 Y329 | Q69-F331 HydrophobicContact CB-CE2 4.21Å; Y126-F331 AromaticContact CE2-CE1 3.86Å; Y126-F331 HydrophobicContact CE2-CE1 3.86Å; Y126-F331 AromaticContact CE2-CZ 3.85Å; Y126-F331 HydrophobicContact CE2-CZ 3.85Å; Y329-F331 PolarHBondContact O-N 2.91Å |
| 332 | D | 41.7 | Very low | 40.4 | Very low | 75 Ų | 75 | 130 Ų | 130 | 40% | 0.401 | 68% | 0.683 | S | S | . | * | S | Bend | trans | -82.5 | 143.2 | 170.5 | -66.3 | -35.5 | 0 | 0 | 0 | 109.1 | Y329 | Y329-D332 PolarHBondContact O-N 3.24Š|
| 333 | D | 37.7 | Very low | 40.2 | Very low | 92 Ų | 92 | 124.7 Ų | 124.7 | 49% | 0.492 | 66% | 0.662 | S | S | . | * | trans | -44.1 | 147 | -153.3 | -86 | -55.2 | 0 | 0 | 0 | 118.1 | K64 E335 | K64-D333 IonicContact NZ-OD1 3.26Å; K64-D333 PolarHBondContact NZ-OD1 3.29Å; K64-D333 IonicContact NZ-OD2 2.82Å; K64-D333 PolarHBondContact NZ-OD2 3.43Å; D333-E335 HydrophobicContact CB-CB 4.41Å; D333-E335 PolarHBondContact O-N 2.78Å | ||
| 334 | P | 42.6 | Very low | 40.5 | Very low | 97 Ų | 97 | 119.1 Ų | 119.1 | 63% | 0.63 | 65% | 0.654 | S | S | * | * | S | Bend | trans | -79.1 | 14.1 | 167.5 | 36.8 | -36.4 | 0 | 0 | 0 | 113.2 | G336 | P334-G336 PolarHBondContact O-N 2.83Š|
| 335 | E | 42.9 | Very low | 40.9 | Very low | 166 Ų | 166 | 122.6 Ų | 122.6 | 78% | 0.776 | 65% | 0.652 | S | S | * | * | trans | -76.1 | 79.7 | 164.1 | -72.8 | -176.8 | 140.5 | 0 | 0 | 107 | D333 S337 | D333-E335 HydrophobicContact CB-CB 4.41Å; D333-E335 PolarHBondContact O-N 2.78Å; E335-S337 PolarHBondContact O-N 3.25Å; E335-S337 VanDerWaalsContact O-N 3.08Å | ||
| 336 | G | 38.4 | Very low | 40.6 | Very low | 62 Ų | 62 | 122.9 Ų | 122.9 | 64% | 0.639 | 65% | 0.654 | S | S | * | * | trans | -57.8 | 111.3 | 152.3 | 0 | 0 | 0 | 0 | 0 | 105.9 | P334 D338 | P334-G336 PolarHBondContact O-N 2.83Å; G336-D338 PolarHBondContact O-N 3.17Å | ||
| 337 | S | 36 | Very low | 40.5 | Very low | 82 Ų | 82 | 127.9 Ų | 127.9 | 57% | 0.573 | 66% | 0.656 | S | S | * | * | trans | -37 | 127.3 | 162 | 48.6 | 0 | 0 | 0 | 0 | 109.4 | E335 D339 | E335-S337 PolarHBondContact O-N 3.25Å; E335-S337 VanDerWaalsContact O-N 3.08Å; S337-D339 PolarHBondContact O-N 3.25Å | ||
| 338 | D | 38.8 | Very low | 40 | Very low | 170 Ų | 170 | 122.8 Ų | 122.8 | 91% | 0.909 | 65% | 0.653 | S | S | * | * | S | Bend | trans | -63.3 | 30.1 | 172.4 | -76.3 | -40 | 0 | 0 | 0 | 113.3 | G336 | G336-D338 PolarHBondContact O-N 3.17Š|
