| 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 | 34.3 | Very low | 30.4 | Very low | 250 Ų | 250 | 160.5 Ų | 160.5 | 100% | 1.232 | 86% | 0.858 | S | S | * | * | 0 | 119.3 | 0 | -88 | 165.6 | 142.3 | 0 | 0 | 108.4 | |||||
| 2 | G | 32.1 | Very low | 30.5 | Very low | 79 Ų | 79 | 159.6 Ų | 159.6 | 81% | 0.814 | 85% | 0.852 | S | S | * | * | trans | 66.1 | 107.1 | 171.6 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 3 | N | 26.2 | Very low | 30.3 | Very low | 157 Ų | 157 | 156.3 Ų | 156.3 | 84% | 0.84 | 84% | 0.841 | S | S | * | * | cis | 66.1 | 93.8 | 41.7 | -88.7 | 7.3 | 0 | 0 | 0 | 117.3 | ||||
| 4 | I | 33.5 | Very low | 30.6 | Very low | 150 Ų | 150 | 154 Ų | 154 | 77% | 0.769 | 83% | 0.834 | S | S | * | * | trans | 9.5 | 152 | 134.5 | -17.8 | 174.9 | 0 | 0 | 0 | 116.7 | ||||
| 5 | P | 42 | Very low | 30.2 | Very low | 121 Ų | 121 | 152.3 Ų | 152.3 | 79% | 0.786 | 83% | 0.825 | S | S | * | * | cis | -158.7 | 176 | 37.9 | 43.1 | -18.3 | 0 | 0 | 0 | 123.4 | ||||
| 6 | R | 32.2 | Very low | 30.1 | Very low | 236 Ų | 236 | 146.4 Ų | 146.4 | 89% | 0.891 | 80% | 0.798 | S | S | * | * | trans | -65.4 | 145.2 | 160.7 | -77.6 | 175.3 | 163.2 | 170.5 | -5.1 | 113.7 | ||||
| 7 | K | 28.9 | Very low | 30.4 | Very low | 217 Ų | 217 | 144.4 Ų | 144.4 | 94% | 0.943 | 81% | 0.806 | S | S | * | * | trans | 167.1 | 146.3 | 135.9 | -104.3 | 178.8 | 173.7 | 178.8 | 0 | 107.3 | ||||
| 8 | G | 25.4 | Very low | 30.2 | Very low | 72 Ų | 72 | 142.7 Ų | 142.7 | 74% | 0.742 | 80% | 0.8 | S | S | * | * | cis | -173.3 | 175.8 | 10.9 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 9 | S | 28.4 | Very low | 30.5 | Very low | 116 Ų | 116 | 140.4 Ų | 140.4 | 81% | 0.811 | 79% | 0.794 | S | S | * | * | trans | -92.1 | 170.9 | -163.5 | -32.6 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 10 | R | 26.6 | Very low | 30.7 | Very low | 227 Ų | 227 | 141.9 Ų | 141.9 | 86% | 0.857 | 80% | 0.799 | S | S | * | * | trans | 93.9 | 127 | 166.4 | -59.2 | 178.3 | 173.5 | 171.6 | -3.4 | 113.5 | ||||
| 11 | D | 25 | Very low | 30.9 | Very low | 141 Ų | 141 | 143.9 Ų | 143.9 | 75% | 0.754 | 80% | 0.802 | S | S | * | * | cis | -135.1 | 134.1 | 39.6 | -63.6 | -51 | 0 | 0 | 0 | 111.4 | ||||
| 12 | L | 31.4 | Very low | 31.4 | Very low | 149 Ų | 149 | 138.3 Ų | 138.3 | 78% | 0.78 | 78% | 0.777 | S | S | * | * | 41.1 | 73.5 | 81.9 | -76.9 | 170.3 | 0 | 0 | 0 | 114.6 | |||||
| 13 | V | 27.2 | Very low | 32.2 | Very low | 117 Ų | 117 | 136 Ų | 136 | 71% | 0.709 | 75% | 0.753 | S | S | * | * | trans | -121.8 | 100.6 | 142.7 | -178.2 | 0 | 0 | 0 | 0 | 107.6 | D15 | V13-D15 HydrophobicContact CG1-CB 4.21Å; V13-D15 PolarHBondContact O-N 3.45Å | ||
| 14 | V | 34.9 | Very low | 33.8 | Very low | 124 Ų | 124 | 134.3 Ų | 134.3 | 75% | 0.752 | 75% | 0.751 | S | S | * | * | trans | -71.1 | 102.6 | 156.5 | 172.9 | 0 | 0 | 0 | 0 | 105.2 | ||||
| 15 | D | 25.1 | Very low | 35.4 | Very low | 129 Ų | 129 | 130.6 Ų | 130.6 | 69% | 0.69 | 74% | 0.738 | S | S | * | * | trans | -118.4 | 93.4 | 157.1 | -97.6 | -34.4 | 0 | 0 | 0 | 106.3 | V13 | V13-D15 HydrophobicContact CG1-CB 4.21Å; V13-D15 PolarHBondContact O-N 3.45Å | ||
| 16 | S | 28.6 | Very low | 36.7 | Very low | 58 Ų | 58 | 126.1 Ų | 126.1 | 41% | 0.406 | 71% | 0.711 | S | S | . | * | 59.6 | 84.1 | 95.9 | 73.9 | 0 | 0 | 0 | 0 | 108.3 | T18 | S16-T18 PolarHBondContact O-N 2.9Å; S16-T18 PolarHBondContact O-OG1 2.93Å; S16-T18 VanDerWaalsContact O-OG1 3.05Å | |||
| 17 | A | 35.3 | Very low | 38.9 | Very low | 112 Ų | 112 | 117.1 Ų | 117.1 | 93% | 0.926 | 69% | 0.687 | S | S | * | * | 34.6 | 51.7 | 92.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | |||||
| 18 | T | 27.3 | Very low | 41.4 | Very low | 113 Ų | 113 | 108.3 Ų | 108.3 | 69% | 0.693 | 65% | 0.65 | S | S | * | * | trans | -107.4 | 92.3 | 169.1 | 36.7 | 0 | 0 | 0 | 0 | 106.6 | S16 L20 | S16-T18 PolarHBondContact O-N 2.9Å; S16-T18 PolarHBondContact O-OG1 2.93Å; S16-T18 VanDerWaalsContact O-OG1 3.05Å; T18-L20 PolarHBondContact O-N 3.08Å | ||
| 19 | S | 35.9 | Very low | 44.2 | Very low | 99 Ų | 99 | 105.5 Ų | 105.5 | 69% | 0.692 | 62% | 0.618 | S | S | * | * | trans | 17 | 95.5 | 147.7 | 51.8 | 0 | 0 | 0 | 0 | 114.7 | E21 | S19-E21 VanDerWaalsContact C-N 3.34Å; S19-E21 PolarHBondContact O-N 3Å | ||
| 20 | L | 34.1 | Very low | 46.8 | Very low | 171 Ų | 171 | 101.6 Ų | 101.6 | 90% | 0.895 | 59% | 0.59 | S | S | * | * | trans | -50.6 | 109.3 | 153.1 | -86.3 | 156.8 | 0 | 0 | 0 | 106 | T18 D22 | T18-L20 PolarHBondContact O-N 3.08Å; L20-D22 PolarHBondContact O-N 2.85Å | ||
| 21 | E | 35 | Very low | 49.6 | Very low | 184 Ų | 184 | 97.2 Ų | 97.2 | 86% | 0.86 | 58% | 0.578 | S | S | * | * | trans | -48.5 | 111.5 | -175.3 | -63.3 | -176.4 | 149.9 | 0 | 0 | 109.5 | S19 G23 | S19-E21 VanDerWaalsContact C-N 3.34Å; S19-E21 PolarHBondContact O-N 3Å; E21-G23 PolarHBondContact O-N 3.33Å | ||
| 22 | D | 43.4 | Very low | 52.4 | Low | 133 Ų | 133 | 90.5 Ų | 90.5 | 71% | 0.711 | 54% | 0.542 | S | S | * | . | trans | -63 | 82 | 162.9 | -80.1 | -42.8 | 0 | 0 | 0 | 107 | L20 | L20-D22 PolarHBondContact O-N 2.85Š| ||
| 23 | G | 49.1 | Very low | 55.1 | Low | 30 Ų | 30 | 83.6 Ų | 83.6 | 31% | 0.309 | 51% | 0.505 | S | S | . | . | trans | -55 | 152 | 178.6 | 0 | 0 | 0 | 0 | 0 | 110.7 | E21 S25 A26 A27 | E21-G23 PolarHBondContact O-N 3.33Å; G23-S25 PolarHBondContact O-N 3.22Å; G23-A26 PolarHBondContact O-N 3.31Å; G23-A27 PolarHBondContact O-N 3.32Å | ||
| 24 | P | 61.1 | Low | 57.9 | Low | 121 Ų | 121 | 80.4 Ų | 80.4 | 79% | 0.786 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -54.6 | -25.9 | -176.6 | 19.2 | -31.5 | 0 | 0 | 0 | 113.6 | L28 | P24-L28 WeakPolarHBondContact O-CB 3.49Å; P24-L28 PolarHBondContact O-N 2.88Å |
| 25 | S | 65.7 | Low | 60.4 | Low | 73 Ų | 73 | 74.8 Ų | 74.8 | 51% | 0.51 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -68.5 | -41 | 174.7 | -179.3 | 0 | 0 | 0 | 0 | 113.5 | G23 L28 H29 | G23-S25 PolarHBondContact O-N 3.22Å; S25-L28 PolarHBondContact O-N 3.12Å; S25-H29 PolarHBondContact O-CD2 3.29Å; S25-H29 VanDerWaalsContact O-CG 3.31Å; S25-H29 PolarHBondContact O-N 3.11Å |
| 26 | A | 70.9 | Confident | 63.4 | Low | 27 Ų | 27 | 68.7 Ų | 68.7 | 22% | 0.223 | 42% | 0.416 | C | S | . | . | H | α-helix | trans | -68.4 | -40.6 | 179.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | G23 L28 H29 S30 L60 | G23-A26 PolarHBondContact O-N 3.31Å; A26-L28 VanDerWaalsContact C-N 3.31Å; A26-L28 PolarHBondContact O-N 3.38Å; A26-H29 PolarHBondContact O-N 3.32Å; A26-S30 PolarHBondContact O-N 3.01Å; A26-L60 HydrophobicContact CB-CD1 4.09Å |
| 27 | A | 76.6 | Confident | 66.2 | Low | 46 Ų | 46 | 67.5 Ų | 67.5 | 38% | 0.38 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -63.7 | -36.9 | 174 | 0 | 0 | 0 | 0 | 0 | 112.1 | G23 K31 | G23-A27 PolarHBondContact O-N 3.32Å; A27-K31 WeakPolarHBondContact O-CG 3.23Å; A27-K31 PolarHBondContact O-N 2.99Å; A27-K31 VanDerWaalsContact O-N 3.16Å |
| 28 | L | 82.4 | Confident | 68.8 | Low | 33 Ų | 33 | 70.5 Ų | 70.5 | 17% | 0.173 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -66.9 | -45.6 | 175.6 | -172 | 147.1 | 0 | 0 | 0 | 111.7 | P24 S25 A26 S30 K31 L32 L47 N50 H51 | P24-L28 WeakPolarHBondContact O-CB 3.49Å; P24-L28 PolarHBondContact O-N 2.88Å; S25-L28 PolarHBondContact O-N 3.12Å; A26-L28 VanDerWaalsContact C-N 3.31Å; A26-L28 PolarHBondContact O-N 3.38Å; L28-S30 VanDerWaalsContact C-N 3.34Å; L28-S30 PolarHBondContact O-N 2.85Å; L28-K31 PolarHBondContact O-N 3.25Å; L28-L32 WeakPolarHBondContact O-CB 3.41Å; L28-L32 PolarHBondContact O-N 2.85Å; L28-L47 HydrophobicContact CG-CD2 4.42Å; L28-N50 HydrophobicContact CD1-CB 4.16Å; L28-H51 HydrophobicContact CD2-CB 3.76Å |
| 29 | H | 84.5 | Confident | 71.6 | Confident | 13 Ų | 13 | 68 Ų | 68 | 6% | 0.06 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -59.9 | -42.3 | 177 | -68.6 | 177 | 0 | 0 | 0 | 112.2 | S25 A26 L32 Y33 H51 I57 T58 | S25-H29 PolarHBondContact O-CD2 3.29Å; S25-H29 VanDerWaalsContact O-CG 3.31Å; S25-H29 PolarHBondContact O-N 3.11Å; A26-H29 PolarHBondContact O-N 3.32Å; H29-L32 PolarHBondContact O-N 3.39Å; H29-Y33 WeakPolarHBondContact O-CB 3.48Å; H29-Y33 PolarHBondContact O-N 3.46Å; H29-H51 AromaticContact NE2-CD2 3.73Å; H29-H51 AromaticContact NE2-NE2 3.6Å; H29-I57 HydrophobicContact CB-CB 4.14Å; H29-I57 HydrophobicContact CB-CG2 4.42Å; H29-T58 PolarHBondContact ND1-N 3.45Å |
| 30 | S | 82.1 | Confident | 74.2 | Confident | 33 Ų | 33 | 65.9 Ų | 65.9 | 23% | 0.231 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -64.8 | -40.1 | 177.1 | -170 | 0 | 0 | 0 | 0 | 112.4 | A26 L28 E34 S63 | A26-S30 PolarHBondContact O-N 3.01Å; L28-S30 VanDerWaalsContact C-N 3.34Å; L28-S30 PolarHBondContact O-N 2.85Å; S30-E34 PolarHBondContact O-N 3.18Å; S30-E34 VanDerWaalsContact O-N 3.11Å; S30-S63 WeakPolarHBondContact OG-CB 3.15Å |
| 31 | K | 85 | Confident | 76.9 | Confident | 136 Ų | 136 | 59.3 Ų | 59.3 | 59% | 0.591 | 32% | 0.322 | S | S | * | . | H | α-helix | trans | -66.8 | -41.9 | 176.5 | -74.2 | 176.3 | -178.6 | -179.9 | 0 | 111.9 | A27 L28 E34 A35 L47 | A27-K31 WeakPolarHBondContact O-CG 3.23Å; A27-K31 PolarHBondContact O-N 2.99Å; A27-K31 VanDerWaalsContact O-N 3.16Å; L28-K31 PolarHBondContact O-N 3.25Å; K31-E34 PolarHBondContact O-N 3.47Å; K31-A35 WeakPolarHBondContact O-CB 3.26Å; K31-A35 PolarHBondContact O-N 2.77Å; K31-L47 HydrophobicContact CB-CD1 3.99Å |
| 32 | L | 85.4 | Confident | 79.5 | Confident | 0 Ų | 0 | 54.9 Ų | 54.9 | 0% | 0 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -65.9 | -41.1 | 178.3 | -176.9 | 55.8 | 0 | 0 | 0 | 111.4 | L28 H29 A35 I36 I44 L47 L48 I57 P79 | L28-L32 WeakPolarHBondContact O-CB 3.41Å; L28-L32 PolarHBondContact O-N 2.85Å; H29-L32 PolarHBondContact O-N 3.39Å; L32-A35 PolarHBondContact O-N 2.87Å; L32-I36 HydrophobicContact CD1-CD1 4.14Å; L32-I36 HydrophobicContact CD1-CG1 4.37Å; L32-I36 HydrophobicContact CG-CD1 4.05Å; L32-I36 WeakPolarHBondContact O-CD1 3.44Å; L32-I36 VanDerWaalsContact O-CG1 3.27Å; L32-I36 WeakPolarHBondContact O-CG1 3.49Å; L32-I36 PolarHBondContact O-N 2.82Å; L32-I44 HydrophobicContact CD1-CG2 4.45Å; L32-L47 HydrophobicContact CB-CD1 4.13Å; L32-L47 HydrophobicContact CD1-CB 4.17Å; L32-L47 HydrophobicContact CD1-CD1 4.33Å; L32-L48 HydrophobicContact CD1-CD2 4.45Å; L32-L48 HydrophobicContact CD2-CD2 4.33Å; L32-I57 HydrophobicContact CD2-CG2 3.92Å; L32-P79 HydrophobicContact CD2-CG 4.28Å |
| 33 | Y | 86.9 | Confident | 81.7 | Confident | 4 Ų | 4 | 51 Ų | 51 | 2% | 0.016 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -56.2 | -50.5 | 172 | 173.8 | -94.1 | 0 | 0 | 0 | 111.9 | H29 A35 I36 M37 I59 L82 | H29-Y33 WeakPolarHBondContact O-CB 3.48Å; H29-Y33 PolarHBondContact O-N 3.46Å; Y33-A35 PolarHBondContact O-N 2.87Å; Y33-I36 PolarHBondContact O-N 2.87Å; Y33-M37 HydrophobicContact CD1-CG 4.36Å; Y33-M37 HydrophobicContact CE1-CG 3.98Å; Y33-M37 HydrophobicContact CE2-CG 4.13Å; Y33-M37 VanDerWaalsContact O-CG 3.31Å; Y33-M37 WeakPolarHBondContact O-CG 3.3Å; Y33-M37 PolarHBondContact O-N 3.05Å; Y33-I59 HydrophobicContact CD2-CD1 3.42Å; Y33-I59 VanDerWaalsContact CD2-CD1 3.42Å; Y33-I59 HydrophobicContact CD2-CG1 3.85Å; Y33-I59 HydrophobicContact CE2-CD1 3.55Å; Y33-I59 HydrophobicContact CE2-CG1 4.34Å; Y33-I59 HydrophobicContact CG-CD1 4.42Å; Y33-I59 HydrophobicContact CG-CG1 4.43Å; Y33-L82 HydrophobicContact CD2-CD1 4.08Å; Y33-L82 HydrophobicContact CD2-CD2 3.47Å; Y33-L82 VanDerWaalsContact CD2-CD2 3.47Å; Y33-L82 HydrophobicContact CD2-CG 4.44Å; Y33-L82 HydrophobicContact CE2-CD1 3.78Å; Y33-L82 HydrophobicContact CE2-CD2 3.98Å; Y33-L82 HydrophobicContact CG-CD2 4.37Å |
| 34 | E | 86.3 | Confident | 83.6 | Confident | 50 Ų | 50 | 49.6 Ų | 49.6 | 23% | 0.234 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -64.8 | -39.9 | -178.3 | -171.1 | 169.5 | 157 | 0 | 0 | 112.2 | S30 K31 M37 R38 S65 | S30-E34 PolarHBondContact O-N 3.18Å; S30-E34 VanDerWaalsContact O-N 3.11Å; K31-E34 PolarHBondContact O-N 3.47Å; E34-M37 PolarHBondContact O-N 3.1Å; E34-R38 WeakPolarHBondContact O-CB 3Å; E34-R38 WeakPolarHBondContact O-CG 3.34Å; E34-R38 PolarHBondContact O-N 2.83Å; E34-R38 IonicContact OE1-CZ 3.38Å; E34-R38 IonicContact OE1-NE 2.78Å; E34-R38 IonicContact OE1-NH1 3.75Å; E34-R38 PolarHBondContact OE1-NH1 2.93Å; E34-R38 IonicContact OE1-NH2 3.97Å; E34-R38 PolarHBondContact OE1-NH2 3.2Å; E34-S65 PolarHBondContact OE2-OG 2.73Å |
| 35 | A | 88.2 | Confident | 84.8 | Confident | 6 Ų | 6 | 47.7 Ų | 47.7 | 5% | 0.05 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -61 | -45.6 | 175 | 0 | 0 | 0 | 0 | 0 | 111.9 | K31 L32 Y33 M37 R38 E39 D40 T43 I44 L47 | K31-A35 WeakPolarHBondContact O-CB 3.26Å; K31-A35 PolarHBondContact O-N 2.77Å; L32-A35 PolarHBondContact O-N 2.87Å; Y33-A35 PolarHBondContact O-N 2.87Å; A35-M37 VanDerWaalsContact C-N 3.35Å; A35-M37 PolarHBondContact O-N 3.32Å; A35-R38 PolarHBondContact O-N 3.21Å; A35-E39 PolarHBondContact O-N 3.37Å; A35-D40 PolarHBondContact O-N 2.91Å; A35-D40 VanDerWaalsContact O-N 3.1Å; A35-T43 VanDerWaalsContact CB-OG1 3.3Å; A35-T43 WeakPolarHBondContact CB-OG1 3.37Å; A35-I44 HydrophobicContact CB-CG1 3.78Å; A35-L47 HydrophobicContact CB-CD1 4.47Å |
| 36 | I | 88.4 | Confident | 85.9 | Confident | 0 Ų | 0 | 48.2 Ų | 48.2 | 0% | 0 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -61.7 | -42.9 | 176 | -69 | 165.2 | 0 | 0 | 0 | 111.1 | L32 Y33 R38 E39 I44 P79 L82 A83 S91 L95 | L32-I36 HydrophobicContact CD1-CD1 4.14Å; L32-I36 HydrophobicContact CD1-CG1 4.37Å; L32-I36 HydrophobicContact CG-CD1 4.05Å; L32-I36 WeakPolarHBondContact O-CD1 3.44Å; L32-I36 VanDerWaalsContact O-CG1 3.27Å; L32-I36 WeakPolarHBondContact O-CG1 3.49Å; L32-I36 PolarHBondContact O-N 2.82Å; Y33-I36 PolarHBondContact O-N 2.87Å; I36-R38 VanDerWaalsContact C-N 3.33Å; I36-R38 PolarHBondContact O-N 3.39Å; I36-E39 PolarHBondContact O-N 3.21Å; I36-I44 HydrophobicContact CG1-CD1 4.05Å; I36-I44 HydrophobicContact CG1-CG1 4.23Å; I36-P79 HydrophobicContact CD1-CB 3.84Å; I36-L82 HydrophobicContact CB-CD2 4.12Å; I36-L82 HydrophobicContact CD1-CD2 4.04Å; I36-L82 HydrophobicContact CG2-CD2 3.83Å; I36-L82 HydrophobicContact CG2-CG 4.11Å; I36-A83 HydrophobicContact CG2-CB 4.03Å; I36-S91 PolarHBondContact O-OG 3.3Å; I36-L95 HydrophobicContact CD1-CD1 4.38Å |
| 37 | M | 87 | Confident | 86.7 | Confident | 33 Ų | 33 | 48.2 Ų | 48.2 | 16% | 0.163 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -69.6 | -30.7 | -179.3 | -69.8 | -59.7 | -77.9 | 0 | 0 | 113.1 | Y33 E34 A35 Y86 K88 | Y33-M37 HydrophobicContact CD1-CG 4.36Å; Y33-M37 HydrophobicContact CE1-CG 3.98Å; Y33-M37 HydrophobicContact CE2-CG 4.13Å; Y33-M37 VanDerWaalsContact O-CG 3.31Å; Y33-M37 WeakPolarHBondContact O-CG 3.3Å; Y33-M37 PolarHBondContact O-N 3.05Å; E34-M37 PolarHBondContact O-N 3.1Å; A35-M37 VanDerWaalsContact C-N 3.35Å; A35-M37 PolarHBondContact O-N 3.32Å; M37-Y86 HydrophobicContact CE-CD1 3.95Å; M37-Y86 HydrophobicContact CE-CD2 4.2Å; M37-Y86 HydrophobicContact CE-CE1 4.29Å; M37-Y86 HydrophobicContact CE-CG 3.9Å; M37-Y86 HydrophobicContact SD-CD2 3.8Å; M37-Y86 HydrophobicContact SD-CE2 4.4Å; M37-Y86 HydrophobicContact SD-CG 3.89Å; M37-K88 WeakPolarHBondContact O-CE 2.93Å; M37-K88 PolarHBondContact O-NZ 2.89Å |
| 38 | R | 88.7 | Confident | 87.2 | Confident | 175 Ų | 175 | 46.8 Ų | 46.8 | 66% | 0.66 | 24% | 0.237 | S | C | * | . | H | α-helix | trans | -85.8 | -6.4 | 176.1 | -74.5 | -172.1 | 175 | 144.8 | 12.5 | 114.8 | E34 A35 I36 D40 | E34-R38 WeakPolarHBondContact O-CB 3Å; E34-R38 WeakPolarHBondContact O-CG 3.34Å; E34-R38 PolarHBondContact O-N 2.83Å; E34-R38 IonicContact OE1-CZ 3.38Å; E34-R38 IonicContact OE1-NE 2.78Å; E34-R38 IonicContact OE1-NH1 3.75Å; E34-R38 PolarHBondContact OE1-NH1 2.93Å; E34-R38 IonicContact OE1-NH2 3.97Å; E34-R38 PolarHBondContact OE1-NH2 3.2Å; A35-R38 PolarHBondContact O-N 3.21Å; I36-R38 VanDerWaalsContact C-N 3.33Å; I36-R38 PolarHBondContact O-N 3.39Å; R38-D40 PolarHBondContact O-N 2.93Å |
| 39 | E | 86.8 | Confident | 87.3 | Confident | 61 Ų | 61 | 55 Ų | 55 | 29% | 0.285 | 27% | 0.265 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 61.7 | 26.8 | -174.5 | -63.6 | -166.6 | 126.7 | 0 | 0 | 114.2 | A35 I36 C41 K88 A89 Q90 S91 | A35-E39 PolarHBondContact O-N 3.37Å; I36-E39 PolarHBondContact O-N 3.21Å; E39-C41 PolarHBondContact O-N 3.25Å; E39-C41 VanDerWaalsContact O-N 3.13Å; E39-K88 HydrophobicContact CG-CB 4.14Å; E39-K88 HydrophobicContact CG-CD 3.89Å; E39-K88 WeakPolarHBondContact OE1-CA 3.25Å; E39-A89 PolarHBondContact OE1-N 3.26Å; E39-Q90 HydrophobicContact CB-CB 4.03Å; E39-Q90 HydrophobicContact CG-CB 4.29Å; E39-Q90 PolarHBondContact OE1-N 2.97Å; E39-Q90 VanDerWaalsContact OE1-N 3.08Å; E39-S91 WeakPolarHBondContact CA-OG 3.37Å |
| 40 | D | 91.3 | Very high | 87.1 | Confident | 55 Ų | 55 | 60.4 Ų | 60.4 | 29% | 0.294 | 30% | 0.295 | S | S | . | . | trans | -84.7 | 88.8 | 179.1 | -178 | 3.3 | 0 | 0 | 0 | 111.1 | A35 R38 T42 T43 I44 | A35-D40 PolarHBondContact O-N 2.91Å; A35-D40 VanDerWaalsContact O-N 3.1Å; R38-D40 PolarHBondContact O-N 2.93Å; D40-T42 PolarHBondContact O-N 2.9Å; D40-T42 PolarHBondContact OD1-N 3.26Å; D40-T42 PolarHBondContact OD1-OG1 3.47Å; D40-T43 WeakPolarHBondContact CB-OG1 3.14Å; D40-T43 PolarHBondContact O-N 2.97Å; D40-T43 PolarHBondContact O-OG1 2.62Å; D40-T43 VanDerWaalsContact O-OG1 3.12Å; D40-T43 PolarHBondContact OD1-N 3.48Å; D40-T43 WeakPolarHBondContact OD2-CB 3.49Å; D40-T43 WeakPolarHBondContact OD2-CG2 3.28Å; D40-T43 PolarHBondContact OD2-OG1 2.87Å; D40-I44 VanDerWaalsContact O-CG1 3.26Å; D40-I44 WeakPolarHBondContact O-CG1 3.26Å; D40-I44 PolarHBondContact O-N 2.97Å; D40-I44 VanDerWaalsContact O-N 3.1Å | ||
| 41 | C | 90.1 | Very high | 87.2 | Confident | 32 Ų | 32 | 59.5 Ų | 59.5 | 22% | 0.216 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -60.6 | -33.5 | -178.9 | -61.3 | 0 | 0 | 0 | 0 | 112.1 | E39 T43 I44 E45 C94 | E39-C41 PolarHBondContact O-N 3.25Å; E39-C41 VanDerWaalsContact O-N 3.13Å; C41-T43 PolarHBondContact O-N 3.34Å; C41-I44 PolarHBondContact O-N 3.37Å; C41-E45 WeakPolarHBondContact O-CB 3.17Å; C41-E45 WeakPolarHBondContact O-CG 3.41Å; C41-E45 PolarHBondContact O-N 2.94Å; C41-C94 HydrophobicContact CB-CB 4.2Å |
| 42 | T | 90.4 | Very high | 87.2 | Confident | 92 Ų | 92 | 56.6 Ų | 56.6 | 56% | 0.564 | 28% | 0.282 | S | S | * | . | H | α-helix | trans | -66.1 | -41.1 | -177.2 | 67.6 | 0 | 0 | 0 | 0 | 111.9 | D40 V46 | D40-T42 PolarHBondContact O-N 2.9Å; D40-T42 PolarHBondContact OD1-N 3.26Å; D40-T42 PolarHBondContact OD1-OG1 3.47Å; T42-V46 WeakPolarHBondContact O-CG2 3.41Å; T42-V46 PolarHBondContact O-N 3.21Å |
| 43 | T | 89.3 | Confident | 87.2 | Confident | 51 Ų | 51 | 57.5 Ų | 57.5 | 31% | 0.313 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -75.9 | -34.8 | 176.5 | 52.1 | 0 | 0 | 0 | 0 | 111.8 | A35 D40 C41 V46 L47 | A35-T43 VanDerWaalsContact CB-OG1 3.3Å; A35-T43 WeakPolarHBondContact CB-OG1 3.37Å; D40-T43 WeakPolarHBondContact CB-OG1 3.14Å; D40-T43 PolarHBondContact O-N 2.97Å; D40-T43 PolarHBondContact O-OG1 2.62Å; D40-T43 VanDerWaalsContact O-OG1 3.12Å; D40-T43 PolarHBondContact OD1-N 3.48Å; D40-T43 WeakPolarHBondContact OD2-CB 3.49Å; D40-T43 WeakPolarHBondContact OD2-CG2 3.28Å; D40-T43 PolarHBondContact OD2-OG1 2.87Å; C41-T43 PolarHBondContact O-N 3.34Å; T43-V46 PolarHBondContact O-N 3.49Å; T43-L47 WeakPolarHBondContact O-CB 2.84Å; T43-L47 WeakPolarHBondContact O-CG 3.23Å; T43-L47 PolarHBondContact O-N 3.31Å |
| 44 | I | 88 | Confident | 87.2 | Confident | 0 Ų | 0 | 60 Ų | 60 | 0% | 0 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -56.9 | -50.8 | 171.2 | -66.1 | 167.2 | 0 | 0 | 0 | 109.9 | L32 A35 I36 D40 C41 V46 L47 L48 L95 | L32-I44 HydrophobicContact CD1-CG2 4.45Å; A35-I44 HydrophobicContact CB-CG1 3.78Å; I36-I44 HydrophobicContact CG1-CD1 4.05Å; I36-I44 HydrophobicContact CG1-CG1 4.23Å; D40-I44 VanDerWaalsContact O-CG1 3.26Å; D40-I44 WeakPolarHBondContact O-CG1 3.26Å; D40-I44 PolarHBondContact O-N 2.97Å; D40-I44 VanDerWaalsContact O-N 3.1Å; C41-I44 PolarHBondContact O-N 3.37Å; I44-V46 VanDerWaalsContact C-N 3.34Å; I44-V46 PolarHBondContact O-N 2.91Å; I44-L47 PolarHBondContact O-N 3.41Å; I44-L47 VanDerWaalsContact O-N 3.15Å; I44-L48 HydrophobicContact CG2-CD1 3.65Å; I44-L48 HydrophobicContact CG2-CG 4Å; I44-L48 VanDerWaalsContact O-CG 3.27Å; I44-L48 WeakPolarHBondContact O-CG 3.28Å; I44-L48 PolarHBondContact O-N 2.81Å; I44-L95 HydrophobicContact CG2-CD2 4.22Å |
| 45 | E | 87.6 | Confident | 87.2 | Confident | 81 Ų | 81 | 62.5 Ų | 62.5 | 38% | 0.379 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -56.1 | -44.7 | 179.9 | -75.8 | 178.5 | -164.4 | 0 | 0 | 112.9 | C41 H98 | C41-E45 WeakPolarHBondContact O-CB 3.17Å; C41-E45 WeakPolarHBondContact O-CG 3.41Å; C41-E45 PolarHBondContact O-N 2.94Å; E45-H98 WeakPolarHBondContact CG-NE2 3.33Å |
| 46 | V | 89.1 | Confident | 87 | Confident | 85 Ų | 85 | 64.7 Ų | 64.7 | 52% | 0.515 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -65.8 | -41.8 | 178.4 | 172.2 | 0 | 0 | 0 | 0 | 111.1 | T42 T43 I44 R49 | T42-V46 WeakPolarHBondContact O-CG2 3.41Å; T42-V46 PolarHBondContact O-N 3.21Å; T43-V46 PolarHBondContact O-N 3.49Å; I44-V46 VanDerWaalsContact C-N 3.34Å; I44-V46 PolarHBondContact O-N 2.91Å; V46-R49 PolarHBondContact O-N 3.25Å |
| 47 | L | 87.1 | Confident | 86.9 | Confident | 26 Ų | 26 | 64.7 Ų | 64.7 | 14% | 0.136 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -72.7 | -34.7 | -177.5 | -67.9 | 171.8 | 0 | 0 | 0 | 112.6 | L28 K31 L32 A35 T43 I44 R49 N50 H51 | L28-L47 HydrophobicContact CG-CD2 4.42Å; K31-L47 HydrophobicContact CB-CD1 3.99Å; L32-L47 HydrophobicContact CB-CD1 4.13Å; L32-L47 HydrophobicContact CD1-CB 4.17Å; L32-L47 HydrophobicContact CD1-CD1 4.33Å; A35-L47 HydrophobicContact CB-CD1 4.47Å; T43-L47 WeakPolarHBondContact O-CB 2.84Å; T43-L47 WeakPolarHBondContact O-CG 3.23Å; T43-L47 PolarHBondContact O-N 3.31Å; I44-L47 PolarHBondContact O-N 3.41Å; I44-L47 VanDerWaalsContact O-N 3.15Å; L47-R49 PolarHBondContact O-N 3.05Å; L47-N50 PolarHBondContact O-N 3.5Å; L47-N50 VanDerWaalsContact O-N 3.1Å; L47-H51 PolarHBondContact O-N 2.88Å |
| 48 | L | 86.7 | Confident | 86.7 | Confident | 17 Ų | 17 | 66.1 Ų | 66.1 | 9% | 0.089 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -68.2 | -17.8 | 177.1 | -68.8 | 179.5 | 0 | 0 | 0 | 113.6 | L32 I44 N50 V53 L95 H98 | L32-L48 HydrophobicContact CD1-CD2 4.45Å; L32-L48 HydrophobicContact CD2-CD2 4.33Å; I44-L48 HydrophobicContact CG2-CD1 3.65Å; I44-L48 HydrophobicContact CG2-CG 4Å; I44-L48 VanDerWaalsContact O-CG 3.27Å; I44-L48 WeakPolarHBondContact O-CG 3.28Å; I44-L48 PolarHBondContact O-N 2.81Å; L48-N50 PolarHBondContact O-N 3.35Å; L48-V53 HydrophobicContact CD1-CG1 4.27Å; L48-V53 HydrophobicContact CD1-CG2 4.18Å; L48-V53 HydrophobicContact CD2-CB 4.34Å; L48-V53 HydrophobicContact CD2-CG1 4.17Å; L48-V53 HydrophobicContact CD2-CG2 4.05Å; L48-V53 HydrophobicContact CG-CG2 4.46Å; L48-L95 HydrophobicContact CD1-CD2 3.93Å; L48-L95 HydrophobicContact CD2-CD2 4.23Å; L48-H98 HydrophobicContact CD1-CB 3.79Å |
| 49 | R | 83.9 | Confident | 85.9 | Confident | 204 Ų | 204 | 58.2 Ų | 58.2 | 77% | 0.77 | 31% | 0.308 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.9 | -27.3 | 170.5 | -67 | -179.3 | -175.5 | -175.2 | 1.1 | 112.6 | V46 L47 | V46-R49 PolarHBondContact O-N 3.25Å; L47-R49 PolarHBondContact O-N 3.05Å |
| 50 | N | 82 | Confident | 84.8 | Confident | 128 Ų | 128 | 58.9 Ų | 58.9 | 68% | 0.684 | 31% | 0.313 | S | S | * | . | S | Bend | trans | -109.3 | -0.5 | -175.1 | -61.8 | -30.1 | 0 | 0 | 0 | 112.8 | L28 L47 L48 | L28-N50 HydrophobicContact CD1-CB 4.16Å; L47-N50 PolarHBondContact O-N 3.5Å; L47-N50 VanDerWaalsContact O-N 3.1Å; L48-N50 PolarHBondContact O-N 3.35Å |
| 51 | H | 82.8 | Confident | 83.1 | Confident | 13 Ų | 13 | 58.5 Ų | 58.5 | 6% | 0.06 | 31% | 0.314 | C | S | . | . | S | Bend | trans | -145.1 | 127.8 | -177.9 | 179.2 | -80.9 | 0 | 0 | 0 | 111.4 | L28 H29 L47 V53 Q55 | L28-H51 HydrophobicContact CD2-CB 3.76Å; H29-H51 AromaticContact NE2-CD2 3.73Å; H29-H51 AromaticContact NE2-NE2 3.6Å; L47-H51 PolarHBondContact O-N 2.88Å; H51-V53 PolarHBondContact O-N 3.5Å; H51-Q55 PolarHBondContact CE1-O 3.08Å |
| 52 | P | 86.1 | Confident | 81.1 | Confident | 75 Ų | 75 | 64.4 Ų | 64.4 | 49% | 0.487 | 34% | 0.343 | S | S | . | . | trans | -65.6 | 132.3 | -179.4 | 26.5 | -32.7 | 0 | 0 | 0 | 111.8 | N54 Q55 | P52-N54 VanDerWaalsContact C-N 3.27Å; P52-N54 PolarHBondContact O-N 2.96Å; P52-N54 VanDerWaalsContact O-N 3.17Å; P52-Q55 HydrophobicContact CB-CB 4.43Å; P52-Q55 HydrophobicContact CG-CB 3.68Å; P52-Q55 HydrophobicContact CG-CG 4.44Å; P52-Q55 PolarHBondContact O-N 2.9Å; P52-Q55 VanDerWaalsContact O-N 3.11Å | ||
| 53 | V | 84.9 | Confident | 79.2 | Confident | 19 Ų | 19 | 61.2 Ų | 61.2 | 12% | 0.115 | 33% | 0.325 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -61.9 | -31.3 | -166.7 | -165.9 | 0 | 0 | 0 | 0 | 113.9 | L48 H51 L95 H98 A100 | L48-V53 HydrophobicContact CD1-CG1 4.27Å; L48-V53 HydrophobicContact CD1-CG2 4.18Å; L48-V53 HydrophobicContact CD2-CB 4.34Å; L48-V53 HydrophobicContact CD2-CG1 4.17Å; L48-V53 HydrophobicContact CD2-CG2 4.05Å; L48-V53 HydrophobicContact CG-CG2 4.46Å; H51-V53 PolarHBondContact O-N 3.5Å; V53-L95 HydrophobicContact CG1-CD2 3.84Å; V53-H98 HydrophobicContact CG2-CB 4.43Å; V53-H98 WeakPolarHBondContact CG2-O 3.42Å; V53-A100 HydrophobicContact CG1-CB 3.61Å |
| 54 | N | 86 | Confident | 77.2 | Confident | 57 Ų | 57 | 64.2 Ų | 64.2 | 31% | 0.305 | 34% | 0.343 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -94.2 | -1.4 | -177.5 | -64.2 | -32.8 | 0 | 0 | 0 | 113.8 | P52 A100 D101 V104 | P52-N54 VanDerWaalsContact C-N 3.27Å; P52-N54 PolarHBondContact O-N 2.96Å; P52-N54 VanDerWaalsContact O-N 3.17Å; N54-A100 WeakPolarHBondContact OD1-CA 3.11Å; N54-D101 PolarHBondContact OD1-N 3.14Å; N54-V104 HydrophobicContact CB-CG2 4.49Å |
| 55 | Q | 86.3 | Confident | 75.3 | Confident | 102 Ų | 102 | 65.7 Ų | 65.7 | 48% | 0.477 | 35% | 0.353 | S | S | . | . | S | Bend | trans | -79.4 | 138.7 | 176.8 | -172.3 | 173 | 4.2 | 0 | 0 | 110 | H51 P52 P79 | H51-Q55 PolarHBondContact CE1-O 3.08Å; P52-Q55 HydrophobicContact CB-CB 4.43Å; P52-Q55 HydrophobicContact CG-CB 3.68Å; P52-Q55 HydrophobicContact CG-CG 4.44Å; P52-Q55 PolarHBondContact O-N 2.9Å; P52-Q55 VanDerWaalsContact O-N 3.11Å; Q55-P79 WeakPolarHBondContact O-CD 3.34Å |
| 56 | P | 84.8 | Confident | 73.3 | Confident | 53 Ų | 53 | 62.5 Ų | 62.5 | 34% | 0.344 | 34% | 0.34 | S | S | . | . | P | Polyproline II helix | trans | -69.4 | 141 | 179.2 | 28.5 | -35.9 | 0 | 0 | 0 | 111.7 | S76 I77 I78 | P56-S76 WeakPolarHBondContact CB-OG 3.19Å; P56-I77 WeakPolarHBondContact CA-O 3.5Å; P56-I78 HydrophobicContact CB-CG1 4.13Å |
| 57 | I | 85.8 | Confident | 71.1 | Confident | 0 Ų | 0 | 68.9 Ų | 68.9 | 0% | 0 | 35% | 0.354 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -92.1 | 136.4 | 170.6 | 56 | 168.6 | 0 | 0 | 0 | 109.9 | H29 L32 S76 I77 P79 L82 | H29-I57 HydrophobicContact CB-CB 4.14Å; H29-I57 HydrophobicContact CB-CG2 4.42Å; L32-I57 HydrophobicContact CD2-CG2 3.92Å; I57-S76 WeakPolarHBondContact O-CA 3.48Å; I57-I77 HydrophobicContact CG1-CG2 4.03Å; I57-I77 WeakPolarHBondContact CG1-O 3.35Å; I57-I77 PolarHBondContact N-O 3.35Å; I57-I77 PolarHBondContact O-N 2.59Å; I57-P79 HydrophobicContact CG2-CG 4.21Å; I57-L82 HydrophobicContact CD1-CD2 4.05Å |
| 58 | T | 82.7 | Confident | 69.1 | Low | 62 Ų | 62 | 73.9 Ų | 73.9 | 38% | 0.38 | 38% | 0.381 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -90.5 | 117.7 | 174.9 | -47 | 0 | 0 | 0 | 0 | 109.5 | H29 | H29-T58 PolarHBondContact ND1-N 3.45Å |
| 59 | I | 72.8 | Confident | 67.1 | Low | 9 Ų | 9 | 74.3 Ų | 74.3 | 5% | 0.046 | 38% | 0.383 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -96.1 | 115.7 | 177.6 | -54.3 | 161.7 | 0 | 0 | 0 | 108.8 | Y33 L69 E75 I77 | Y33-I59 HydrophobicContact CD2-CD1 3.42Å; Y33-I59 VanDerWaalsContact CD2-CD1 3.42Å; Y33-I59 HydrophobicContact CD2-CG1 3.85Å; Y33-I59 HydrophobicContact CE2-CD1 3.55Å; Y33-I59 HydrophobicContact CE2-CG1 4.34Å; Y33-I59 HydrophobicContact CG-CD1 4.42Å; Y33-I59 HydrophobicContact CG-CG1 4.43Å; I59-L69 HydrophobicContact CG2-CD1 3.6Å; I59-E75 PolarHBondContact N-O 3.35Å; I59-I77 HydrophobicContact CD1-CG2 3.7Å |