| 339 | D | 40.3 | Very low | 39.9 | Very low | 123 Ų | 123 | 123.7 Ų | 123.7 | 66% | 0.658 | 66% | 0.659 | S | S | * | * | trans | -97 | 109.1 | 175 | -66 | -38.5 | 0 | 0 | 0 | 108.1 | S337 I341 | S337-D339 PolarHBondContact O-N 3.25Å; D339-I341 PolarHBondContact O-N 2.83Å | ||
| 340 | E | 41.7 | Very low | 39.2 | Very low | 193 Ų | 193 | 125.2 Ų | 125.2 | 90% | 0.902 | 68% | 0.679 | S | S | * | * | trans | -42.5 | 95.2 | 173.5 | -69.9 | 175.6 | 138.6 | 0 | 0 | 111.8 | P342 | E340-P342 WeakPolarHBondContact O-CD 3.46Š| ||
| 341 | I | 41.6 | Very low | 38.6 | Very low | 151 Ų | 151 | 127.7 Ų | 127.7 | 77% | 0.774 | 69% | 0.692 | S | S | * | * | trans | -92.4 | 112.5 | 161.1 | -60.1 | 171.2 | 0 | 0 | 0 | 105.8 | D339 A343 | D339-I341 PolarHBondContact O-N 2.83Å; I341-A343 PolarHBondContact O-N 3.5Å | ||
| 342 | P | 34.6 | Very low | 38 | Very low | 104 Ų | 104 | 131.7 Ų | 131.7 | 68% | 0.675 | 72% | 0.717 | S | S | * | * | trans | -61.2 | 138.4 | 178.1 | -18.1 | 30.3 | 0 | 0 | 0 | 110 | E340 | E340-P342 WeakPolarHBondContact O-CD 3.46Š| ||
| 343 | A | 38.1 | Very low | 37.5 | Very low | 54 Ų | 54 | 137.1 Ų | 137.1 | 45% | 0.446 | 74% | 0.74 | S | S | . | * | trans | -53.9 | 140.7 | 177 | 0 | 0 | 0 | 0 | 0 | 110.7 | I341 W345 D346 | I341-A343 PolarHBondContact O-N 3.5Å; A343-W345 PolarHBondContact O-N 3.31Å; A343-D346 PolarHBondContact O-N 3.1Å | ||
| 344 | P | 42.6 | Very low | 37.1 | Very low | 104 Ų | 104 | 138.8 Ų | 138.8 | 68% | 0.675 | 76% | 0.759 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.1 | 8.3 | -168.5 | 28.8 | -38 | 0 | 0 | 0 | 115.5 | ||
| 345 | W | 47.9 | Very low | 36.5 | Very low | 224 Ų | 224 | 145.9 Ų | 145.9 | 85% | 0.848 | 77% | 0.773 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -108.5 | -10.2 | -178.5 | -18.6 | 92.1 | 0 | 0 | 0 | 113.1 | A343 R347 | A343-W345 PolarHBondContact O-N 3.31Å; W345-R347 PolarHBondContact O-N 2.92Å; W345-R347 VanDerWaalsContact O-N 3.17Å |
| 346 | D | 34.3 | Very low | 35.9 | Very low | 139 Ų | 139 | 148.3 Ų | 148.3 | 74% | 0.743 | 78% | 0.776 | S | S | * | * | trans | -86.9 | 81 | 171.8 | -95.7 | -26 | 0 | 0 | 0 | 110.1 | A343 | A343-D346 PolarHBondContact O-N 3.1Š| ||
| 347 | R | 33.4 | Very low | 35.4 | Very low | 229 Ų | 229 | 149.2 Ų | 149.2 | 86% | 0.864 | 79% | 0.786 | S | S | * | * | trans | -133 | 96.4 | 160.7 | -70.2 | -168 | -168.9 | -164.4 | 3.8 | 110 | W345 | W345-R347 PolarHBondContact O-N 2.92Å; W345-R347 VanDerWaalsContact O-N 3.17Å | ||
| 348 | S | 34.4 | Very low | 35.2 | Very low | 102 Ų | 102 | 150.3 Ų | 150.3 | 71% | 0.713 | 79% | 0.794 | S | S | * | * | trans | -67.4 | 139.4 | 153.3 | -17.7 | 0 | 0 | 0 | 0 | 108.3 | T350 | S348-T350 PolarHBondContact O-N 3.12Š| ||