| 60 | L | 63.9 | Low | 65.1 | Low | 75 Ų | 75 | 73.6 Ų | 73.6 | 39% | 0.393 | 39% | 0.393 | S | S | . | . | trans | -84.7 | 138.9 | 176.1 | -74.7 | 160.7 | 0 | 0 | 0 | 110.6 | A26 N62 S63 T74 | A26-L60 HydrophobicContact CB-CD1 4.09Å; L60-N62 PolarHBondContact O-N 2.84Å; L60-N62 VanDerWaalsContact O-N 3.11Å; L60-S63 PolarHBondContact O-OG 3.11Å; L60-T74 HydrophobicContact CD2-CG2 4.01Å | ||
| 61 | P | 54.7 | Low | 63.2 | Low | 48 Ų | 48 | 69.2 Ų | 69.2 | 31% | 0.312 | 37% | 0.373 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -67.6 | -11.8 | -173.8 | 24.4 | -33 | 0 | 0 | 0 | 114.8 | S66 | P61-S66 WeakPolarHBondContact O-CB 3.32Å; P61-S66 PolarHBondContact O-OG 3.22Å |
| 62 | N | 48.9 | Very low | 61.6 | Low | 155 Ų | 155 | 77.7 Ų | 77.7 | 83% | 0.829 | 41% | 0.413 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -105 | 3.1 | -174.2 | -76.7 | -6.3 | 0 | 0 | 0 | 115.3 | L60 | L60-N62 PolarHBondContact O-N 2.84Å; L60-N62 VanDerWaalsContact O-N 3.11Å |
| 63 | S | 49.3 | Very low | 60 | Low | 26 Ų | 26 | 81.1 Ų | 81.1 | 18% | 0.182 | 42% | 0.422 | C | S | . | . | S | Bend | trans | -67.9 | 137.8 | 170.7 | 60.5 | 0 | 0 | 0 | 0 | 108.9 | S30 L60 S65 S66 | S30-S63 WeakPolarHBondContact OG-CB 3.15Å; L60-S63 PolarHBondContact O-OG 3.11Å; S63-S65 PolarHBondContact O-N 2.8Å; S63-S66 VanDerWaalsContact O-CB 3.3Å; S63-S66 WeakPolarHBondContact O-CB 3.47Å; S63-S66 PolarHBondContact O-N 3.27Å; S63-S66 PolarHBondContact O-OG 3.26Å |
| 64 | T | 48.2 | Very low | 58.8 | Low | 114 Ų | 114 | 84.5 Ų | 84.5 | 70% | 0.699 | 44% | 0.443 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -54 | -18 | -177.9 | 44.5 | 0 | 0 | 0 | 0 | 114.2 | ||
| 65 | S | 47.9 | Very low | 58 | Low | 31 Ų | 31 | 84.2 Ų | 84.2 | 22% | 0.217 | 44% | 0.44 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -88 | -6.7 | 177.4 | -53.5 | 0 | 0 | 0 | 0 | 114.6 | E34 S63 | E34-S65 PolarHBondContact OE2-OG 2.73Å; S63-S65 PolarHBondContact O-N 2.8Å |
| 66 | S | 46.5 | Very low | 57.9 | Low | 13 Ų | 13 | 82.5 Ų | 82.5 | 9% | 0.091 | 44% | 0.439 | C | S | . | . | G | 310 helix | trans | -83.7 | -2.7 | 179.6 | 71.7 | 0 | 0 | 0 | 0 | 114.3 | P61 S63 L68 L69 | P61-S66 WeakPolarHBondContact O-CB 3.32Å; P61-S66 PolarHBondContact O-OG 3.22Å; S63-S66 VanDerWaalsContact O-CB 3.3Å; S63-S66 WeakPolarHBondContact O-CB 3.47Å; S63-S66 PolarHBondContact O-N 3.27Å; S63-S66 PolarHBondContact O-OG 3.26Å; S66-L68 PolarHBondContact O-N 3.34Å; S66-L69 WeakPolarHBondContact O-CB 3.32Å; S66-L69 PolarHBondContact O-N 3.04Å |
| 67 | R | 42.7 | Very low | 58 | Low | 219 Ų | 219 | 81.1 Ų | 81.1 | 83% | 0.826 | 43% | 0.428 | S | S | * | . | G | 310 helix | trans | -59.1 | -11.5 | -178.5 | -94.9 | -172.8 | -95.8 | -140.9 | -4.3 | 115.1 | ||
| 68 | L | 45.1 | Very low | 58.2 | Low | 131 Ų | 131 | 81.8 Ų | 81.8 | 69% | 0.686 | 43% | 0.432 | S | S | * | . | G | 310 helix | trans | -91.1 | -9.9 | 174.1 | -70.1 | 165.5 | 0 | 0 | 0 | 113.7 | S66 L70 | S66-L68 PolarHBondContact O-N 3.34Å; L68-L70 PolarHBondContact O-N 3.19Å |
| 69 | L | 44.4 | Very low | 58.5 | Low | 27 Ų | 27 | 78.8 Ų | 78.8 | 14% | 0.141 | 41% | 0.414 | C | S | . | . | trans | -84.1 | 108.9 | 173.4 | -73.1 | 156.4 | 0 | 0 | 0 | 108.4 | I59 S66 S71 | I59-L69 HydrophobicContact CG2-CD1 3.6Å; S66-L69 WeakPolarHBondContact O-CB 3.32Å; S66-L69 PolarHBondContact O-N 3.04Å; L69-S71 PolarHBondContact O-N 3.2Å | ||
| 70 | L | 40.9 | Very low | 59.4 | Low | 188 Ų | 188 | 78.4 Ų | 78.4 | 98% | 0.984 | 41% | 0.411 | S | S | * | . | trans | -70.8 | -4.6 | 172.6 | -77.2 | 151.8 | 0 | 0 | 0 | 112.5 | L68 | L68-L70 PolarHBondContact O-N 3.19Š| ||
| 71 | S | 43.2 | Very low | 60.7 | Low | 37 Ų | 37 | 74.9 Ų | 74.9 | 26% | 0.259 | 39% | 0.393 | S | S | . | . | trans | -108.2 | 126.4 | -177.5 | 49.4 | 0 | 0 | 0 | 0 | 111.1 | L69 Q73 E75 | L69-S71 PolarHBondContact O-N 3.2Å; S71-Q73 PolarHBondContact O-N 3.46Å; S71-E75 PolarHBondContact OG-OE1 2.86Å | ||
| 72 | Q | 48.3 | Very low | 62.3 | Low | 191 Ų | 191 | 72.7 Ų | 72.7 | 89% | 0.893 | 38% | 0.379 | S | S | * | . | trans | -76.1 | 25.4 | 173.5 | -68.7 | -177.7 | -19.5 | 0 | 0 | 113.1 | ||||
| 73 | Q | 53.4 | Low | 64.3 | Low | 146 Ų | 146 | 65.3 Ų | 65.3 | 68% | 0.682 | 34% | 0.339 | S | S | * | . | S | Bend | trans | -114.2 | 145.6 | -172.9 | -70.3 | -179.2 | -9.8 | 0 | 0 | 111.3 | S71 E75 | S71-Q73 PolarHBondContact O-N 3.46Å; Q73-E75 PolarHBondContact O-N 3.19Å; Q73-E75 VanDerWaalsContact O-N 3.12Å |
| 74 | T | 59.3 | Low | 66.3 | Low | 90 Ų | 90 | 64 Ų | 64 | 55% | 0.552 | 33% | 0.33 | S | S | * | . | trans | -68.7 | 103.9 | 171.6 | 44.7 | 0 | 0 | 0 | 0 | 109.5 | L60 | L60-T74 HydrophobicContact CD2-CG2 4.01Š| ||
| 75 | E | 69.8 | Low | 68.2 | Low | 52 Ų | 52 | 61 Ų | 61 | 24% | 0.243 | 31% | 0.307 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -85.4 | 124.2 | 174.3 | -72.7 | -173.6 | -163 | 0 | 0 | 109.5 | I59 S71 Q73 K85 | I59-E75 PolarHBondContact N-O 3.35Å; S71-E75 PolarHBondContact OG-OE1 2.86Å; Q73-E75 PolarHBondContact O-N 3.19Å; Q73-E75 VanDerWaalsContact O-N 3.12Å; E75-K85 IonicContact OE2-NZ 2.98Å; E75-K85 PolarHBondContact OE2-NZ 3.47Å; E75-K85 VanDerWaalsContact OE2-NZ 3.14Å |
| 76 | S | 83.1 | Confident | 70 | Confident | 66 Ų | 66 | 62.8 Ų | 62.8 | 46% | 0.462 | 31% | 0.31 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.8 | 113.3 | 169.7 | -178.5 | 0 | 0 | 0 | 0 | 107.7 | P56 I57 | P56-S76 WeakPolarHBondContact CB-OG 3.19Å; I57-S76 WeakPolarHBondContact O-CA 3.48Å |
| 77 | I | 86.3 | Confident | 72.1 | Confident | 23 Ų | 23 | 63 Ų | 63 | 12% | 0.118 | 31% | 0.31 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -137.3 | 138.9 | -173.1 | -168 | 165.8 | 0 | 0 | 0 | 111.1 | P56 I57 I59 H81 L82 K85 | P56-I77 WeakPolarHBondContact CA-O 3.5Å; I57-I77 HydrophobicContact CG1-CG2 4.03Å; I57-I77 WeakPolarHBondContact CG1-O 3.35Å; I57-I77 PolarHBondContact N-O 3.35Å; I57-I77 PolarHBondContact O-N 2.59Å; I59-I77 HydrophobicContact CD1-CG2 3.7Å; I77-H81 HydrophobicContact CD1-CB 4.41Å; I77-H81 HydrophobicContact CG1-CB 3.99Å; I77-L82 HydrophobicContact CD1-CB 4.07Å; I77-L82 HydrophobicContact CD1-CD1 4.14Å; I77-L82 HydrophobicContact CG1-CB 4.26Å; I77-L82 HydrophobicContact CG2-CB 4.19Å; I77-L82 HydrophobicContact CG2-CD1 4.2Å; I77-K85 HydrophobicContact CD1-CD 4.04Å |
| 78 | I | 90 | Very high | 74.4 | Confident | 14 Ų | 14 | 55.1 Ų | 55.1 | 7% | 0.072 | 28% | 0.281 | C | S | . | . | trans | -73.9 | 136.7 | 177 | -59.9 | 165.8 | 0 | 0 | 0 | 108.8 | P56 I80 H81 L82 V104 | P56-I78 HydrophobicContact CB-CG1 4.13Å; I78-I80 HydrophobicContact CG2-CG2 3.91Å; I78-I80 PolarHBondContact O-N 3.32Å; I78-I80 VanDerWaalsContact O-N 3.12Å; I78-H81 HydrophobicContact CB-CB 4.37Å; I78-H81 WeakPolarHBondContact O-CA 3.42Å; I78-H81 WeakPolarHBondContact O-CB 3.13Å; I78-H81 PolarHBondContact O-N 3.39Å; I78-L82 PolarHBondContact O-N 2.79Å; I78-V104 HydrophobicContact CD1-CB 4.47Å; I78-V104 HydrophobicContact CD1-CG1 4.03Å; I78-V104 HydrophobicContact CD1-CG2 3.64Å; I78-V104 HydrophobicContact CG2-CG1 4.04Å | ||
| 79 | P | 90.1 | Very high | 76.7 | Confident | 0 Ų | 0 | 49 Ų | 49 | 0% | 0 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -47.8 | -42.1 | -178.4 | -34.5 | 38 | 0 | 0 | 0 | 114.8 | L32 I36 Q55 I57 L82 A83 L95 | L32-P79 HydrophobicContact CD2-CG 4.28Å; I36-P79 HydrophobicContact CD1-CB 3.84Å; Q55-P79 WeakPolarHBondContact O-CD 3.34Å; I57-P79 HydrophobicContact CG2-CG 4.21Å; P79-L82 WeakPolarHBondContact O-CB 3.21Å; P79-L82 PolarHBondContact O-N 2.9Å; P79-A83 PolarHBondContact O-N 3.08Å; P79-L95 HydrophobicContact CB-CD1 4.06Å; P79-L95 HydrophobicContact CB-CD2 3.75Å; P79-L95 WeakPolarHBondContact O-CD1 3.45Å |
| 80 | I | 91.3 | Very high | 79 | Confident | 0 Ų | 0 | 52.5 Ų | 52.5 | 0% | 0 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -67.3 | -38.4 | 178.5 | -158.7 | -173.3 | 0 | 0 | 0 | 112.3 | I78 A83 A84 L92 L96 A100 V104 T112 L152 | I78-I80 HydrophobicContact CG2-CG2 3.91Å; I78-I80 PolarHBondContact O-N 3.32Å; I78-I80 VanDerWaalsContact O-N 3.12Å; I80-A83 PolarHBondContact O-N 3.46Å; I80-A84 VanDerWaalsContact O-CB 3.31Å; I80-A84 WeakPolarHBondContact O-CB 3.37Å; I80-A84 PolarHBondContact O-N 3.39Å; I80-L92 HydrophobicContact CD1-CD1 4.32Å; I80-L92 HydrophobicContact CG1-CD1 3.55Å; I80-L96 HydrophobicContact CD1-CD2 3.67Å; I80-L96 HydrophobicContact CD1-CG 4.16Å; I80-A100 HydrophobicContact CB-CB 4.21Å; I80-A100 HydrophobicContact CD1-CB 3.89Å; I80-A100 HydrophobicContact CG1-CB 4.24Å; I80-V104 HydrophobicContact CG2-CG1 3.69Å; I80-T112 HydrophobicContact CD1-CG2 4.11Å; I80-T112 HydrophobicContact CG1-CG2 3.97Å; I80-T112 HydrophobicContact CG2-CG2 4.42Å; I80-L152 HydrophobicContact CD1-CD2 4.41Å |
| 81 | H | 90.4 | Very high | 81.4 | Confident | 2 Ų | 2 | 43.6 Ų | 43.6 | 1% | 0.009 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -67.2 | -36.7 | 174.6 | -65.2 | 161.5 | 0 | 0 | 0 | 111.8 | I77 I78 A84 K85 V104 D106 T112 L115 | I77-H81 HydrophobicContact CD1-CB 4.41Å; I77-H81 HydrophobicContact CG1-CB 3.99Å; I78-H81 HydrophobicContact CB-CB 4.37Å; I78-H81 WeakPolarHBondContact O-CA 3.42Å; I78-H81 WeakPolarHBondContact O-CB 3.13Å; I78-H81 PolarHBondContact O-N 3.39Å; H81-A84 PolarHBondContact O-N 3.34Å; H81-K85 VanDerWaalsContact O-CB 3.25Å; H81-K85 WeakPolarHBondContact O-CB 3.38Å; H81-K85 PolarHBondContact O-N 3.33Å; H81-V104 PolarHBondContact CE1-O 3.19Å; H81-V104 VanDerWaalsContact CE1-O 3.28Å; H81-V104 PolarHBondContact NE2-O 3.25Å; H81-D106 PolarHBondContact CE1-N 3.07Å; H81-T112 PolarHBondContact CD2-OG1 2.79Å; H81-T112 VanDerWaalsContact CD2-OG1 3.24Å; H81-T112 PolarHBondContact NE2-OG1 3.35Å; H81-L115 HydrophobicContact CB-CD1 3.61Å; H81-L115 VanDerWaalsContact CG-CD1 3.45Å |
| 82 | L | 89.7 | Confident | 83.8 | Confident | 1 Ų | 1 | 41.8 Ų | 41.8 | 1% | 0.005 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -62.9 | -50 | 174.6 | -179.9 | 71.5 | 0 | 0 | 0 | 111 | Y33 I36 I57 I77 I78 P79 A84 K85 Y86 | Y33-L82 HydrophobicContact CD2-CD1 4.08Å; Y33-L82 HydrophobicContact CD2-CD2 3.47Å; Y33-L82 VanDerWaalsContact CD2-CD2 3.47Å; Y33-L82 HydrophobicContact CD2-CG 4.44Å; Y33-L82 HydrophobicContact CE2-CD1 3.78Å; Y33-L82 HydrophobicContact CE2-CD2 3.98Å; Y33-L82 HydrophobicContact CG-CD2 4.37Å; I36-L82 HydrophobicContact CB-CD2 4.12Å; I36-L82 HydrophobicContact CD1-CD2 4.04Å; I36-L82 HydrophobicContact CG2-CD2 3.83Å; I36-L82 HydrophobicContact CG2-CG 4.11Å; I57-L82 HydrophobicContact CD1-CD2 4.05Å; I77-L82 HydrophobicContact CD1-CB 4.07Å; I77-L82 HydrophobicContact CD1-CD1 4.14Å; I77-L82 HydrophobicContact CG1-CB 4.26Å; I77-L82 HydrophobicContact CG2-CB 4.19Å; I77-L82 HydrophobicContact CG2-CD1 4.2Å; I78-L82 PolarHBondContact O-N 2.79Å; P79-L82 WeakPolarHBondContact O-CB 3.21Å; P79-L82 PolarHBondContact O-N 2.9Å; L82-A84 VanDerWaalsContact C-N 3.26Å; L82-A84 PolarHBondContact O-N 3.4Å; L82-K85 PolarHBondContact O-N 3.4Å; L82-Y86 HydrophobicContact CD1-CD2 3.59Å; L82-Y86 HydrophobicContact CD1-CE2 3.45Å; L82-Y86 VanDerWaalsContact CD1-CE2 3.45Å; L82-Y86 HydrophobicContact CG-CD2 4.29Å; L82-Y86 WeakPolarHBondContact O-CD2 3.31Å; L82-Y86 PolarHBondContact O-N 2.74Å |
| 83 | A | 90.9 | Very high | 86 | Confident | 0 Ų | 0 | 34.3 Ų | 34.3 | 0% | 0 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -59.9 | -39.5 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | I36 P79 I80 H87 K88 L92 L95 | I36-A83 HydrophobicContact CG2-CB 4.03Å; P79-A83 PolarHBondContact O-N 3.08Å; I80-A83 PolarHBondContact O-N 3.46Å; A83-H87 PolarHBondContact O-N 3.35Å; A83-H87 VanDerWaalsContact O-N 3.1Å; A83-K88 HydrophobicContact CB-CB 4.34Å; A83-K88 PolarHBondContact O-N 3.29Å; A83-L92 HydrophobicContact CB-CB 4.02Å; A83-L92 HydrophobicContact CB-CD1 4.13Å; A83-L95 HydrophobicContact CB-CD1 3.95Å |
| 84 | A | 90.2 | Very high | 87.9 | Confident | 0 Ų | 0 | 27.7 Ų | 27.7 | 0% | 0 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -65.8 | -48 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | I80 H81 L82 Y86 H87 T112 I116 | I80-A84 VanDerWaalsContact O-CB 3.31Å; I80-A84 WeakPolarHBondContact O-CB 3.37Å; I80-A84 PolarHBondContact O-N 3.39Å; H81-A84 PolarHBondContact O-N 3.34Å; L82-A84 VanDerWaalsContact C-N 3.26Å; L82-A84 PolarHBondContact O-N 3.4Å; A84-Y86 PolarHBondContact O-N 2.9Å; A84-H87 PolarHBondContact O-N 2.98Å; A84-T112 HydrophobicContact CB-CG2 3.54Å; A84-I116 HydrophobicContact CB-CD1 4.04Å; A84-I116 HydrophobicContact CB-CG1 3.54Å |
| 85 | K | 88.1 | Confident | 89.4 | Confident | 49 Ų | 49 | 23.4 Ų | 23.4 | 21% | 0.213 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -58.1 | -36.5 | -179.6 | 179.7 | 176.8 | 179.3 | -176.4 | 0 | 112.2 | E75 I77 H81 L82 | E75-K85 IonicContact OE2-NZ 2.98Å; E75-K85 PolarHBondContact OE2-NZ 3.47Å; E75-K85 VanDerWaalsContact OE2-NZ 3.14Å; I77-K85 HydrophobicContact CD1-CD 4.04Å; H81-K85 VanDerWaalsContact O-CB 3.25Å; H81-K85 WeakPolarHBondContact O-CB 3.38Å; H81-K85 PolarHBondContact O-N 3.33Å; L82-K85 PolarHBondContact O-N 3.4Å |
| 86 | Y | 87.4 | Confident | 90.5 | Very high | 70 Ų | 70 | 21.6 Ų | 21.6 | 28% | 0.275 | 11% | 0.108 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -104 | 10.9 | -178.3 | -66.6 | -75.9 | 0 | 0 | 0 | 114.4 | M37 L82 A84 K88 | M37-Y86 HydrophobicContact CE-CD1 3.95Å; M37-Y86 HydrophobicContact CE-CD2 4.2Å; M37-Y86 HydrophobicContact CE-CE1 4.29Å; M37-Y86 HydrophobicContact CE-CG 3.9Å; M37-Y86 HydrophobicContact SD-CD2 3.8Å; M37-Y86 HydrophobicContact SD-CE2 4.4Å; M37-Y86 HydrophobicContact SD-CG 3.89Å; L82-Y86 HydrophobicContact CD1-CD2 3.59Å; L82-Y86 HydrophobicContact CD1-CE2 3.45Å; L82-Y86 VanDerWaalsContact CD1-CE2 3.45Å; L82-Y86 HydrophobicContact CG-CD2 4.29Å; L82-Y86 WeakPolarHBondContact O-CD2 3.31Å; L82-Y86 PolarHBondContact O-N 2.74Å; A84-Y86 PolarHBondContact O-N 2.9Å; Y86-K88 VanDerWaalsContact C-N 3.32Å; Y86-K88 PolarHBondContact O-N 3.1Å |
| 87 | H | 90 | Very high | 90.9 | Very high | 18 Ų | 18 | 27.4 Ų | 27.4 | 8% | 0.083 | 12% | 0.119 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 54.5 | 42.9 | 177 | -49.3 | -63.8 | 0 | 0 | 0 | 113.7 | A83 A84 A89 H119 N144 A145 C148 | A83-H87 PolarHBondContact O-N 3.35Å; A83-H87 VanDerWaalsContact O-N 3.1Å; A84-H87 PolarHBondContact O-N 2.98Å; H87-A89 PolarHBondContact O-N 3.38Å; H87-H119 PolarHBondContact CE1-O 2.8Å; H87-H119 VanDerWaalsContact CE1-O 3.28Å; H87-H119 PolarHBondContact NE2-O 3.16Å; H87-N144 HydrophobicContact CB-CB 4.33Å; H87-N144 WeakPolarHBondContact O-CB 3.07Å; H87-A145 HydrophobicContact CB-CB 4.4Å; H87-A145 WeakPolarHBondContact ND1-CB 3.42Å; H87-C148 VanDerWaalsContact C-SG 3.59Å |
| 88 | K | 91.6 | Very high | 91.1 | Very high | 52 Ų | 52 | 30.3 Ų | 30.3 | 23% | 0.226 | 13% | 0.132 | C | C | . | . | trans | -90.2 | 83.6 | 179.4 | -59.1 | -65.7 | 173.7 | 168.7 | 0 | 110.3 | M37 E39 A83 Y86 Q90 S91 L92 | M37-K88 WeakPolarHBondContact O-CE 2.93Å; M37-K88 PolarHBondContact O-NZ 2.89Å; E39-K88 HydrophobicContact CG-CB 4.14Å; E39-K88 HydrophobicContact CG-CD 3.89Å; E39-K88 WeakPolarHBondContact OE1-CA 3.25Å; A83-K88 HydrophobicContact CB-CB 4.34Å; A83-K88 PolarHBondContact O-N 3.29Å; Y86-K88 VanDerWaalsContact C-N 3.32Å; Y86-K88 PolarHBondContact O-N 3.1Å; K88-Q90 PolarHBondContact O-N 2.95Å; K88-S91 PolarHBondContact O-N 3.38Å; K88-L92 VanDerWaalsContact O-CB 3.24Å; K88-L92 WeakPolarHBondContact O-CB 3.4Å; K88-L92 PolarHBondContact O-N 2.96Å | ||
| 89 | A | 92.3 | Very high | 91 | Very high | 3 Ų | 3 | 32.1 Ų | 32.1 | 3% | 0.025 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -60.8 | -41 | -171.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | E39 H87 L92 L93 T147 C148 I151 | E39-A89 PolarHBondContact OE1-N 3.26Å; H87-A89 PolarHBondContact O-N 3.38Å; A89-L92 PolarHBondContact O-N 3.17Å; A89-L93 WeakPolarHBondContact O-CB 3.22Å; A89-L93 PolarHBondContact O-N 3.37Å; A89-T147 HydrophobicContact CB-CG2 3.87Å; A89-C148 WeakPolarHBondContact CA-SG 3.49Å; A89-C148 PolarHBondContact N-SG 3.18Å; A89-I151 HydrophobicContact CB-CD1 4.17Å |
| 90 | Q | 92.6 | Very high | 91.1 | Very high | 101 Ų | 101 | 32.4 Ų | 32.4 | 47% | 0.472 | 16% | 0.157 | S | C | . | . | H | α-helix | trans | -71.3 | -45.5 | -179 | -63 | -58.2 | -32.3 | 0 | 0 | 111.4 | E39 K88 L92 L93 C94 | E39-Q90 HydrophobicContact CB-CB 4.03Å; E39-Q90 HydrophobicContact CG-CB 4.29Å; E39-Q90 PolarHBondContact OE1-N 2.97Å; E39-Q90 VanDerWaalsContact OE1-N 3.08Å; K88-Q90 PolarHBondContact O-N 2.95Å; Q90-L92 VanDerWaalsContact C-N 3.29Å; Q90-L92 PolarHBondContact O-N 3.23Å; Q90-L93 PolarHBondContact O-N 2.96Å; Q90-C94 WeakPolarHBondContact O-CB 3.31Å; Q90-C94 PolarHBondContact O-N 3.1Å |
| 91 | S | 92.6 | Very high | 91 | Very high | 0 Ų | 0 | 35.8 Ų | 35.8 | 0% | 0 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -59 | -42 | 174.5 | -57.2 | 0 | 0 | 0 | 0 | 111.6 | I36 E39 K88 C94 L95 | I36-S91 PolarHBondContact O-OG 3.3Å; E39-S91 WeakPolarHBondContact CA-OG 3.37Å; K88-S91 PolarHBondContact O-N 3.38Å; S91-C94 WeakPolarHBondContact O-CB 3.23Å; S91-C94 PolarHBondContact O-N 3.19Å; S91-L95 WeakPolarHBondContact O-CB 3.34Å; S91-L95 WeakPolarHBondContact O-CD1 3.41Å; S91-L95 WeakPolarHBondContact O-CG 3.26Å; S91-L95 PolarHBondContact O-N 3.44Å |
| 92 | L | 93.5 | Very high | 91 | Very high | 0 Ų | 0 | 36.4 Ų | 36.4 | 0% | 0 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -62 | -46.8 | 178.1 | -174.9 | 70 | 0 | 0 | 0 | 111.6 | I80 A83 K88 A89 Q90 C94 L95 L96 T112 I116 C148 I151 L152 | I80-L92 HydrophobicContact CD1-CD1 4.32Å; I80-L92 HydrophobicContact CG1-CD1 3.55Å; A83-L92 HydrophobicContact CB-CB 4.02Å; A83-L92 HydrophobicContact CB-CD1 4.13Å; K88-L92 VanDerWaalsContact O-CB 3.24Å; K88-L92 WeakPolarHBondContact O-CB 3.4Å; K88-L92 PolarHBondContact O-N 2.96Å; A89-L92 PolarHBondContact O-N 3.17Å; Q90-L92 VanDerWaalsContact C-N 3.29Å; Q90-L92 PolarHBondContact O-N 3.23Å; L92-C94 VanDerWaalsContact C-N 3.35Å; L92-L95 PolarHBondContact O-N 2.85Å; L92-L96 HydrophobicContact CG-CD1 4.21Å; L92-L96 WeakPolarHBondContact O-CG 3.5Å; L92-L96 PolarHBondContact O-N 3.19Å; L92-T112 HydrophobicContact CD1-CG2 4.46Å; L92-I116 HydrophobicContact CD2-CD1 4.45Å; L92-C148 HydrophobicContact CD2-CB 3.6Å; L92-I151 HydrophobicContact CD2-CG2 4.41Å; L92-I151 HydrophobicContact CG-CG2 4.48Å; L92-L152 HydrophobicContact CD1-CD2 4.22Å; L92-L152 HydrophobicContact CD2-CD2 4.33Å; L92-L152 HydrophobicContact CD2-CG 4.1Å |
| 93 | L | 93.8 | Very high | 91 | Very high | 34 Ų | 34 | 38.5 Ų | 38.5 | 18% | 0.178 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -62 | -43.1 | 176 | -179.3 | 61.6 | 0 | 0 | 0 | 111.7 | A89 Q90 L96 R97 I151 | A89-L93 WeakPolarHBondContact O-CB 3.22Å; A89-L93 PolarHBondContact O-N 3.37Å; Q90-L93 PolarHBondContact O-N 2.96Å; L93-L96 PolarHBondContact O-N 2.91Å; L93-R97 HydrophobicContact CD1-CG 4.49Å; L93-R97 WeakPolarHBondContact O-CG 3.5Å; L93-R97 PolarHBondContact O-N 3.41Å; L93-I151 HydrophobicContact CB-CD1 4.17Å; L93-I151 HydrophobicContact CB-CG2 4.3Å; L93-I151 HydrophobicContact CD1-CG2 4.07Å |
| 94 | C | 92.3 | Very high | 91 | Very high | 7 Ų | 7 | 39.8 Ų | 39.8 | 5% | 0.047 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -58.6 | -50.5 | 176.1 | -172.5 | 0 | 0 | 0 | 0 | 110.7 | C41 Q90 S91 L92 L96 R97 H98 | C41-C94 HydrophobicContact CB-CB 4.2Å; Q90-C94 WeakPolarHBondContact O-CB 3.31Å; Q90-C94 PolarHBondContact O-N 3.1Å; S91-C94 WeakPolarHBondContact O-CB 3.23Å; S91-C94 PolarHBondContact O-N 3.19Å; L92-C94 VanDerWaalsContact C-N 3.35Å; C94-L96 VanDerWaalsContact C-N 3.34Å; C94-L96 PolarHBondContact O-N 3.39Å; C94-R97 PolarHBondContact O-N 3.27Å; C94-H98 PolarHBondContact O-CD2 2.86Å; C94-H98 PolarHBondContact O-N 3.19Å; C94-H98 VanDerWaalsContact O-N 3.15Å |
| 95 | L | 92.4 | Very high | 90.8 | Very high | 0 Ų | 0 | 44.8 Ų | 44.8 | 0% | 0 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -58.9 | -44.5 | 179.6 | -71.6 | 163.8 | 0 | 0 | 0 | 112 | I36 I44 L48 V53 P79 A83 S91 L92 H98 G99 A100 | I36-L95 HydrophobicContact CD1-CD1 4.38Å; I44-L95 HydrophobicContact CG2-CD2 4.22Å; L48-L95 HydrophobicContact CD1-CD2 3.93Å; L48-L95 HydrophobicContact CD2-CD2 4.23Å; V53-L95 HydrophobicContact CG1-CD2 3.84Å; P79-L95 HydrophobicContact CB-CD1 4.06Å; P79-L95 HydrophobicContact CB-CD2 3.75Å; P79-L95 WeakPolarHBondContact O-CD1 3.45Å; A83-L95 HydrophobicContact CB-CD1 3.95Å; S91-L95 WeakPolarHBondContact O-CB 3.34Å; S91-L95 WeakPolarHBondContact O-CD1 3.41Å; S91-L95 WeakPolarHBondContact O-CG 3.26Å; S91-L95 PolarHBondContact O-N 3.44Å; L92-L95 PolarHBondContact O-N 2.85Å; L95-H98 CarbonylContact O-C 3.53Å; L95-H98 PolarHBondContact O-N 2.67Å; L95-H98 VanDerWaalsContact O-N 3.16Å; L95-G99 PolarHBondContact O-N 2.89Å; L95-A100 VanDerWaalsContact C-CB 3.47Å; L95-A100 HydrophobicContact CB-CB 4.03Å; L95-A100 WeakPolarHBondContact O-CB 3.42Å; L95-A100 PolarHBondContact O-N 2.67Å |
| 96 | L | 92.5 | Very high | 90.6 | Very high | 14 Ų | 14 | 44.2 Ų | 44.2 | 7% | 0.073 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -63.7 | -41.7 | 177.6 | -72.4 | 163.4 | 0 | 0 | 0 | 112.8 | I80 L92 L93 C94 H98 G99 P102 I151 L152 H155 | I80-L96 HydrophobicContact CD1-CD2 3.67Å; I80-L96 HydrophobicContact CD1-CG 4.16Å; L92-L96 HydrophobicContact CG-CD1 4.21Å; L92-L96 WeakPolarHBondContact O-CG 3.5Å; L92-L96 PolarHBondContact O-N 3.19Å; L93-L96 PolarHBondContact O-N 2.91Å; C94-L96 VanDerWaalsContact C-N 3.34Å; C94-L96 PolarHBondContact O-N 3.39Å; L96-H98 PolarHBondContact O-N 3.15Å; L96-G99 PolarHBondContact O-N 2.89Å; L96-P102 HydrophobicContact CD2-CB 4.29Å; L96-I151 HydrophobicContact CD1-CG2 3.46Å; L96-I151 VanDerWaalsContact CD1-CG2 3.46Å; L96-L152 HydrophobicContact CD1-CD2 4.22Å; L96-H155 HydrophobicContact CD1-CB 4.02Å; L96-H155 HydrophobicContact CD2-CB 4.01Å; L96-H155 HydrophobicContact CG-CB 4.41Å |
| 97 | R | 91.8 | Very high | 90.4 | Very high | 187 Ų | 187 | 47.4 Ų | 47.4 | 71% | 0.706 | 24% | 0.242 | S | C | * | . | H | α-helix | trans | -60.8 | -28.1 | 174.8 | -76.2 | 177.2 | 174 | -176.3 | -1.2 | 112.8 | L93 C94 G99 | L93-R97 HydrophobicContact CD1-CG 4.49Å; L93-R97 WeakPolarHBondContact O-CG 3.5Å; L93-R97 PolarHBondContact O-N 3.41Å; C94-R97 PolarHBondContact O-N 3.27Å; R97-G99 VanDerWaalsContact C-N 3.33Å |
| 98 | H | 90 | Very high | 89.9 | Confident | 84 Ų | 84 | 51 Ų | 51 | 39% | 0.389 | 27% | 0.265 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -91.7 | 13.7 | 177.4 | -77 | -83.6 | 0 | 0 | 0 | 113.9 | E45 L48 V53 C94 L95 L96 | E45-H98 WeakPolarHBondContact CG-NE2 3.33Å; L48-H98 HydrophobicContact CD1-CB 3.79Å; V53-H98 HydrophobicContact CG2-CB 4.43Å; V53-H98 WeakPolarHBondContact CG2-O 3.42Å; C94-H98 PolarHBondContact O-CD2 2.86Å; C94-H98 PolarHBondContact O-N 3.19Å; C94-H98 VanDerWaalsContact O-N 3.15Å; L95-H98 CarbonylContact O-C 3.53Å; L95-H98 PolarHBondContact O-N 2.67Å; L95-H98 VanDerWaalsContact O-N 3.16Å; L96-H98 PolarHBondContact O-N 3.15Å |
| 99 | G | 88.7 | Confident | 89.5 | Confident | 52 Ų | 52 | 49.1 Ų | 49.1 | 54% | 0.536 | 26% | 0.26 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 87.7 | 21.1 | 173.4 | 0 | 0 | 0 | 0 | 0 | 114.5 | L95 L96 R97 D101 | L95-G99 PolarHBondContact O-N 2.89Å; L96-G99 PolarHBondContact O-N 2.89Å; R97-G99 VanDerWaalsContact C-N 3.33Å; G99-D101 PolarHBondContact O-N 3.29Å |
| 100 | A | 91.1 | Very high | 89.1 | Confident | 7 Ų | 7 | 50.6 Ų | 50.6 | 6% | 0.058 | 27% | 0.268 | C | S | . | . | trans | -59.9 | 132.8 | 166.2 | 0 | 0 | 0 | 0 | 0 | 110 | V53 N54 I80 L95 P102 | V53-A100 HydrophobicContact CG1-CB 3.61Å; N54-A100 WeakPolarHBondContact OD1-CA 3.11Å; I80-A100 HydrophobicContact CB-CB 4.21Å; I80-A100 HydrophobicContact CD1-CB 3.89Å; I80-A100 HydrophobicContact CG1-CB 4.24Å; L95-A100 VanDerWaalsContact C-CB 3.47Å; L95-A100 HydrophobicContact CB-CB 4.03Å; L95-A100 WeakPolarHBondContact O-CB 3.42Å; L95-A100 PolarHBondContact O-N 2.67Å; A100-P102 WeakPolarHBondContact O-CD 3.34Å | ||
| 101 | D | 89.7 | Confident | 88.9 | Confident | 71 Ų | 71 | 46.3 Ų | 46.3 | 38% | 0.38 | 25% | 0.249 | S | C | . | . | trans | -84.9 | 116.8 | 177.1 | -179.7 | 2.9 | 0 | 0 | 0 | 109.5 | N54 G99 E103 V104 | N54-D101 PolarHBondContact OD1-N 3.14Å; G99-D101 PolarHBondContact O-N 3.29Å; D101-E103 PolarHBondContact O-N 2.84Å; D101-E103 WeakPolarHBondContact OD1-CB 3.26Å; D101-E103 PolarHBondContact OD1-N 3.03Å; D101-V104 HydrophobicContact CB-CB 4.36Å; D101-V104 WeakPolarHBondContact O-CB 3.46Å; D101-V104 VanDerWaalsContact O-CG1 3.24Å; D101-V104 WeakPolarHBondContact O-CG1 3.3Å; D101-V104 PolarHBondContact O-N 3.2Å | ||
| 102 | P | 89.8 | Confident | 88.8 | Confident | 15 Ų | 15 | 46.3 Ų | 46.3 | 10% | 0.097 | 25% | 0.249 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -63.2 | -23.5 | 177.5 | 26.9 | -34.6 | 0 | 0 | 0 | 113.3 | L96 A100 T112 L152 A157 | L96-P102 HydrophobicContact CD2-CB 4.29Å; A100-P102 WeakPolarHBondContact O-CD 3.34Å; P102-T112 WeakPolarHBondContact O-CB 3.43Å; P102-T112 PolarHBondContact O-OG1 2.93Å; P102-L152 HydrophobicContact CB-CD2 4.3Å; P102-A157 HydrophobicContact CB-CB 4.12Å |
| 103 | E | 90.4 | Very high | 88.6 | Confident | 44 Ų | 44 | 46.4 Ų | 46.4 | 21% | 0.206 | 25% | 0.249 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -90.3 | -0.4 | -177.6 | -62.5 | -54.3 | 124.5 | 0 | 0 | 113.7 | D101 R105 A157 Q158 | D101-E103 PolarHBondContact O-N 2.84Å; D101-E103 WeakPolarHBondContact OD1-CB 3.26Å; D101-E103 PolarHBondContact OD1-N 3.03Å; E103-R105 PolarHBondContact O-N 3.26Å; E103-A157 WeakPolarHBondContact OE1-CA 3.37Å; E103-Q158 VanDerWaalsContact CD-CG 3.48Å; E103-Q158 HydrophobicContact CG-CG 4.07Å; E103-Q158 PolarHBondContact OE1-N 2.63Å; E103-Q158 WeakPolarHBondContact OE2-CB 3.37Å |
| 104 | V | 89.4 | Confident | 88.2 | Confident | 27 Ų | 27 | 45.5 Ų | 45.5 | 16% | 0.164 | 24% | 0.244 | C | C | . | . | trans | -58 | 134.4 | 174.9 | 76.7 | 0 | 0 | 0 | 0 | 110.1 | N54 I78 I80 H81 D101 | N54-V104 HydrophobicContact CB-CG2 4.49Å; I78-V104 HydrophobicContact CD1-CB 4.47Å; I78-V104 HydrophobicContact CD1-CG1 4.03Å; I78-V104 HydrophobicContact CD1-CG2 3.64Å; I78-V104 HydrophobicContact CG2-CG1 4.04Å; I80-V104 HydrophobicContact CG2-CG1 3.69Å; H81-V104 PolarHBondContact CE1-O 3.19Å; H81-V104 VanDerWaalsContact CE1-O 3.28Å; H81-V104 PolarHBondContact NE2-O 3.25Å; D101-V104 HydrophobicContact CB-CB 4.36Å; D101-V104 WeakPolarHBondContact O-CB 3.46Å; D101-V104 VanDerWaalsContact O-CG1 3.24Å; D101-V104 WeakPolarHBondContact O-CG1 3.3Å; D101-V104 PolarHBondContact O-N 3.2Å | ||
| 105 | R | 87.1 | Confident | 88 | Confident | 106 Ų | 106 | 45.9 Ų | 45.9 | 40% | 0.4 | 25% | 0.245 | S | C | . | . | B | Isolated β-bridge | trans | -100.1 | 139.2 | -176.3 | -65.6 | -179.3 | -179.1 | -113.6 | 5.4 | 110.8 | E103 G109 L110 T111 E164 | E103-R105 PolarHBondContact O-N 3.26Å; R105-G109 PolarHBondContact NH1-O 3.37Å; R105-L110 WeakPolarHBondContact CA-O 3.28Å; R105-T111 HydrophobicContact CG-CG2 4.4Å; R105-E164 IonicContact CZ-OE1 2.7Å; R105-E164 IonicContact NH1-OE1 3.9Å; R105-E164 PolarHBondContact NH1-OE1 3.48Å |
| 106 | D | 84.6 | Confident | 87.9 | Confident | 36 Ų | 36 | 45.9 Ų | 45.9 | 19% | 0.193 | 25% | 0.245 | C | C | . | . | trans | -75.2 | -178.2 | 172.2 | 72.3 | 5.2 | 0 | 0 | 0 | 111.3 | H81 T108 G109 L110 | H81-D106 PolarHBondContact CE1-N 3.07Å; D106-T108 VanDerWaalsContact CG-OG1 3.24Å; D106-T108 PolarHBondContact O-N 2.94Å; D106-T108 VanDerWaalsContact O-N 3.09Å; D106-T108 VanDerWaalsContact OD1-C 3.28Å; D106-T108 VanDerWaalsContact OD1-CA 3.27Å; D106-T108 WeakPolarHBondContact OD1-CA 3.48Å; D106-T108 WeakPolarHBondContact OD1-CB 3.38Å; D106-T108 PolarHBondContact OD1-N 2.87Å; D106-T108 PolarHBondContact OD1-OG1 3.44Å; D106-T108 PolarHBondContact OD2-OG1 3.24Å; D106-T108 VanDerWaalsContact OD2-OG1 3.1Å; D106-G109 PolarHBondContact O-N 3.03Å; D106-G109 PolarHBondContact OD1-N 3.23Å; D106-L110 PolarHBondContact N-O 3.45Å; D106-L110 PolarHBondContact OD1-N 3.01Å | ||