| 349 | P | 36.2 | Very low | 34.7 | Very low | 130 Ų | 130 | 150.1 Ų | 150.1 | 84% | 0.844 | 79% | 0.787 | S | S | * | * | trans | -88 | 96.1 | -178.5 | 33.4 | -28.5 | 0 | 0 | 0 | 109.4 | ||||
| 350 | T | 32.9 | Very low | 34.4 | Very low | 133 Ų | 133 | 150.9 Ų | 150.9 | 82% | 0.816 | 80% | 0.796 | S | S | * | * | trans | -128.3 | 96 | 163.1 | 26.5 | 0 | 0 | 0 | 0 | 110.8 | S348 N352 | S348-T350 PolarHBondContact O-N 3.12Å; T350-N352 PolarHBondContact O-N 3.44Å | ||
| 351 | Q | 31.9 | Very low | 33.9 | Very low | 182 Ų | 182 | 146.6 Ų | 146.6 | 85% | 0.85 | 79% | 0.794 | S | S | * | * | trans | -36.9 | 117 | 153.8 | -173.1 | 176.9 | 21.8 | 0 | 0 | 112.4 | ||||
| 352 | N | 30.2 | Very low | 33.9 | Very low | 154 Ų | 154 | 144.4 Ų | 144.4 | 82% | 0.824 | 79% | 0.79 | S | S | * | * | -170.1 | 121.9 | 126 | -103.1 | -12.7 | 0 | 0 | 0 | 112.5 | T350 | T350-N352 PolarHBondContact O-N 3.44Š| |||
| 353 | Q | 31.4 | Very low | 33.7 | Very low | 189 Ų | 189 | 146.8 Ų | 146.8 | 88% | 0.883 | 80% | 0.796 | S | S | * | * | trans | -70.5 | 134 | 166 | -67.9 | 164 | -26.6 | 0 | 0 | 109.3 | ||||
| 354 | S | 29.1 | Very low | 33.2 | Very low | 127 Ų | 127 | 150.2 Ų | 150.2 | 89% | 0.888 | 81% | 0.806 | S | S | * | * | trans | -172.9 | 128.9 | 133.8 | 37.8 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 355 | W | 29.8 | Very low | 32.7 | Very low | 245 Ų | 245 | 153.8 Ų | 153.8 | 93% | 0.928 | 81% | 0.811 | S | S | * | * | trans | -98.3 | 131.3 | -175.8 | -173.7 | -78.6 | 0 | 0 | 0 | 108 | ||||
| 356 | Y | 30.8 | Very low | 31.8 | Very low | 217 Ų | 217 | 147 Ų | 147 | 85% | 0.851 | 80% | 0.803 | S | S | * | * | trans | 6.8 | 129 | 168.9 | -87 | -91.7 | 0 | 0 | 0 | 120.7 | ||||
| 357 | G | 28.1 | Very low | 31.6 | Very low | 81 Ų | 81 | 148.6 Ų | 148.6 | 84% | 0.835 | 81% | 0.811 | S | S | * | * | trans | -161.2 | 75.8 | 159.6 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 358 | S | 30.3 | Very low | 31.6 | Very low | 106 Ų | 106 | 145 Ų | 145 | 74% | 0.741 | 81% | 0.81 | S | S | * | * | trans | -75.3 | 117 | 164.2 | 162.1 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 359 | E | 29.6 | Very low | 32.6 | Very low | 166 Ų | 166 | 145.4 Ų | 145.4 | 78% | 0.776 | 81% | 0.81 | S | S | * | * | trans | 178 | 131.3 | 137.6 | -102 | 168.5 | 158.9 | 0 | 0 | 111.9 | ||||