| 107 | T | 82.6 | Confident | 87.7 | Confident | 137 Ų | 137 | 45.2 Ų | 45.2 | 84% | 0.84 | 24% | 0.242 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -62.3 | -15.3 | 177.6 | 54.2 | 0 | 0 | 0 | 0 | 113.8 | ||
| 108 | T | 79.9 | Confident | 87.4 | Confident | 95 Ų | 95 | 38.8 Ų | 38.8 | 58% | 0.583 | 22% | 0.221 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -100.4 | 1.4 | 177.5 | 72.5 | 0 | 0 | 0 | 0 | 112.8 | D106 L110 | D106-T108 VanDerWaalsContact CG-OG1 3.24Å; D106-T108 PolarHBondContact O-N 2.94Å; D106-T108 VanDerWaalsContact O-N 3.09Å; D106-T108 VanDerWaalsContact OD1-C 3.28Å; D106-T108 VanDerWaalsContact OD1-CA 3.27Å; D106-T108 WeakPolarHBondContact OD1-CA 3.48Å; D106-T108 WeakPolarHBondContact OD1-CB 3.38Å; D106-T108 PolarHBondContact OD1-N 2.87Å; D106-T108 PolarHBondContact OD1-OG1 3.44Å; D106-T108 PolarHBondContact OD2-OG1 3.24Å; D106-T108 VanDerWaalsContact OD2-OG1 3.1Å; T108-L110 WeakPolarHBondContact OG1-CD1 3.3Å; T108-L110 VanDerWaalsContact OG1-CG 3.25Å; T108-L110 WeakPolarHBondContact OG1-CG 3.27Å |
| 109 | G | 83 | Confident | 87.2 | Confident | 12 Ų | 12 | 38.8 Ų | 38.8 | 12% | 0.124 | 22% | 0.221 | C | C | . | . | S | Bend | trans | 82.6 | 11.6 | 179.6 | 0 | 0 | 0 | 0 | 0 | 114.6 | R105 D106 | R105-G109 PolarHBondContact NH1-O 3.37Å; D106-G109 PolarHBondContact O-N 3.03Å; D106-G109 PolarHBondContact OD1-N 3.23Å |
| 110 | L | 83.5 | Confident | 87 | Confident | 33 Ų | 33 | 37.1 Ų | 37.1 | 17% | 0.173 | 20% | 0.198 | C | C | . | . | trans | -88.2 | 139.6 | -177.8 | -57.7 | 171.4 | 0 | 0 | 0 | 111.6 | R105 D106 T108 K114 L115 L118 | R105-L110 WeakPolarHBondContact CA-O 3.28Å; D106-L110 PolarHBondContact N-O 3.45Å; D106-L110 PolarHBondContact OD1-N 3.01Å; T108-L110 WeakPolarHBondContact OG1-CD1 3.3Å; T108-L110 VanDerWaalsContact OG1-CG 3.25Å; T108-L110 WeakPolarHBondContact OG1-CG 3.27Å; L110-K114 HydrophobicContact CB-CB 4.4Å; L110-K114 HydrophobicContact CB-CG 4.5Å; L110-K114 HydrophobicContact CD2-CG 3.78Å; L110-L115 HydrophobicContact CB-CD2 4.33Å; L110-L115 HydrophobicContact CB-CG 4.32Å; L110-L115 HydrophobicContact CD1-CD2 3.94Å; L110-L118 HydrophobicContact CD1-CD1 3.54Å | ||
| 111 | T | 89.2 | Confident | 86.5 | Confident | 12 Ų | 12 | 37.8 Ų | 37.8 | 7% | 0.074 | 20% | 0.202 | C | C | . | . | B | Isolated β-bridge | trans | -82.2 | 163.6 | 172.9 | 63.5 | 0 | 0 | 0 | 0 | 111.7 | R105 L113 K114 L115 | R105-T111 HydrophobicContact CG-CG2 4.4Å; T111-L113 VanDerWaalsContact C-N 3.28Å; T111-L113 PolarHBondContact O-N 2.86Å; T111-K114 WeakPolarHBondContact O-CB 3.43Å; T111-K114 PolarHBondContact O-N 2.98Å; T111-L115 PolarHBondContact O-N 3.37Å; T111-L115 VanDerWaalsContact O-N 3.13Å |
| 112 | T | 89.4 | Confident | 85.5 | Confident | 0 Ų | 0 | 39.8 Ų | 39.8 | 0% | 0 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -54.9 | -43.4 | 178.5 | -46.4 | 0 | 0 | 0 | 0 | 112.5 | I80 H81 A84 L92 P102 K114 L115 I116 L152 | I80-T112 HydrophobicContact CD1-CG2 4.11Å; I80-T112 HydrophobicContact CG1-CG2 3.97Å; I80-T112 HydrophobicContact CG2-CG2 4.42Å; H81-T112 PolarHBondContact CD2-OG1 2.79Å; H81-T112 VanDerWaalsContact CD2-OG1 3.24Å; H81-T112 PolarHBondContact NE2-OG1 3.35Å; A84-T112 HydrophobicContact CB-CG2 3.54Å; L92-T112 HydrophobicContact CD1-CG2 4.46Å; P102-T112 WeakPolarHBondContact O-CB 3.43Å; P102-T112 PolarHBondContact O-OG1 2.93Å; T112-K114 VanDerWaalsContact C-N 3.31Å; T112-K114 PolarHBondContact O-N 3.01Å; T112-L115 PolarHBondContact O-N 3.12Å; T112-I116 PolarHBondContact O-N 3.33Å; T112-L152 HydrophobicContact CG2-CD1 3.9Å; T112-L152 HydrophobicContact CG2-CD2 3.86Å |
| 113 | L | 89.8 | Confident | 84.1 | Confident | 1 Ų | 1 | 41 Ų | 41 | 1% | 0.005 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -60.3 | -42.9 | 178.4 | -173.7 | 158 | 0 | 0 | 0 | 111.2 | T111 L115 I116 L117 L149 L152 A157 V159 P170 L186 | T111-L113 VanDerWaalsContact C-N 3.28Å; T111-L113 PolarHBondContact O-N 2.86Å; L113-L115 VanDerWaalsContact C-N 3.35Å; L113-L115 PolarHBondContact O-N 3.49Å; L113-I116 PolarHBondContact O-N 3.17Å; L113-L117 HydrophobicContact CD2-CD1 3.74Å; L113-L117 HydrophobicContact CD2-CG 4.3Å; L113-L117 WeakPolarHBondContact O-CG 3.46Å; L113-L117 PolarHBondContact O-N 3.29Å; L113-L149 HydrophobicContact CG-CD1 4.37Å; L113-L152 HydrophobicContact CB-CD1 4.25Å; L113-A157 HydrophobicContact CD1-CB 4.06Å; L113-V159 HydrophobicContact CD1-CG1 4.24Å; L113-P170 HydrophobicContact CD2-CB 3.56Å; L113-P170 HydrophobicContact CD2-CG 3.47Å; L113-P170 VanDerWaalsContact CD2-CG 3.47Å; L113-L186 HydrophobicContact CD1-CD2 4.39Å |
| 114 | K | 86.1 | Confident | 82.3 | Confident | 16 Ų | 16 | 42.8 Ų | 42.8 | 7% | 0.07 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -63 | -42.1 | 179.6 | -161.7 | 77.4 | 172.2 | 172.1 | 0 | 111.6 | L110 T111 T112 I116 L117 L118 R168 L173 | L110-K114 HydrophobicContact CB-CB 4.4Å; L110-K114 HydrophobicContact CB-CG 4.5Å; L110-K114 HydrophobicContact CD2-CG 3.78Å; T111-K114 WeakPolarHBondContact O-CB 3.43Å; T111-K114 PolarHBondContact O-N 2.98Å; T112-K114 VanDerWaalsContact C-N 3.31Å; T112-K114 PolarHBondContact O-N 3.01Å; K114-I116 PolarHBondContact O-N 2.95Å; K114-L117 PolarHBondContact O-N 3.38Å; K114-L117 VanDerWaalsContact O-N 3.16Å; K114-L118 HydrophobicContact CG-CD1 4.41Å; K114-L118 WeakPolarHBondContact O-CG 3.44Å; K114-L118 PolarHBondContact O-N 3.09Å; K114-R168 PolarHBondContact NZ-O 2.88Å; K114-L173 HydrophobicContact CD-CD1 3.3Å; K114-L173 HydrophobicContact CD-CG 4.12Å; K114-L173 HydrophobicContact CG-CD1 3.91Å; K114-L173 VanDerWaalsContact NZ-CD1 3.29Å |
| 115 | L | 88.1 | Confident | 80.4 | Confident | 15 Ų | 15 | 48 Ų | 48 | 8% | 0.079 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -62.3 | -40.8 | 178.4 | -70.6 | 171.4 | 0 | 0 | 0 | 112.2 | H81 L110 T111 T112 L113 L117 L118 H119 | H81-L115 HydrophobicContact CB-CD1 3.61Å; H81-L115 VanDerWaalsContact CG-CD1 3.45Å; L110-L115 HydrophobicContact CB-CD2 4.33Å; L110-L115 HydrophobicContact CB-CG 4.32Å; L110-L115 HydrophobicContact CD1-CD2 3.94Å; T111-L115 PolarHBondContact O-N 3.37Å; T111-L115 VanDerWaalsContact O-N 3.13Å; T112-L115 PolarHBondContact O-N 3.12Å; L113-L115 VanDerWaalsContact C-N 3.35Å; L113-L115 PolarHBondContact O-N 3.49Å; L115-L117 VanDerWaalsContact C-N 3.28Å; L115-L117 PolarHBondContact O-N 2.85Å; L115-L118 HydrophobicContact CD2-CD1 4.41Å; L115-L118 PolarHBondContact O-N 3.5Å; L115-H119 PolarHBondContact O-CD2 2.99Å; L115-H119 PolarHBondContact O-N 3.23Å |
| 116 | I | 89.6 | Confident | 78.3 | Confident | 0 Ų | 0 | 48.2 Ų | 48.2 | 0% | 0 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -57.5 | -44.1 | 173.4 | -65.1 | -165.8 | 0 | 0 | 0 | 110.9 | A84 L92 T112 L113 K114 H119 W120 C148 L152 | A84-I116 HydrophobicContact CB-CD1 4.04Å; A84-I116 HydrophobicContact CB-CG1 3.54Å; L92-I116 HydrophobicContact CD2-CD1 4.45Å; T112-I116 PolarHBondContact O-N 3.33Å; L113-I116 PolarHBondContact O-N 3.17Å; K114-I116 PolarHBondContact O-N 2.95Å; I116-H119 CarbonylContact O-C 3.53Å; I116-H119 PolarHBondContact O-N 3.01Å; I116-W120 HydrophobicContact CG2-CE3 4.12Å; I116-W120 HydrophobicContact CG2-CZ3 4.17Å; I116-W120 PolarHBondContact O-N 3.13Å; I116-W120 VanDerWaalsContact O-N 3.09Å; I116-C148 HydrophobicContact CD1-CB 3.61Å; I116-L152 HydrophobicContact CD1-CD1 3.35Å; I116-L152 HydrophobicContact CD1-CG 4.2Å; I116-L152 HydrophobicContact CG1-CD1 4.1Å |
| 117 | L | 87.8 | Confident | 76.4 | Confident | 0 Ų | 0 | 54.8 Ų | 54.8 | 0% | 0 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -70.3 | -36.4 | -178.6 | -62.4 | -177.1 | 0 | 0 | 0 | 112.7 | L113 K114 L115 H119 W120 P170 L173 Y177 V182 L186 | L113-L117 HydrophobicContact CD2-CD1 3.74Å; L113-L117 HydrophobicContact CD2-CG 4.3Å; L113-L117 WeakPolarHBondContact O-CG 3.46Å; L113-L117 PolarHBondContact O-N 3.29Å; K114-L117 PolarHBondContact O-N 3.38Å; K114-L117 VanDerWaalsContact O-N 3.16Å; L115-L117 VanDerWaalsContact C-N 3.28Å; L115-L117 PolarHBondContact O-N 2.85Å; L117-H119 VanDerWaalsContact C-N 3.33Å; L117-W120 HydrophobicContact CD2-CE3 4.45Å; L117-W120 WeakPolarHBondContact O-CB 3.36Å; L117-W120 PolarHBondContact O-N 3.47Å; L117-P170 HydrophobicContact CD1-CB 3.76Å; L117-P170 WeakPolarHBondContact CD1-O 3.43Å; L117-L173 HydrophobicContact CB-CB 4.14Å; L117-L173 HydrophobicContact CB-CD1 3.7Å; L117-L173 HydrophobicContact CD1-CB 4.14Å; L117-L173 HydrophobicContact CD1-CD1 4.21Å; L117-Y177 WeakPolarHBondContact O-CD2 3.28Å; L117-V182 HydrophobicContact CD2-CB 4.47Å; L117-V182 HydrophobicContact CD2-CG1 3.48Å; L117-V182 VanDerWaalsContact CD2-CG1 3.48Å; L117-V182 HydrophobicContact CD2-CG2 4.2Å; L117-L186 HydrophobicContact CD1-CD1 4.42Å |
| 118 | L | 85.5 | Confident | 74.6 | Confident | 52 Ų | 52 | 53 Ų | 53 | 27% | 0.272 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -66.1 | -36.4 | 175.2 | -70.4 | 172 | 0 | 0 | 0 | 112.1 | L110 K114 L115 L173 Y177 | L110-L118 HydrophobicContact CD1-CD1 3.54Å; K114-L118 HydrophobicContact CG-CD1 4.41Å; K114-L118 WeakPolarHBondContact O-CG 3.44Å; K114-L118 PolarHBondContact O-N 3.09Å; L115-L118 HydrophobicContact CD2-CD1 4.41Å; L115-L118 PolarHBondContact O-N 3.5Å; L118-L173 HydrophobicContact CD2-CD1 4.28Å; L118-L173 HydrophobicContact CG-CD1 4.34Å; L118-Y177 HydrophobicContact CD2-CE2 3.85Å; L118-Y177 WeakPolarHBondContact CD2-OH 3.43Å |
| 119 | H | 85.2 | Confident | 73.5 | Confident | 83 Ų | 83 | 58.2 Ų | 58.2 | 38% | 0.384 | 32% | 0.322 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -98.2 | 21.2 | 179.5 | -67.8 | -68.6 | 0 | 0 | 0 | 113.1 | H87 L115 I116 L117 | H87-H119 PolarHBondContact CE1-O 2.8Å; H87-H119 VanDerWaalsContact CE1-O 3.28Å; H87-H119 PolarHBondContact NE2-O 3.16Å; L115-H119 PolarHBondContact O-CD2 2.99Å; L115-H119 PolarHBondContact O-N 3.23Å; I116-H119 CarbonylContact O-C 3.53Å; I116-H119 PolarHBondContact O-N 3.01Å; L117-H119 VanDerWaalsContact C-N 3.33Å |
| 120 | W | 85.7 | Confident | 72 | Confident | 18 Ų | 18 | 59.7 Ų | 59.7 | 7% | 0.068 | 33% | 0.33 | C | S | . | . | trans | -61.4 | 133.4 | -178.1 | -168.5 | -88.6 | 0 | 0 | 0 | 111.1 | I116 L117 V122 A145 I146 L149 C179 V182 | I116-W120 HydrophobicContact CG2-CE3 4.12Å; I116-W120 HydrophobicContact CG2-CZ3 4.17Å; I116-W120 PolarHBondContact O-N 3.13Å; I116-W120 VanDerWaalsContact O-N 3.09Å; L117-W120 HydrophobicContact CD2-CE3 4.45Å; L117-W120 WeakPolarHBondContact O-CB 3.36Å; L117-W120 PolarHBondContact O-N 3.47Å; W120-V122 PolarHBondContact O-N 3.28Å; W120-A145 HydrophobicContact CE3-CB 4.11Å; W120-A145 HydrophobicContact CH2-CB 4.02Å; W120-A145 HydrophobicContact CZ2-CB 4.44Å; W120-A145 HydrophobicContact CZ3-CB 3.84Å; W120-I146 HydrophobicContact CH2-CB 4.44Å; W120-I146 HydrophobicContact CH2-CG1 3.64Å; W120-I146 HydrophobicContact CZ2-CG1 3.88Å; W120-L149 HydrophobicContact CZ3-CD2 4.45Å; W120-C179 HydrophobicContact CD2-CB 4.37Å; W120-C179 HydrophobicContact CG-CB 4.27Å; W120-V182 HydrophobicContact CD2-CG2 3.91Å; W120-V182 HydrophobicContact CE3-CG2 3.72Å; W120-V182 HydrophobicContact CH2-CG2 3.28Å; W120-V182 HydrophobicContact CZ2-CG2 3.49Å; W120-V182 VanDerWaalsContact CZ2-CG2 3.49Å; W120-V182 HydrophobicContact CZ3-CG2 3.41Å; W120-V182 VanDerWaalsContact CZ3-CG2 3.41Å | ||
| 121 | P | 80.1 | Confident | 70.9 | Confident | 21 Ų | 21 | 60.7 Ų | 60.7 | 14% | 0.136 | 35% | 0.348 | C | S | . | . | trans | -65.9 | 107 | 179.4 | 26.3 | -34.8 | 0 | 0 | 0 | 111 | T123 I141 Q142 A145 | P121-T123 PolarHBondContact O-N 2.81Å; P121-T123 VanDerWaalsContact O-N 3.15Å; P121-I141 HydrophobicContact CB-CG2 3.67Å; P121-I141 HydrophobicContact CG-CG2 3.98Å; P121-Q142 HydrophobicContact CB-CG 4.4Å; P121-Q142 HydrophobicContact CG-CG 4Å; P121-A145 HydrophobicContact CG-CB 3.92Å | ||
| 122 | V | 68.3 | Low | 70.1 | Confident | 112 Ų | 112 | 66.5 Ų | 66.5 | 68% | 0.679 | 38% | 0.379 | S | S | * | . | trans | -77.4 | 97.1 | 174.4 | -175 | 0 | 0 | 0 | 0 | 108.7 | W120 | W120-V122 PolarHBondContact O-N 3.28Š| ||
| 123 | T | 61.3 | Low | 69.5 | Low | 41 Ų | 41 | 75.8 Ų | 75.8 | 25% | 0.252 | 41% | 0.414 | S | S | . | . | trans | -95.4 | 109.1 | 168.7 | 67.8 | 0 | 0 | 0 | 0 | 108.7 | P121 T125 L138 Q142 | P121-T123 PolarHBondContact O-N 2.81Å; P121-T123 VanDerWaalsContact O-N 3.15Å; T123-T125 PolarHBondContact O-N 3.1Å; T123-L138 HydrophobicContact CG2-CB 4.32Å; T123-L138 HydrophobicContact CG2-CD2 4.34Å; T123-Q142 HydrophobicContact CG2-CG 3.89Å; T123-Q142 VanDerWaalsContact CG2-NE2 3.31Å; T123-Q142 PolarHBondContact OG1-NE2 3.44Å | ||
| 124 | S | 53 | Low | 68.7 | Low | 82 Ų | 82 | 81.7 Ų | 81.7 | 57% | 0.573 | 44% | 0.443 | S | S | * | . | trans | -69.1 | 117.4 | 168.7 | -155 | 0 | 0 | 0 | 0 | 108.3 | T126 | S124-T126 PolarHBondContact O-N 3.36Å; S124-T126 PolarHBondContact OG-OG1 3.23Å | ||
| 125 | T | 48.2 | Very low | 68.2 | Low | 137 Ų | 137 | 85.8 Ų | 85.8 | 84% | 0.84 | 46% | 0.462 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -73.8 | 12.2 | -176.5 | 44.8 | 0 | 0 | 0 | 0 | 113.9 | T123 | T123-T125 PolarHBondContact O-N 3.1Š|
| 126 | T | 43.3 | Very low | 67.6 | Low | 109 Ų | 109 | 92.2 Ų | 92.2 | 67% | 0.669 | 49% | 0.485 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91.7 | 10.9 | -176.1 | 53.5 | 0 | 0 | 0 | 0 | 114.5 | S124 A128 | S124-T126 PolarHBondContact O-N 3.36Å; S124-T126 PolarHBondContact OG-OG1 3.23Å; T126-A128 PolarHBondContact O-N 3.44Å; T126-A128 VanDerWaalsContact O-N 3.15Å |
| 127 | W | 45.3 | Very low | 67.2 | Low | 175 Ų | 175 | 96 Ų | 96 | 66% | 0.663 | 50% | 0.504 | S | S | * | . | trans | -82.1 | 98.6 | 176.2 | -72.3 | -4.5 | 0 | 0 | 0 | 111.5 | K129 L138 | W127-K129 PolarHBondContact O-N 2.88Å; W127-K129 VanDerWaalsContact O-N 3.12Å; W127-L138 HydrophobicContact CE3-CD1 4.33Å; W127-L138 HydrophobicContact CZ3-CD1 3.87Å | ||
| 128 | A | 43.8 | Very low | 66.8 | Low | 99 Ų | 99 | 98.7 Ų | 98.7 | 82% | 0.818 | 52% | 0.519 | S | S | * | . | S | Bend | trans | -63.2 | 109 | 165.5 | 0 | 0 | 0 | 0 | 0 | 109.4 | T126 | T126-A128 PolarHBondContact O-N 3.44Å; T126-A128 VanDerWaalsContact O-N 3.15Å |
| 129 | K | 58 | Low | 66.5 | Low | 204 Ų | 204 | 98 Ų | 98 | 89% | 0.887 | 52% | 0.517 | S | S | * | . | trans | 62.3 | 77.3 | 175.7 | -64.5 | -176.5 | 178.5 | 179.2 | 0 | 115.9 | W127 | W127-K129 PolarHBondContact O-N 2.88Å; W127-K129 VanDerWaalsContact O-N 3.12Å | ||
| 130 | P | 51.1 | Low | 66.4 | Low | 43 Ų | 43 | 97.8 Ų | 97.8 | 28% | 0.279 | 52% | 0.519 | S | S | . | . | trans | -74.3 | 127.1 | 163.7 | 29.7 | -27.7 | 0 | 0 | 0 | 109.4 | N132 H135 | P130-N132 PolarHBondContact O-N 3.25Å; P130-H135 HydrophobicContact CB-CB 3.96Å; P130-H135 HydrophobicContact CG-CB 3.75Å | ||
| 131 | G | 60.9 | Low | 66.3 | Low | 55 Ų | 55 | 100.2 Ų | 100.2 | 57% | 0.567 | 53% | 0.532 | S | S | * | . | trans | -52.2 | 138.2 | 170.3 | 0 | 0 | 0 | 0 | 0 | 110.9 | R133 M134 | G131-R133 PolarHBondContact O-N 3.07Å; G131-M134 PolarHBondContact O-N 3.15Å | ||
| 132 | N | 70.9 | Confident | 66.5 | Low | 134 Ų | 134 | 101.6 Ų | 101.6 | 72% | 0.717 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -48.8 | -18.2 | -165 | -62.8 | -10.9 | 0 | 0 | 0 | 116.8 | P130 R136 | P130-N132 PolarHBondContact O-N 3.25Å; N132-R136 WeakPolarHBondContact O-CB 3.39Å |
| 133 | R | 76.9 | Confident | 67.3 | Low | 195 Ų | 195 | 100.3 Ų | 100.3 | 74% | 0.736 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -84.9 | -47.8 | 178 | -174.3 | -179 | -78.7 | -174.2 | -4.1 | 113.1 | G131 H135 R136 I137 | G131-R133 PolarHBondContact O-N 3.07Å; R133-H135 VanDerWaalsContact C-N 3.34Å; R133-R136 WeakPolarHBondContact O-CB 3.13Å; R133-R136 PolarHBondContact O-N 3.45Å; R133-I137 HydrophobicContact CG-CD1 4.06Å; R133-I137 WeakPolarHBondContact O-CG1 3.42Å; R133-I137 PolarHBondContact O-N 3.25Å |
| 134 | M | 74.1 | Confident | 68.6 | Low | 125 Ų | 125 | 101.3 Ų | 101.3 | 62% | 0.616 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -68.1 | -38.6 | -178.5 | -69.5 | -57.8 | -174.7 | 0 | 0 | 111.4 | G131 R136 I137 L138 | G131-M134 PolarHBondContact O-N 3.15Å; M134-R136 VanDerWaalsContact C-N 3.31Å; M134-R136 PolarHBondContact O-N 3.32Å; M134-I137 PolarHBondContact O-N 3.13Å; M134-I137 HydrophobicContact SD-CD1 4.42Å; M134-L138 WeakPolarHBondContact O-CG 3.2Å; M134-L138 PolarHBondContact O-N 2.62Å |
| 135 | H | 74.8 | Confident | 70.4 | Confident | 101 Ų | 101 | 97.4 Ų | 97.4 | 47% | 0.468 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -57.2 | -47.5 | 172.2 | -171.4 | 58.5 | 0 | 0 | 0 | 111.5 | P130 R133 I137 L138 T139 | P130-H135 HydrophobicContact CB-CB 3.96Å; P130-H135 HydrophobicContact CG-CB 3.75Å; R133-H135 VanDerWaalsContact C-N 3.34Å; H135-I137 PolarHBondContact O-N 3.24Å; H135-L138 PolarHBondContact O-N 3.44Å; H135-T139 WeakPolarHBondContact O-CG2 3.25Å; H135-T139 PolarHBondContact O-N 3.38Å; H135-T139 PolarHBondContact O-OG1 3.47Å |
| 136 | R | 76.6 | Confident | 72.4 | Confident | 151 Ų | 151 | 92.7 Ų | 92.7 | 57% | 0.57 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -61.4 | -45.4 | -179.7 | -164.2 | -176 | -47.8 | 174.9 | 1.7 | 112.3 | N132 R133 M134 L138 T139 D140 | N132-R136 WeakPolarHBondContact O-CB 3.39Å; R133-R136 WeakPolarHBondContact O-CB 3.13Å; R133-R136 PolarHBondContact O-N 3.45Å; M134-R136 VanDerWaalsContact C-N 3.31Å; M134-R136 PolarHBondContact O-N 3.32Å; R136-L138 VanDerWaalsContact C-N 3.33Å; R136-L138 PolarHBondContact O-N 2.96Å; R136-T139 VanDerWaalsContact CA-OG1 3.29Å; R136-T139 WeakPolarHBondContact CA-OG1 3.16Å; R136-T139 PolarHBondContact O-N 3.45Å; R136-T139 PolarHBondContact O-OG1 3.34Å; R136-D140 WeakPolarHBondContact O-CB 3.33Å; R136-D140 PolarHBondContact O-N 3.39Å |
| 137 | I | 80.6 | Confident | 74.7 | Confident | 78 Ų | 78 | 90.1 Ų | 90.1 | 40% | 0.4 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -61.1 | -43.6 | 176.8 | -66.3 | 166 | 0 | 0 | 0 | 110.8 | R133 M134 H135 D140 I141 | R133-I137 HydrophobicContact CG-CD1 4.06Å; R133-I137 WeakPolarHBondContact O-CG1 3.42Å; R133-I137 PolarHBondContact O-N 3.25Å; M134-I137 PolarHBondContact O-N 3.13Å; M134-I137 HydrophobicContact SD-CD1 4.42Å; H135-I137 PolarHBondContact O-N 3.24Å; I137-D140 PolarHBondContact O-N 3.5Å; I137-I141 HydrophobicContact CG2-CD1 3.93Å; I137-I141 VanDerWaalsContact O-CG1 3.25Å; I137-I141 WeakPolarHBondContact O-CG1 3.42Å; I137-I141 PolarHBondContact O-N 3.28Å |
| 138 | L | 78.1 | Confident | 76.9 | Confident | 57 Ų | 57 | 81.8 Ų | 81.8 | 30% | 0.298 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -66.1 | -42.2 | 178 | -70.3 | 172.1 | 0 | 0 | 0 | 112.2 | T123 W127 M134 H135 R136 D140 I141 Q142 | T123-L138 HydrophobicContact CG2-CB 4.32Å; T123-L138 HydrophobicContact CG2-CD2 4.34Å; W127-L138 HydrophobicContact CE3-CD1 4.33Å; W127-L138 HydrophobicContact CZ3-CD1 3.87Å; M134-L138 WeakPolarHBondContact O-CG 3.2Å; M134-L138 PolarHBondContact O-N 2.62Å; H135-L138 PolarHBondContact O-N 3.44Å; R136-L138 VanDerWaalsContact C-N 3.33Å; R136-L138 PolarHBondContact O-N 2.96Å; L138-D140 VanDerWaalsContact C-N 3.32Å; L138-D140 PolarHBondContact O-N 2.89Å; L138-I141 PolarHBondContact O-N 2.95Å; L138-Q142 WeakPolarHBondContact O-CG 3.37Å; L138-Q142 PolarHBondContact O-N 3.24Å |
| 139 | T | 80.1 | Confident | 79.2 | Confident | 39 Ų | 39 | 77 Ų | 77 | 24% | 0.239 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -64.4 | -38 | 175.3 | 52.5 | 0 | 0 | 0 | 0 | 111.6 | H135 R136 Q142 N143 | H135-T139 WeakPolarHBondContact O-CG2 3.25Å; H135-T139 PolarHBondContact O-N 3.38Å; H135-T139 PolarHBondContact O-OG1 3.47Å; R136-T139 VanDerWaalsContact CA-OG1 3.29Å; R136-T139 WeakPolarHBondContact CA-OG1 3.16Å; R136-T139 PolarHBondContact O-N 3.45Å; R136-T139 PolarHBondContact O-OG1 3.34Å; T139-Q142 PolarHBondContact O-N 2.92Å; T139-N143 WeakPolarHBondContact O-CB 3.13Å; T139-N143 PolarHBondContact O-N 2.99Å; T139-N143 PolarHBondContact O-ND2 3.07Å; T139-N143 VanDerWaalsContact O-ND2 3.17Å |
| 140 | D | 83.6 | Confident | 80.8 | Confident | 78 Ų | 78 | 75 Ų | 75 | 42% | 0.417 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -66 | -42.8 | 177.7 | -67.8 | -16.8 | 0 | 0 | 0 | 111.1 | R136 I137 L138 Q142 N143 N144 | R136-D140 WeakPolarHBondContact O-CB 3.33Å; R136-D140 PolarHBondContact O-N 3.39Å; I137-D140 PolarHBondContact O-N 3.5Å; L138-D140 VanDerWaalsContact C-N 3.32Å; L138-D140 PolarHBondContact O-N 2.89Å; D140-Q142 VanDerWaalsContact C-N 3.32Å; D140-Q142 PolarHBondContact O-N 3.49Å; D140-N143 PolarHBondContact O-N 3.23Å; D140-N144 WeakPolarHBondContact O-CB 3.48Å; D140-N144 PolarHBondContact O-N 3.2Å |
| 141 | I | 83.6 | Confident | 82.8 | Confident | 68 Ų | 68 | 74.1 Ų | 74.1 | 35% | 0.349 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -60.2 | -43.3 | 174.7 | -67.9 | 164.6 | 0 | 0 | 0 | 110.8 | P121 I137 L138 N144 A145 | P121-I141 HydrophobicContact CB-CG2 3.67Å; P121-I141 HydrophobicContact CG-CG2 3.98Å; I137-I141 HydrophobicContact CG2-CD1 3.93Å; I137-I141 VanDerWaalsContact O-CG1 3.25Å; I137-I141 WeakPolarHBondContact O-CG1 3.42Å; I137-I141 PolarHBondContact O-N 3.28Å; L138-I141 PolarHBondContact O-N 2.95Å; I141-N144 PolarHBondContact O-N 3.33Å; I141-A145 PolarHBondContact O-N 2.88Å |
| 142 | Q | 83.3 | Confident | 84.3 | Confident | 50 Ų | 50 | 71.5 Ų | 71.5 | 23% | 0.234 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -65.8 | -44.7 | 176.7 | -72.1 | -169.1 | -47.5 | 0 | 0 | 112.7 | P121 T123 L138 T139 D140 N144 A145 I146 | P121-Q142 HydrophobicContact CB-CG 4.4Å; P121-Q142 HydrophobicContact CG-CG 4Å; T123-Q142 HydrophobicContact CG2-CG 3.89Å; T123-Q142 VanDerWaalsContact CG2-NE2 3.31Å; T123-Q142 PolarHBondContact OG1-NE2 3.44Å; L138-Q142 WeakPolarHBondContact O-CG 3.37Å; L138-Q142 PolarHBondContact O-N 3.24Å; T139-Q142 PolarHBondContact O-N 2.92Å; D140-Q142 VanDerWaalsContact C-N 3.32Å; D140-Q142 PolarHBondContact O-N 3.49Å; Q142-N144 VanDerWaalsContact C-N 3.27Å; Q142-N144 PolarHBondContact O-N 3.04Å; Q142-A145 PolarHBondContact O-N 3.44Å; Q142-I146 WeakPolarHBondContact O-CB 3.39Å; Q142-I146 VanDerWaalsContact O-CG1 3.29Å; Q142-I146 WeakPolarHBondContact O-CG1 3.35Å; Q142-I146 PolarHBondContact O-N 2.99Å |
| 143 | N | 86.4 | Confident | 85.2 | Confident | 85 Ų | 85 | 65.7 Ų | 65.7 | 46% | 0.455 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -62 | -39 | 177.9 | -71.7 | -24.1 | 0 | 0 | 0 | 111 | T139 D140 I146 T147 | T139-N143 WeakPolarHBondContact O-CB 3.13Å; T139-N143 PolarHBondContact O-N 2.99Å; T139-N143 PolarHBondContact O-ND2 3.07Å; T139-N143 VanDerWaalsContact O-ND2 3.17Å; D140-N143 PolarHBondContact O-N 3.23Å; N143-I146 PolarHBondContact O-N 3.43Å; N143-T147 VanDerWaalsContact O-CB 3.3Å; N143-T147 WeakPolarHBondContact O-CB 3.27Å; N143-T147 PolarHBondContact O-N 3.12Å; N143-T147 PolarHBondContact O-OG1 3.48Å |
| 144 | N | 88.6 | Confident | 85.9 | Confident | 62 Ų | 62 | 60.2 Ų | 60.2 | 33% | 0.332 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -65.7 | -45 | 174.7 | -79.2 | -6.3 | 0 | 0 | 0 | 112 | H87 D140 I141 Q142 I146 T147 C148 | H87-N144 HydrophobicContact CB-CB 4.33Å; H87-N144 WeakPolarHBondContact O-CB 3.07Å; D140-N144 WeakPolarHBondContact O-CB 3.48Å; D140-N144 PolarHBondContact O-N 3.2Å; I141-N144 PolarHBondContact O-N 3.33Å; Q142-N144 VanDerWaalsContact C-N 3.27Å; Q142-N144 PolarHBondContact O-N 3.04Å; N144-I146 VanDerWaalsContact C-N 3.34Å; N144-I146 PolarHBondContact O-N 3.03Å; N144-T147 PolarHBondContact O-N 3.28Å; N144-T147 VanDerWaalsContact O-N 3.14Å; N144-C148 PolarHBondContact O-N 3.31Å; N144-C148 PolarHBondContact O-SG 3.44Å |
| 145 | A | 89.2 | Confident | 86.7 | Confident | 0 Ų | 0 | 57.9 Ų | 57.9 | 0% | 0 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -60.5 | -42.9 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | H87 W120 P121 I141 Q142 T147 C148 L149 | H87-A145 HydrophobicContact CB-CB 4.4Å; H87-A145 WeakPolarHBondContact ND1-CB 3.42Å; W120-A145 HydrophobicContact CE3-CB 4.11Å; W120-A145 HydrophobicContact CH2-CB 4.02Å; W120-A145 HydrophobicContact CZ2-CB 4.44Å; W120-A145 HydrophobicContact CZ3-CB 3.84Å; P121-A145 HydrophobicContact CG-CB 3.92Å; I141-A145 PolarHBondContact O-N 2.88Å; Q142-A145 PolarHBondContact O-N 3.44Å; A145-T147 VanDerWaalsContact C-N 3.35Å; A145-C148 PolarHBondContact O-N 3.29Å; A145-L149 PolarHBondContact O-N 3.43Å |
| 146 | I | 90.4 | Very high | 87.2 | Confident | 39 Ų | 39 | 55.3 Ų | 55.3 | 20% | 0.2 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -60.7 | -45 | 173.3 | -70.6 | 166.5 | 0 | 0 | 0 | 110.6 | W120 Q142 N143 N144 L149 R150 P181 I185 | W120-I146 HydrophobicContact CH2-CB 4.44Å; W120-I146 HydrophobicContact CH2-CG1 3.64Å; W120-I146 HydrophobicContact CZ2-CG1 3.88Å; Q142-I146 WeakPolarHBondContact O-CB 3.39Å; Q142-I146 VanDerWaalsContact O-CG1 3.29Å; Q142-I146 WeakPolarHBondContact O-CG1 3.35Å; Q142-I146 PolarHBondContact O-N 2.99Å; N143-I146 PolarHBondContact O-N 3.43Å; N144-I146 VanDerWaalsContact C-N 3.34Å; N144-I146 PolarHBondContact O-N 3.03Å; I146-L149 PolarHBondContact O-N 3.31Å; I146-R150 WeakPolarHBondContact O-CG 3.43Å; I146-R150 PolarHBondContact O-N 3.05Å; I146-P181 HydrophobicContact CD1-CB 4.1Å; I146-P181 HydrophobicContact CD1-CG 4.4Å; I146-P181 HydrophobicContact CG1-CB 4.41Å; I146-I185 HydrophobicContact CG2-CD1 3.83Å |
| 147 | T | 91.8 | Very high | 87.8 | Confident | 54 Ų | 54 | 48.6 Ų | 48.6 | 33% | 0.331 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -64.3 | -44.7 | -179.7 | -58 | 0 | 0 | 0 | 0 | 110.9 | A89 N143 N144 A145 L149 R150 I151 | A89-T147 HydrophobicContact CB-CG2 3.87Å; N143-T147 VanDerWaalsContact O-CB 3.3Å; N143-T147 WeakPolarHBondContact O-CB 3.27Å; N143-T147 PolarHBondContact O-N 3.12Å; N143-T147 PolarHBondContact O-OG1 3.48Å; N144-T147 PolarHBondContact O-N 3.28Å; N144-T147 VanDerWaalsContact O-N 3.14Å; A145-T147 VanDerWaalsContact C-N 3.35Å; T147-L149 VanDerWaalsContact C-N 3.33Å; T147-L149 PolarHBondContact O-N 3.48Å; T147-R150 PolarHBondContact O-N 3.46Å; T147-I151 HydrophobicContact CG2-CD1 3.79Å; T147-I151 HydrophobicContact CG2-CG1 4.42Å; T147-I151 WeakPolarHBondContact O-CB 3.17Å; T147-I151 WeakPolarHBondContact O-CD1 3.48Å; T147-I151 VanDerWaalsContact O-CG1 3.26Å; T147-I151 WeakPolarHBondContact O-CG1 3.26Å; T147-I151 PolarHBondContact O-N 3.46Å |
| 148 | C | 91.8 | Very high | 88.2 | Confident | 0 Ų | 0 | 50.1 Ų | 50.1 | 0% | 0 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -57.6 | -45.2 | 174.2 | -69.1 | 0 | 0 | 0 | 0 | 112 | H87 A89 L92 I116 N144 A145 R150 I151 L152 | H87-C148 VanDerWaalsContact C-SG 3.59Å; A89-C148 WeakPolarHBondContact CA-SG 3.49Å; A89-C148 PolarHBondContact N-SG 3.18Å; L92-C148 HydrophobicContact CD2-CB 3.6Å; I116-C148 HydrophobicContact CD1-CB 3.61Å; N144-C148 PolarHBondContact O-N 3.31Å; N144-C148 PolarHBondContact O-SG 3.44Å; A145-C148 PolarHBondContact O-N 3.29Å; C148-R150 PolarHBondContact O-N 3.28Å; C148-I151 PolarHBondContact O-N 3.23Å; C148-L152 PolarHBondContact O-N 2.98Å |
| 149 | L | 91.8 | Very high | 88.7 | Confident | 0 Ų | 0 | 48 Ų | 48 | 0% | 0 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -60.9 | -46 | 177.3 | -179.2 | 65.4 | 0 | 0 | 0 | 111.6 | L113 W120 A145 I146 T147 I151 L152 C153 V182 I185 L186 | L113-L149 HydrophobicContact CG-CD1 4.37Å; W120-L149 HydrophobicContact CZ3-CD2 4.45Å; A145-L149 PolarHBondContact O-N 3.43Å; I146-L149 PolarHBondContact O-N 3.31Å; T147-L149 VanDerWaalsContact C-N 3.33Å; T147-L149 PolarHBondContact O-N 3.48Å; L149-I151 VanDerWaalsContact C-N 3.33Å; L149-I151 PolarHBondContact O-N 3.05Å; L149-L152 PolarHBondContact O-N 3.03Å; L149-C153 PolarHBondContact O-N 3.15Å; L149-C153 PolarHBondContact O-SG 3.11Å; L149-C153 VanDerWaalsContact O-SG 3.38Å; L149-V182 HydrophobicContact CD2-CB 4.18Å; L149-V182 HydrophobicContact CD2-CG1 3.85Å; L149-V182 HydrophobicContact CD2-CG2 3.95Å; L149-I185 HydrophobicContact CD2-CB 4.05Å; L149-I185 HydrophobicContact CD2-CD1 4.09Å; L149-I185 HydrophobicContact CD2-CG2 3.8Å; L149-I185 HydrophobicContact CG-CG2 3.97Å; L149-L186 HydrophobicContact CD1-CD2 4.24Å |