| 360 | T | 33.7 | Very low | 32.4 | Very low | 138 Ų | 138 | 143.2 Ų | 143.2 | 85% | 0.847 | 80% | 0.802 | S | S | * | * | trans | 64.6 | 106.3 | 154.5 | 58.5 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 361 | A | 31.6 | Very low | 32.5 | Very low | 103 Ų | 103 | 143.7 Ų | 143.7 | 85% | 0.851 | 80% | 0.8 | S | S | * | * | trans | -119.4 | 135.4 | 148.7 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 362 | P | 41.8 | Very low | 32.7 | Very low | 106 Ų | 106 | 143.5 Ų | 143.5 | 69% | 0.688 | 80% | 0.799 | S | S | * | * | trans | -119.8 | 139.3 | 149.6 | 26.4 | -10 | 0 | 0 | 0 | 111.4 | ||||
| 363 | L | 28.8 | Very low | 32.8 | Very low | 154 Ų | 154 | 139.8 Ų | 139.8 | 81% | 0.806 | 79% | 0.785 | S | S | * | * | trans | 66.7 | 112 | 139.1 | -66 | -179.6 | 0 | 0 | 0 | 118.4 | ||||
| 364 | L | 28.1 | Very low | 32.9 | Very low | 126 Ų | 126 | 138.8 Ų | 138.8 | 66% | 0.66 | 78% | 0.78 | S | S | * | * | 156.7 | 147.2 | 89.9 | -104.7 | 162.2 | 0 | 0 | 0 | 114.8 | |||||
| 365 | F | 32 | Very low | 33.3 | Very low | 178 Ų | 178 | 140 Ų | 140 | 78% | 0.781 | 77% | 0.772 | S | S | * | * | trans | 75.1 | 103 | 165.6 | -54.4 | -66.7 | 0 | 0 | 0 | 117.6 | ||||
| 366 | A | 29.3 | Very low | 33.5 | Very low | 81 Ų | 81 | 135.5 Ų | 135.5 | 67% | 0.669 | 76% | 0.761 | S | S | * | * | 74 | 107 | 69.3 | 0 | 0 | 0 | 0 | 0 | 114.3 | |||||
| 367 | N | 29.9 | Very low | 33.8 | Very low | 173 Ų | 173 | 134.3 Ų | 134.3 | 93% | 0.925 | 76% | 0.762 | S | S | * | * | -172 | 145.5 | 115.1 | -98.8 | -15.4 | 0 | 0 | 0 | 112.5 | |||||
| 368 | N | 33.1 | Very low | 34.3 | Very low | 155 Ų | 155 | 134.9 Ų | 134.9 | 83% | 0.829 | 75% | 0.753 | S | S | * | * | trans | -97.1 | -166.9 | -163.4 | -140.5 | 7.5 | 0 | 0 | 0 | 110.7 | ||||
| 369 | P | 56.3 | Low | 34.5 | Very low | 109 Ų | 109 | 139 Ų | 139 | 71% | 0.708 | 76% | 0.758 | S | S | * | * | trans | -120.6 | -171.5 | -132.1 | 34.3 | -10.5 | 0 | 0 | 0 | 113.8 | ||||
| 370 | A | 32.7 | Very low | 34.9 | Very low | 84 Ų | 84 | 141.6 Ų | 141.6 | 69% | 0.694 | 76% | 0.763 | S | S | * | * | trans | -174.9 | 116.8 | 147 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 371 | D | 33.4 | Very low | 35.3 | Very low | 143 Ų | 143 | 139.3 Ų | 139.3 | 77% | 0.765 | 75% | 0.752 | S | S | * | * | 73 | 115.1 | 104.2 | -72.6 | -32.2 | 0 | 0 | 0 | 116.3 | |||||
| 372 | H | 36.5 | Very low | 35.9 | Very low | 179 Ų | 179 | 140.5 Ų | 140.5 | 83% | 0.829 | 75% | 0.749 | S | S | * | * | 176.6 | 97.9 | 113.9 | -94.6 | -62.3 | 0 | 0 | 0 | 112.9 | |||||