| 150 | R | 92.3 | Very high | 89.1 | Confident | 162 Ų | 162 | 49.3 Ų | 49.3 | 61% | 0.611 | 27% | 0.27 | S | S | * | . | H | α-helix | trans | -62.7 | -40 | 177.4 | -68.8 | -178 | 79.9 | -122.2 | 1.2 | 112 | I146 T147 C148 A154 I185 | I146-R150 WeakPolarHBondContact O-CG 3.43Å; I146-R150 PolarHBondContact O-N 3.05Å; T147-R150 PolarHBondContact O-N 3.46Å; C148-R150 PolarHBondContact O-N 3.28Å; R150-A154 WeakPolarHBondContact O-CB 3.4Å; R150-A154 PolarHBondContact O-N 3.26Å; R150-I185 HydrophobicContact CG-CD1 4.24Å; R150-I185 HydrophobicContact CG-CG2 4.21Å |
| 151 | I | 92.9 | Very high | 88.9 | Confident | 23 Ų | 23 | 46.7 Ų | 46.7 | 12% | 0.118 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -62.1 | -48 | 176.4 | -71.7 | 162.8 | 0 | 0 | 0 | 110.5 | A89 L92 L93 L96 T147 C148 L149 A154 H155 | A89-I151 HydrophobicContact CB-CD1 4.17Å; L92-I151 HydrophobicContact CD2-CG2 4.41Å; L92-I151 HydrophobicContact CG-CG2 4.48Å; L93-I151 HydrophobicContact CB-CD1 4.17Å; L93-I151 HydrophobicContact CB-CG2 4.3Å; L93-I151 HydrophobicContact CD1-CG2 4.07Å; L96-I151 HydrophobicContact CD1-CG2 3.46Å; L96-I151 VanDerWaalsContact CD1-CG2 3.46Å; T147-I151 HydrophobicContact CG2-CD1 3.79Å; T147-I151 HydrophobicContact CG2-CG1 4.42Å; T147-I151 WeakPolarHBondContact O-CB 3.17Å; T147-I151 WeakPolarHBondContact O-CD1 3.48Å; T147-I151 VanDerWaalsContact O-CG1 3.26Å; T147-I151 WeakPolarHBondContact O-CG1 3.26Å; T147-I151 PolarHBondContact O-N 3.46Å; C148-I151 PolarHBondContact O-N 3.23Å; L149-I151 VanDerWaalsContact C-N 3.33Å; L149-I151 PolarHBondContact O-N 3.05Å; I151-A154 PolarHBondContact O-N 3.38Å; I151-H155 PolarHBondContact O-N 2.98Å; I151-H155 VanDerWaalsContact O-N 3.09Å; I151-H155 PolarHBondContact O-ND1 3.39Å |
| 152 | L | 91.8 | Very high | 88.7 | Confident | 0 Ų | 0 | 47.6 Ų | 47.6 | 0% | 0 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -59.8 | -48 | 178.1 | -76.8 | -177.9 | 0 | 0 | 0 | 112.1 | I80 L92 L96 P102 T112 L113 I116 C148 L149 A154 H155 G156 A157 | I80-L152 HydrophobicContact CD1-CD2 4.41Å; L92-L152 HydrophobicContact CD1-CD2 4.22Å; L92-L152 HydrophobicContact CD2-CD2 4.33Å; L92-L152 HydrophobicContact CD2-CG 4.1Å; L96-L152 HydrophobicContact CD1-CD2 4.22Å; P102-L152 HydrophobicContact CB-CD2 4.3Å; T112-L152 HydrophobicContact CG2-CD1 3.9Å; T112-L152 HydrophobicContact CG2-CD2 3.86Å; L113-L152 HydrophobicContact CB-CD1 4.25Å; I116-L152 HydrophobicContact CD1-CD1 3.35Å; I116-L152 HydrophobicContact CD1-CG 4.2Å; I116-L152 HydrophobicContact CG1-CD1 4.1Å; C148-L152 PolarHBondContact O-N 2.98Å; L149-L152 PolarHBondContact O-N 3.03Å; L152-A154 VanDerWaalsContact C-N 3.29Å; L152-A154 PolarHBondContact O-N 3.45Å; L152-H155 CarbonylContact O-C 3.46Å; L152-H155 PolarHBondContact O-N 3.31Å; L152-H155 VanDerWaalsContact O-N 3.11Å; L152-G156 PolarHBondContact O-N 3.08Å; L152-A157 HydrophobicContact CB-CB 3.97Å; L152-A157 VanDerWaalsContact O-CB 3.23Å; L152-A157 WeakPolarHBondContact O-CB 3.28Å; L152-A157 PolarHBondContact O-N 2.81Å; L152-A157 VanDerWaalsContact O-N 3.13Å |
| 153 | C | 90.9 | Very high | 87.9 | Confident | 13 Ų | 13 | 45.9 Ų | 45.9 | 9% | 0.088 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -60.1 | -40.9 | 178 | -68.9 | 0 | 0 | 0 | 0 | 111.6 | L149 H155 G156 N189 | L149-C153 PolarHBondContact O-N 3.15Å; L149-C153 PolarHBondContact O-SG 3.11Å; L149-C153 VanDerWaalsContact O-SG 3.38Å; C153-H155 PolarHBondContact O-N 2.8Å; C153-G156 PolarHBondContact O-N 3.12Å; C153-N189 HydrophobicContact CB-CB 4.17Å; C153-N189 WeakPolarHBondContact CB-OD1 3.34Å |
| 154 | A | 91.3 | Very high | 86.8 | Confident | 80 Ų | 80 | 48.6 Ų | 48.6 | 66% | 0.661 | 27% | 0.267 | S | S | * | . | H | α-helix | trans | -66.4 | -23.9 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113.8 | R150 I151 L152 | R150-A154 WeakPolarHBondContact O-CB 3.4Å; R150-A154 PolarHBondContact O-N 3.26Å; I151-A154 PolarHBondContact O-N 3.38Å; L152-A154 VanDerWaalsContact C-N 3.29Å; L152-A154 PolarHBondContact O-N 3.45Å |
| 155 | H | 91.1 | Very high | 85.5 | Confident | 75 Ų | 75 | 49.8 Ų | 49.8 | 35% | 0.347 | 28% | 0.28 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -99.9 | 23.1 | 177.9 | -67.3 | 73.8 | 0 | 0 | 0 | 112.7 | L96 I151 L152 C153 | L96-H155 HydrophobicContact CD1-CB 4.02Å; L96-H155 HydrophobicContact CD2-CB 4.01Å; L96-H155 HydrophobicContact CG-CB 4.41Å; I151-H155 PolarHBondContact O-N 2.98Å; I151-H155 VanDerWaalsContact O-N 3.09Å; I151-H155 PolarHBondContact O-ND1 3.39Å; L152-H155 CarbonylContact O-C 3.46Å; L152-H155 PolarHBondContact O-N 3.31Å; L152-H155 VanDerWaalsContact O-N 3.11Å; C153-H155 PolarHBondContact O-N 2.8Å |
| 156 | G | 85.4 | Confident | 84.4 | Confident | 48 Ų | 48 | 53 Ų | 53 | 50% | 0.495 | 30% | 0.297 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 85 | 17.3 | 168.3 | 0 | 0 | 0 | 0 | 0 | 115.7 | L152 C153 Q158 | L152-G156 PolarHBondContact O-N 3.08Å; C153-G156 PolarHBondContact O-N 3.12Å; G156-Q158 PolarHBondContact O-N 2.9Å |
| 157 | A | 88.9 | Confident | 83.8 | Confident | 9 Ų | 9 | 56.5 Ų | 56.5 | 7% | 0.074 | 31% | 0.311 | C | S | . | . | trans | -59.1 | 133.7 | 173.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | P102 E103 L113 L152 V159 | P102-A157 HydrophobicContact CB-CB 4.12Å; E103-A157 WeakPolarHBondContact OE1-CA 3.37Å; L113-A157 HydrophobicContact CD1-CB 4.06Å; L152-A157 HydrophobicContact CB-CB 3.97Å; L152-A157 VanDerWaalsContact O-CB 3.23Å; L152-A157 WeakPolarHBondContact O-CB 3.28Å; L152-A157 PolarHBondContact O-N 2.81Å; L152-A157 VanDerWaalsContact O-N 3.13Å; A157-V159 PolarHBondContact O-N 2.88Å | ||
| 158 | Q | 88.9 | Confident | 83.4 | Confident | 111 Ų | 111 | 58.3 Ų | 58.3 | 52% | 0.519 | 31% | 0.312 | S | S | . | . | trans | -74 | 96.8 | -177.7 | -67.1 | -67.8 | -16.9 | 0 | 0 | 111 | E103 G156 N160 A161 | E103-Q158 VanDerWaalsContact CD-CG 3.48Å; E103-Q158 HydrophobicContact CG-CG 4.07Å; E103-Q158 PolarHBondContact OE1-N 2.63Å; E103-Q158 WeakPolarHBondContact OE2-CB 3.37Å; G156-Q158 PolarHBondContact O-N 2.9Å; Q158-N160 PolarHBondContact O-N 3.43Å; Q158-N160 VanDerWaalsContact O-N 3.12Å; Q158-A161 HydrophobicContact CB-CB 3.89Å; Q158-A161 WeakPolarHBondContact O-CB 3.37Å; Q158-A161 PolarHBondContact O-N 3.34Å | ||
| 159 | V | 89.1 | Confident | 83.2 | Confident | 11 Ų | 11 | 58.4 Ų | 58.4 | 7% | 0.067 | 31% | 0.312 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -67 | -11.5 | -179.3 | -62 | 0 | 0 | 0 | 0 | 114.4 | L113 A157 P170 L186 N189 A191 | L113-V159 HydrophobicContact CD1-CG1 4.24Å; A157-V159 PolarHBondContact O-N 2.88Å; V159-P170 WeakPolarHBondContact O-CD 3.33Å; V159-P170 WeakPolarHBondContact O-CG 3.19Å; V159-L186 HydrophobicContact CB-CD2 4.38Å; V159-L186 HydrophobicContact CG1-CD2 4.15Å; V159-N189 HydrophobicContact CG1-CB 4.05Å; V159-N189 WeakPolarHBondContact CG2-O 3.44Å; V159-A191 HydrophobicContact CB-CB 4.29Å; V159-A191 HydrophobicContact CG2-CB 4.2Å |
| 160 | N | 87.3 | Confident | 83.1 | Confident | 68 Ų | 68 | 58.5 Ų | 58.5 | 36% | 0.364 | 31% | 0.313 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -110.4 | 1.3 | 179.5 | -68.3 | -40.4 | 0 | 0 | 0 | 113.6 | Q158 Q162 G190 A191 D192 | Q158-N160 PolarHBondContact O-N 3.43Å; Q158-N160 VanDerWaalsContact O-N 3.12Å; N160-Q162 PolarHBondContact O-N 2.92Å; N160-Q162 VanDerWaalsContact O-N 3.16Å; N160-G190 PolarHBondContact ND2-O 3.05Å; N160-A191 VanDerWaalsContact OD1-CA 3.29Å; N160-A191 WeakPolarHBondContact OD1-CA 3.47Å; N160-D192 PolarHBondContact OD1-N 3.13Å |
| 161 | A | 81.1 | Confident | 83 | Confident | 22 Ų | 22 | 50.9 Ų | 50.9 | 18% | 0.182 | 28% | 0.284 | C | S | . | . | P | Polyproline II helix | trans | -59 | 121.1 | 179.8 | 0 | 0 | 0 | 0 | 0 | 110.8 | Q158 | Q158-A161 HydrophobicContact CB-CB 3.89Å; Q158-A161 WeakPolarHBondContact O-CB 3.37Å; Q158-A161 PolarHBondContact O-N 3.34Å |
| 162 | Q | 77.6 | Confident | 82.9 | Confident | 87 Ų | 87 | 49.8 Ų | 49.8 | 41% | 0.407 | 28% | 0.279 | S | S | . | . | P | Polyproline II helix | trans | -85.9 | 132.7 | 175.4 | -67.3 | -173.5 | -9.3 | 0 | 0 | 109.4 | N160 | N160-Q162 PolarHBondContact O-N 2.92Å; N160-Q162 VanDerWaalsContact O-N 3.16Å |
| 163 | G | 67.6 | Low | 82.8 | Confident | 14 Ų | 14 | 50.1 Ų | 50.1 | 14% | 0.144 | 28% | 0.28 | C | S | . | . | P | Polyproline II helix | trans | -69.5 | 145.7 | 172.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | S165 K167 | G163-S165 VanDerWaalsContact C-N 3.28Å; G163-S165 PolarHBondContact O-N 3.35Å; G163-K167 PolarHBondContact O-N 2.84Å |
| 164 | E | 63.3 | Low | 82.7 | Confident | 143 Ų | 143 | 49.5 Ų | 49.5 | 67% | 0.668 | 28% | 0.276 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63 | -29.5 | -173 | -70.3 | 176.6 | -170.5 | 0 | 0 | 113.8 | R105 | R105-E164 IonicContact CZ-OE1 2.7Å; R105-E164 IonicContact NH1-OE1 3.9Å; R105-E164 PolarHBondContact NH1-OE1 3.48Å |
| 165 | S | 62.1 | Low | 82.5 | Confident | 86 Ų | 86 | 45.7 Ų | 45.7 | 60% | 0.601 | 25% | 0.245 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -96.7 | -10.5 | -170.7 | 62.9 | 0 | 0 | 0 | 0 | 116.3 | G163 | G163-S165 VanDerWaalsContact C-N 3.28Å; G163-S165 PolarHBondContact O-N 3.35Å |
| 166 | N | 66 | Low | 82.3 | Confident | 67 Ų | 67 | 44.1 Ų | 44.1 | 36% | 0.358 | 25% | 0.245 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -147 | 0.8 | -173.5 | -77.5 | -79.2 | 0 | 0 | 0 | 115 | R168 E198 | N166-R168 HydrophobicContact CB-CB 4.44Å; N166-R168 HydrophobicContact CB-CG 3.99Å; N166-R168 PolarHBondContact O-N 3.39Å; N166-E198 VanDerWaalsContact C-CG 3.5Å; N166-E198 WeakPolarHBondContact CA-OE1 3.19Å; N166-E198 PolarHBondContact N-OE1 3.43Å; N166-E198 WeakPolarHBondContact O-CG 3.38Å |
| 167 | K | 78 | Confident | 82.2 | Confident | 114 Ų | 114 | 46.1 Ų | 46.1 | 50% | 0.496 | 24% | 0.238 | S | C | . | . | trans | 42.9 | 23.3 | -168.1 | -57.4 | -176.4 | 179.4 | -178.9 | 0 | 115.2 | G163 S169 E198 | G163-K167 PolarHBondContact O-N 2.84Å; K167-S169 PolarHBondContact O-N 3.27Å; K167-E198 HydrophobicContact CB-CG 3.9Å; K167-E198 HydrophobicContact CD-CG 4.07Å; K167-E198 HydrophobicContact CG-CG 3.8Å; K167-E198 PolarHBondContact N-OE1 3.15Å | ||
| 168 | R | 82.5 | Confident | 81.7 | Confident | 92 Ų | 92 | 47.2 Ų | 47.2 | 35% | 0.347 | 25% | 0.25 | S | C | . | . | trans | -76.7 | 115.4 | -178.3 | -77.5 | 177.9 | -175.7 | 169.4 | 2.3 | 109.1 | K114 N166 H172 L173 N197 | K114-R168 PolarHBondContact NZ-O 2.88Å; N166-R168 HydrophobicContact CB-CB 4.44Å; N166-R168 HydrophobicContact CB-CG 3.99Å; N166-R168 PolarHBondContact O-N 3.39Å; R168-H172 HydrophobicContact CB-CB 4.05Å; R168-H172 HydrophobicContact CG-CB 4.16Å; R168-L173 HydrophobicContact CB-CD2 4.46Å; R168-N197 HydrophobicContact CG-CB 4.24Å | ||
| 169 | S | 88.1 | Confident | 81.4 | Confident | 2 Ų | 2 | 42 Ų | 42 | 1% | 0.014 | 23% | 0.226 | C | C | . | . | trans | -62.1 | 161.9 | 167 | 75.6 | 0 | 0 | 0 | 0 | 111.2 | K167 L171 H172 L173 | K167-S169 PolarHBondContact O-N 3.27Å; S169-L171 PolarHBondContact O-N 3.32Å; S169-H172 PolarHBondContact N-ND1 3.02Å; S169-H172 WeakPolarHBondContact O-CB 3.45Å; S169-H172 PolarHBondContact O-N 3.31Å; S169-H172 PolarHBondContact OG-ND1 3.22Å; S169-L173 PolarHBondContact O-N 2.95Å | ||
| 170 | P | 88.3 | Confident | 81 | Confident | 2 Ų | 2 | 46 Ų | 46 | 1% | 0.013 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -50.1 | -41.1 | 171.3 | -36.4 | 43.9 | 0 | 0 | 0 | 114.4 | L113 L117 V159 H172 L173 A174 L186 | L113-P170 HydrophobicContact CD2-CB 3.56Å; L113-P170 HydrophobicContact CD2-CG 3.47Å; L113-P170 VanDerWaalsContact CD2-CG 3.47Å; L117-P170 HydrophobicContact CD1-CB 3.76Å; L117-P170 WeakPolarHBondContact CD1-O 3.43Å; V159-P170 WeakPolarHBondContact O-CD 3.33Å; V159-P170 WeakPolarHBondContact O-CG 3.19Å; P170-H172 VanDerWaalsContact C-N 3.32Å; P170-H172 PolarHBondContact O-N 3.02Å; P170-L173 PolarHBondContact O-N 3.08Å; P170-L173 VanDerWaalsContact O-N 3.13Å; P170-A174 PolarHBondContact O-N 2.87Å; P170-L186 HydrophobicContact CB-CD1 3.7Å; P170-L186 HydrophobicContact CB-CD2 4.19Å |
| 171 | L | 91.3 | Very high | 80.8 | Confident | 2 Ų | 2 | 45.5 Ų | 45.5 | 1% | 0.01 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -60.4 | -38.8 | 175.6 | -76.9 | 173.8 | 0 | 0 | 0 | 112.8 | S169 L173 A174 I175 L183 L186 A191 V193 P203 | S169-L171 PolarHBondContact O-N 3.32Å; L171-L173 VanDerWaalsContact C-N 3.31Å; L171-L173 PolarHBondContact O-N 3.44Å; L171-A174 PolarHBondContact O-N 3.13Å; L171-I175 WeakPolarHBondContact O-CG1 3.41Å; L171-I175 PolarHBondContact O-N 3.43Å; L171-L183 HydrophobicContact CD2-CD2 3.78Å; L171-L186 HydrophobicContact CD2-CB 3.82Å; L171-L186 HydrophobicContact CD2-CD1 4.02Å; L171-L186 HydrophobicContact CG-CB 4.3Å; L171-L186 HydrophobicContact CG-CD1 4.26Å; L171-A191 HydrophobicContact CD1-CB 3.65Å; L171-A191 HydrophobicContact CG-CB 3.91Å; L171-V193 HydrophobicContact CD1-CG2 4.32Å; L171-P203 HydrophobicContact CB-CG 4.03Å |
| 172 | H | 90.9 | Very high | 81.1 | Confident | 0 Ų | 0 | 44.4 Ų | 44.4 | 0% | 0 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -63.8 | -36.1 | 176 | -67.4 | 101.1 | 0 | 0 | 0 | 112.5 | R168 S169 P170 A176 A195 M201 P203 M206 | R168-H172 HydrophobicContact CB-CB 4.05Å; R168-H172 HydrophobicContact CG-CB 4.16Å; S169-H172 PolarHBondContact N-ND1 3.02Å; S169-H172 WeakPolarHBondContact O-CB 3.45Å; S169-H172 PolarHBondContact O-N 3.31Å; S169-H172 PolarHBondContact OG-ND1 3.22Å; P170-H172 VanDerWaalsContact C-N 3.32Å; P170-H172 PolarHBondContact O-N 3.02Å; H172-A176 PolarHBondContact O-N 3.15Å; H172-A176 VanDerWaalsContact O-N 3.13Å; H172-A195 PolarHBondContact CE1-O 3.25Å; H172-A195 PolarHBondContact NE2-O 2.94Å; H172-M201 PolarHBondContact NE2-O 3.18Å; H172-P203 WeakPolarHBondContact NE2-CD 3.49Å; H172-M206 HydrophobicContact CB-SD 4.15Å; H172-M206 VanDerWaalsContact CD2-SD 3.54Å |