| 373 | S | 31.4 | Very low | 36.4 | Very low | 76 Ų | 76 | 141.6 Ų | 141.6 | 53% | 0.531 | 76% | 0.756 | S | S | . | * | 11.6 | 136.6 | 126.5 | 61.1 | 0 | 0 | 0 | 0 | 122.7 | |||||
| 374 | H | 35 | Very low | 37.3 | Very low | 167 Ų | 167 | 143.1 Ų | 143.1 | 77% | 0.773 | 76% | 0.759 | S | S | * | * | trans | 70 | 143.9 | 138.4 | -64.5 | -39.2 | 0 | 0 | 0 | 117.7 | ||||
| 375 | Q | 36.2 | Very low | 38.1 | Very low | 153 Ų | 153 | 148.6 Ų | 148.6 | 72% | 0.715 | 79% | 0.789 | S | S | * | * | cis | -173.2 | 157.5 | 11 | -110.1 | 169.4 | -12.1 | 0 | 0 | 107.7 | ||||
| 376 | H | 34 | Very low | 38.4 | Very low | 151 Ų | 151 | 147.2 Ų | 147.2 | 70% | 0.699 | 79% | 0.79 | S | S | * | * | trans | 22.3 | 136.4 | 151.2 | -62 | -73.5 | 0 | 0 | 0 | 122.4 | ||||
| 377 | H | 38.4 | Very low | 38.8 | Very low | 191 Ų | 191 | 150.6 Ų | 150.6 | 88% | 0.884 | 80% | 0.796 | S | S | * | * | -177 | 136.7 | 104.9 | -91.8 | -66.9 | 0 | 0 | 0 | 112.4 | |||||
| 378 | S | 37.9 | Very low | 39.3 | Very low | 93 Ų | 93 | 149.4 Ų | 149.4 | 65% | 0.65 | 79% | 0.789 | S | S | * | * | trans | -99.1 | 159.3 | 177 | -55.1 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 379 | F | 35.7 | Very low | 39.7 | Very low | 193 Ų | 193 | 149.1 Ų | 149.1 | 85% | 0.846 | 79% | 0.787 | S | S | * | * | trans | 76.9 | 115.8 | 164 | -57.9 | -79.9 | 0 | 0 | 0 | 118 | ||||
| 380 | Y | 36.9 | Very low | 38.7 | Very low | 220 Ų | 220 | 151.6 Ų | 151.6 | 86% | 0.863 | 79% | 0.792 | S | S | * | * | -174 | 162.6 | 87 | -136.3 | -97.9 | 0 | 0 | 0 | 112.5 | |||||
| 381 | S | 41.7 | Very low | 39.1 | Very low | 90 Ų | 90 | 156.1 Ų | 156.1 | 63% | 0.629 | 80% | 0.798 | S | S | * | * | trans | -53.7 | 160.5 | -171.2 | -47.4 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 382 | T | 43.7 | Very low | 39.5 | Very low | 129 Ų | 129 | 157 Ų | 157 | 79% | 0.791 | 80% | 0.8 | S | S | * | * | trans | -43 | 161.8 | 159.9 | 52.3 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 383 | P | 52.3 | Low | 39.7 | Very low | 128 Ų | 128 | 155.3 Ų | 155.3 | 83% | 0.831 | 80% | 0.798 | S | S | * | * | -137 | 164.6 | 82.7 | 26.6 | -6.1 | 0 | 0 | 0 | 115.5 | |||||
| 384 | Q | 49.2 | Very low | 40.4 | Very low | 186 Ų | 186 | 161.9 Ų | 161.9 | 87% | 0.869 | 82% | 0.821 | S | S | * | * | trans | -55.8 | 152.9 | 175.5 | -72.7 | 161 | -56 | 0 | 0 | 114.2 | ||||
| 385 | N | 43.7 | Very low | 40.9 | Very low | 242 Ų | 242 | 161.5 Ų | 161.5 | 100% | 1.294 | 83% | 0.825 | S | S | * | * | -134.2 | 0 | 129.1 | -131.9 | 12.6 | 0 | 0 | 0 | 109.2 |
Retrieved 385 of 385 residues in 1872.7 ms
(Link to these results)