| 173 | L | 88.3 | Confident | 81.6 | Confident | 6 Ų | 6 | 40.4 Ų | 40.4 | 3% | 0.031 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -68.8 | -44.5 | 174.3 | -69 | -167.3 | 0 | 0 | 0 | 112 | K114 L117 L118 R168 S169 P170 L171 I175 A176 Y177 | K114-L173 HydrophobicContact CD-CD1 3.3Å; K114-L173 HydrophobicContact CD-CG 4.12Å; K114-L173 HydrophobicContact CG-CD1 3.91Å; K114-L173 VanDerWaalsContact NZ-CD1 3.29Å; L117-L173 HydrophobicContact CB-CB 4.14Å; L117-L173 HydrophobicContact CB-CD1 3.7Å; L117-L173 HydrophobicContact CD1-CB 4.14Å; L117-L173 HydrophobicContact CD1-CD1 4.21Å; L118-L173 HydrophobicContact CD2-CD1 4.28Å; L118-L173 HydrophobicContact CG-CD1 4.34Å; R168-L173 HydrophobicContact CB-CD2 4.46Å; S169-L173 PolarHBondContact O-N 2.95Å; P170-L173 PolarHBondContact O-N 3.08Å; P170-L173 VanDerWaalsContact O-N 3.13Å; L171-L173 VanDerWaalsContact C-N 3.31Å; L171-L173 PolarHBondContact O-N 3.44Å; L173-I175 PolarHBondContact O-N 3.13Å; L173-A176 PolarHBondContact O-N 3.47Å; L173-Y177 HydrophobicContact CB-CD2 4.16Å; L173-Y177 HydrophobicContact CB-CE2 4.28Å; L173-Y177 HydrophobicContact CD2-CE2 4.18Å; L173-Y177 WeakPolarHBondContact O-CD2 3.45Å; L173-Y177 PolarHBondContact O-N 2.96Å |
| 174 | A | 88.9 | Confident | 82.6 | Confident | 0 Ų | 0 | 41.3 Ų | 41.3 | 0% | 0 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -54.4 | -38.3 | -179.8 | 0 | 0 | 0 | 0 | 0 | 111.1 | P170 L171 G178 C179 V182 L183 | P170-A174 PolarHBondContact O-N 2.87Å; L171-A174 PolarHBondContact O-N 3.13Å; A174-G178 PolarHBondContact O-N 3.35Å; A174-C179 HydrophobicContact CB-CB 4.32Å; A174-C179 PolarHBondContact O-N 3.36Å; A174-V182 HydrophobicContact CB-CB 4.06Å; A174-V182 HydrophobicContact CB-CG1 3.59Å; A174-L183 HydrophobicContact CB-CD2 3.66Å; A174-L183 HydrophobicContact CB-CG 4.4Å |
| 175 | I | 89 | Confident | 83.9 | Confident | 0 Ų | 0 | 35.2 Ų | 35.2 | 0% | 0 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -68.9 | -48 | 174.2 | -65 | 174.3 | 0 | 0 | 0 | 111.8 | L171 L173 Y177 G178 L183 P203 M206 A207 M210 M215 L219 | L171-I175 WeakPolarHBondContact O-CG1 3.41Å; L171-I175 PolarHBondContact O-N 3.43Å; L173-I175 PolarHBondContact O-N 3.13Å; I175-Y177 PolarHBondContact O-N 3.41Å; I175-G178 PolarHBondContact O-N 3.42Å; I175-L183 HydrophobicContact CG1-CD2 3.89Å; I175-P203 VanDerWaalsContact CD1-CA 3.5Å; I175-P203 HydrophobicContact CD1-CB 3.44Å; I175-P203 VanDerWaalsContact CD1-CB 3.44Å; I175-P203 WeakPolarHBondContact CD1-O 3.12Å; I175-M206 HydrophobicContact CG2-CB 3.86Å; I175-A207 HydrophobicContact CG2-CB 4.45Å; I175-M210 HydrophobicContact CG2-SD 3.83Å; I175-M215 HydrophobicContact CB-SD 4.19Å; I175-M215 HydrophobicContact CG1-SD 4.21Å; I175-M215 HydrophobicContact CG2-SD 3.85Å; I175-L219 HydrophobicContact CD1-CD1 3.61Å; I175-L219 HydrophobicContact CD1-CD2 4.36Å |
| 176 | A | 86.6 | Confident | 85.3 | Confident | 43 Ų | 43 | 31.1 Ų | 31.1 | 36% | 0.355 | 16% | 0.16 | S | C | . | . | H | α-helix | trans | -57.9 | -33.1 | -179.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | H172 L173 M206 | H172-A176 PolarHBondContact O-N 3.15Å; H172-A176 VanDerWaalsContact O-N 3.13Å; L173-A176 PolarHBondContact O-N 3.47Å; A176-M206 HydrophobicContact CB-CE 4.22Å |
| 177 | Y | 82.3 | Confident | 86.4 | Confident | 90 Ų | 90 | 29 Ų | 29 | 35% | 0.353 | 15% | 0.153 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -97.8 | 0.7 | -178.6 | -68 | -67.8 | 0 | 0 | 0 | 115.1 | L117 L118 L173 I175 C179 | L117-Y177 WeakPolarHBondContact O-CD2 3.28Å; L118-Y177 HydrophobicContact CD2-CE2 3.85Å; L118-Y177 WeakPolarHBondContact CD2-OH 3.43Å; L173-Y177 HydrophobicContact CB-CD2 4.16Å; L173-Y177 HydrophobicContact CB-CE2 4.28Å; L173-Y177 HydrophobicContact CD2-CE2 4.18Å; L173-Y177 WeakPolarHBondContact O-CD2 3.45Å; L173-Y177 PolarHBondContact O-N 2.96Å; I175-Y177 PolarHBondContact O-N 3.41Å; Y177-C179 VanDerWaalsContact CB-SG 3.5Å |
| 178 | G | 79.8 | Confident | 87 | Confident | 31 Ų | 31 | 31.1 Ų | 31.1 | 32% | 0.32 | 16% | 0.164 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 81.8 | 17.3 | 177.1 | 0 | 0 | 0 | 0 | 0 | 115 | A174 I175 Y180 M215 | A174-G178 PolarHBondContact O-N 3.35Å; I175-G178 PolarHBondContact O-N 3.42Å; G178-Y180 VanDerWaalsContact O-CD2 3.3Å; G178-Y180 WeakPolarHBondContact O-CD2 3.41Å; G178-Y180 WeakPolarHBondContact O-CE2 3.48Å; G178-Y180 PolarHBondContact O-N 3.46Å; G178-M215 VanDerWaalsContact C-CE 3.43Å |
| 179 | C | 81.5 | Confident | 87.4 | Confident | 1 Ų | 1 | 30.1 Ų | 30.1 | 1% | 0.007 | 17% | 0.166 | C | C | . | . | trans | -89.2 | 80.8 | -166.2 | -50.5 | 0 | 0 | 0 | 0 | 112.8 | W120 A174 Y177 V182 | W120-C179 HydrophobicContact CD2-CB 4.37Å; W120-C179 HydrophobicContact CG-CB 4.27Å; A174-C179 HydrophobicContact CB-CB 4.32Å; A174-C179 PolarHBondContact O-N 3.36Å; Y177-C179 VanDerWaalsContact CB-SG 3.5Å; C179-V182 HydrophobicContact CB-CB 3.83Å; C179-V182 HydrophobicContact CB-CG2 3.61Å; C179-V182 WeakPolarHBondContact O-CB 3.43Å; C179-V182 PolarHBondContact O-N 3.09Å | ||
| 180 | Y | 80.8 | Confident | 87.4 | Confident | 96 Ų | 96 | 32.4 Ų | 32.4 | 38% | 0.376 | 19% | 0.19 | S | C | . | . | H | α-helix | trans | -58.6 | -47.8 | -178 | -50.7 | -85.7 | 0 | 0 | 0 | 115 | G178 V182 L183 N212 E214 M215 | G178-Y180 VanDerWaalsContact O-CD2 3.3Å; G178-Y180 WeakPolarHBondContact O-CD2 3.41Å; G178-Y180 WeakPolarHBondContact O-CE2 3.48Å; G178-Y180 PolarHBondContact O-N 3.46Å; Y180-V182 PolarHBondContact O-N 3.21Å; Y180-L183 PolarHBondContact O-N 3.32Å; Y180-N212 WeakPolarHBondContact CE1-OD1 3.35Å; Y180-N212 PolarHBondContact OH-ND2 3.48Å; Y180-E214 HydrophobicContact CD1-CB 4.01Å; Y180-E214 HydrophobicContact CE1-CB 3.66Å; Y180-M215 HydrophobicContact CD1-CE 4.38Å; Y180-M215 HydrophobicContact CD1-CG 3.81Å; Y180-M215 HydrophobicContact CE1-CE 4.13Å; Y180-M215 HydrophobicContact CE1-CG 3.59Å |
| 181 | P | 82.9 | Confident | 87.7 | Confident | 57 Ų | 57 | 32.8 Ų | 32.8 | 37% | 0.37 | 19% | 0.193 | S | C | . | . | H | α-helix | trans | -65.5 | -25.1 | -177.5 | -21 | 34.6 | 0 | 0 | 0 | 112.9 | I146 L183 S184 I185 | I146-P181 HydrophobicContact CD1-CB 4.1Å; I146-P181 HydrophobicContact CD1-CG 4.4Å; I146-P181 HydrophobicContact CG1-CB 4.41Å; P181-L183 VanDerWaalsContact C-N 3.33Å; P181-S184 PolarHBondContact O-OG 3.33Å; P181-I185 WeakPolarHBondContact O-CD1 3.46Å; P181-I185 VanDerWaalsContact O-CG1 3.3Å; P181-I185 WeakPolarHBondContact O-CG1 3.32Å; P181-I185 PolarHBondContact O-N 3.32Å |
| 182 | V | 87 | Confident | 87.8 | Confident | 0 Ų | 0 | 36.4 Ų | 36.4 | 0% | 0 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -68.4 | -35.2 | 179.3 | 174 | 0 | 0 | 0 | 0 | 111.1 | L117 W120 L149 A174 C179 Y180 S184 I185 L186 | L117-V182 HydrophobicContact CD2-CB 4.47Å; L117-V182 HydrophobicContact CD2-CG1 3.48Å; L117-V182 VanDerWaalsContact CD2-CG1 3.48Å; L117-V182 HydrophobicContact CD2-CG2 4.2Å; W120-V182 HydrophobicContact CD2-CG2 3.91Å; W120-V182 HydrophobicContact CE3-CG2 3.72Å; W120-V182 HydrophobicContact CH2-CG2 3.28Å; W120-V182 HydrophobicContact CZ2-CG2 3.49Å; W120-V182 VanDerWaalsContact CZ2-CG2 3.49Å; W120-V182 HydrophobicContact CZ3-CG2 3.41Å; W120-V182 VanDerWaalsContact CZ3-CG2 3.41Å; L149-V182 HydrophobicContact CD2-CB 4.18Å; L149-V182 HydrophobicContact CD2-CG1 3.85Å; L149-V182 HydrophobicContact CD2-CG2 3.95Å; A174-V182 HydrophobicContact CB-CB 4.06Å; A174-V182 HydrophobicContact CB-CG1 3.59Å; C179-V182 HydrophobicContact CB-CB 3.83Å; C179-V182 HydrophobicContact CB-CG2 3.61Å; C179-V182 WeakPolarHBondContact O-CB 3.43Å; C179-V182 PolarHBondContact O-N 3.09Å; Y180-V182 PolarHBondContact O-N 3.21Å; V182-S184 PolarHBondContact O-N 2.94Å; V182-I185 PolarHBondContact O-N 3.27Å; V182-L186 HydrophobicContact CG1-CD1 3.53Å; V182-L186 HydrophobicContact CG1-CG 3.88Å; V182-L186 WeakPolarHBondContact O-CB 3.18Å; V182-L186 WeakPolarHBondContact O-CG 3.49Å; V182-L186 PolarHBondContact O-N 3.17Å |
| 183 | L | 88.8 | Confident | 88 | Confident | 2 Ų | 2 | 37 Ų | 37 | 1% | 0.01 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -60.7 | -46.5 | -178.2 | -63.5 | 177.1 | 0 | 0 | 0 | 111.5 | L171 A174 I175 Y180 P181 A187 M215 M218 L219 | L171-L183 HydrophobicContact CD2-CD2 3.78Å; A174-L183 HydrophobicContact CB-CD2 3.66Å; A174-L183 HydrophobicContact CB-CG 4.4Å; I175-L183 HydrophobicContact CG1-CD2 3.89Å; Y180-L183 PolarHBondContact O-N 3.32Å; P181-L183 VanDerWaalsContact C-N 3.33Å; L183-A187 VanDerWaalsContact O-CB 3.27Å; L183-A187 WeakPolarHBondContact O-CB 3.5Å; L183-A187 PolarHBondContact O-N 2.87Å; L183-M215 HydrophobicContact CD1-CB 4.25Å; L183-M215 HydrophobicContact CD1-CG 3.99Å; L183-M218 HydrophobicContact CD1-CB 4.49Å; L183-L219 HydrophobicContact CD2-CD2 4.46Å |
| 184 | S | 88.1 | Confident | 88.2 | Confident | 33 Ų | 33 | 39.2 Ų | 39.2 | 23% | 0.231 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -67.6 | -40.9 | 178.6 | 55.4 | 0 | 0 | 0 | 0 | 112.1 | P181 V182 A187 Q188 | P181-S184 PolarHBondContact O-OG 3.33Å; V182-S184 PolarHBondContact O-N 2.94Å; S184-A187 PolarHBondContact O-N 3Å; S184-Q188 WeakPolarHBondContact O-CB 3.45Å; S184-Q188 WeakPolarHBondContact O-CG 3.35Å; S184-Q188 PolarHBondContact O-N 3.29Å |
| 185 | I | 90.6 | Very high | 88.5 | Confident | 15 Ų | 15 | 39.6 Ų | 39.6 | 8% | 0.077 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -63.6 | -48.8 | 178.6 | -64.8 | 164.8 | 0 | 0 | 0 | 110.6 | I146 L149 R150 P181 V182 A187 Q188 N189 | I146-I185 HydrophobicContact CG2-CD1 3.83Å; L149-I185 HydrophobicContact CD2-CB 4.05Å; L149-I185 HydrophobicContact CD2-CD1 4.09Å; L149-I185 HydrophobicContact CD2-CG2 3.8Å; L149-I185 HydrophobicContact CG-CG2 3.97Å; R150-I185 HydrophobicContact CG-CD1 4.24Å; R150-I185 HydrophobicContact CG-CG2 4.21Å; P181-I185 WeakPolarHBondContact O-CD1 3.46Å; P181-I185 VanDerWaalsContact O-CG1 3.3Å; P181-I185 WeakPolarHBondContact O-CG1 3.32Å; P181-I185 PolarHBondContact O-N 3.32Å; V182-I185 PolarHBondContact O-N 3.27Å; I185-A187 PolarHBondContact O-N 3.36Å; I185-Q188 PolarHBondContact O-N 3.39Å; I185-N189 PolarHBondContact O-N 2.86Å; I185-N189 PolarHBondContact O-ND2 2.97Å |
| 186 | L | 91.7 | Very high | 88.6 | Confident | 0 Ų | 0 | 43.5 Ų | 43.5 | 0% | 0 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -62.9 | -44.5 | 179.3 | -71.2 | 178 | 0 | 0 | 0 | 111.3 | L113 L117 L149 V159 P170 L171 V182 Q188 N189 G190 A191 | L113-L186 HydrophobicContact CD1-CD2 4.39Å; L117-L186 HydrophobicContact CD1-CD1 4.42Å; L149-L186 HydrophobicContact CD1-CD2 4.24Å; V159-L186 HydrophobicContact CB-CD2 4.38Å; V159-L186 HydrophobicContact CG1-CD2 4.15Å; P170-L186 HydrophobicContact CB-CD1 3.7Å; P170-L186 HydrophobicContact CB-CD2 4.19Å; L171-L186 HydrophobicContact CD2-CB 3.82Å; L171-L186 HydrophobicContact CD2-CD1 4.02Å; L171-L186 HydrophobicContact CG-CB 4.3Å; L171-L186 HydrophobicContact CG-CD1 4.26Å; V182-L186 HydrophobicContact CG1-CD1 3.53Å; V182-L186 HydrophobicContact CG1-CG 3.88Å; V182-L186 WeakPolarHBondContact O-CB 3.18Å; V182-L186 WeakPolarHBondContact O-CG 3.49Å; V182-L186 PolarHBondContact O-N 3.17Å; L186-Q188 PolarHBondContact O-N 3.09Å; L186-N189 CarbonylContact O-C 3.35Å; L186-N189 PolarHBondContact O-N 3.34Å; L186-N189 VanDerWaalsContact O-N 3.13Å; L186-G190 PolarHBondContact O-N 3.45Å; L186-A191 VanDerWaalsContact C-CB 3.49Å; L186-A191 HydrophobicContact CB-CB 3.91Å; L186-A191 WeakPolarHBondContact O-CB 3.39Å; L186-A191 PolarHBondContact O-N 2.71Å |
| 187 | A | 89.7 | Confident | 88.8 | Confident | 24 Ų | 24 | 42 Ų | 42 | 20% | 0.198 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -61.3 | -43.3 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | L183 S184 I185 N189 G190 V193 C222 | L183-A187 VanDerWaalsContact O-CB 3.27Å; L183-A187 WeakPolarHBondContact O-CB 3.5Å; L183-A187 PolarHBondContact O-N 2.87Å; S184-A187 PolarHBondContact O-N 3Å; I185-A187 PolarHBondContact O-N 3.36Å; A187-N189 PolarHBondContact O-N 3.28Å; A187-G190 PolarHBondContact O-N 3.32Å; A187-G190 VanDerWaalsContact O-N 3.11Å; A187-V193 HydrophobicContact CB-CG2 4.46Å; A187-C222 HydrophobicContact CB-CB 3.91Å; A187-C222 VanDerWaalsContact CB-SG 3.59Å |
| 188 | Q | 89.9 | Confident | 89.2 | Confident | 158 Ų | 158 | 42.5 Ų | 42.5 | 74% | 0.738 | 24% | 0.242 | S | C | * | . | H | α-helix | trans | -61.9 | -25.8 | 175.9 | -75.5 | 170.4 | 2.1 | 0 | 0 | 113.3 | S184 I185 L186 G190 | S184-Q188 WeakPolarHBondContact O-CB 3.45Å; S184-Q188 WeakPolarHBondContact O-CG 3.35Å; S184-Q188 PolarHBondContact O-N 3.29Å; I185-Q188 PolarHBondContact O-N 3.39Å; L186-Q188 PolarHBondContact O-N 3.09Å; Q188-G190 VanDerWaalsContact C-N 3.35Å |
| 189 | N | 90.8 | Very high | 89.7 | Confident | 71 Ų | 71 | 43.3 Ų | 43.3 | 38% | 0.38 | 25% | 0.246 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -95.7 | 18.3 | 178.3 | -71.7 | -86.2 | 0 | 0 | 0 | 112.9 | C153 V159 I185 L186 A187 | C153-N189 HydrophobicContact CB-CB 4.17Å; C153-N189 WeakPolarHBondContact CB-OD1 3.34Å; V159-N189 HydrophobicContact CG1-CB 4.05Å; V159-N189 WeakPolarHBondContact CG2-O 3.44Å; I185-N189 PolarHBondContact O-N 2.86Å; I185-N189 PolarHBondContact O-ND2 2.97Å; L186-N189 CarbonylContact O-C 3.35Å; L186-N189 PolarHBondContact O-N 3.34Å; L186-N189 VanDerWaalsContact O-N 3.13Å; A187-N189 PolarHBondContact O-N 3.28Å |
| 190 | G | 89.3 | Confident | 90.2 | Very high | 50 Ų | 50 | 44.5 Ų | 44.5 | 52% | 0.515 | 26% | 0.255 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 85.4 | 21.8 | 172.8 | 0 | 0 | 0 | 0 | 0 | 115 | N160 L186 A187 Q188 D192 | N160-G190 PolarHBondContact ND2-O 3.05Å; L186-G190 PolarHBondContact O-N 3.45Å; A187-G190 PolarHBondContact O-N 3.32Å; A187-G190 VanDerWaalsContact O-N 3.11Å; Q188-G190 VanDerWaalsContact C-N 3.35Å; G190-D192 PolarHBondContact O-N 3.13Å |
| 191 | A | 92.9 | Very high | 90.8 | Very high | 9 Ų | 9 | 42.1 Ų | 42.1 | 7% | 0.074 | 25% | 0.247 | C | C | . | . | trans | -64.6 | 134 | 172.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | V159 N160 L171 L186 V193 | V159-A191 HydrophobicContact CB-CB 4.29Å; V159-A191 HydrophobicContact CG2-CB 4.2Å; N160-A191 VanDerWaalsContact OD1-CA 3.29Å; N160-A191 WeakPolarHBondContact OD1-CA 3.47Å; L171-A191 HydrophobicContact CD1-CB 3.65Å; L171-A191 HydrophobicContact CG-CB 3.91Å; L186-A191 VanDerWaalsContact C-CB 3.49Å; L186-A191 HydrophobicContact CB-CB 3.91Å; L186-A191 WeakPolarHBondContact O-CB 3.39Å; L186-A191 PolarHBondContact O-N 2.71Å; A191-V193 PolarHBondContact O-N 3.15Å | ||
| 192 | D | 93.8 | Very high | 91.4 | Very high | 79 Ų | 79 | 39.6 Ų | 39.6 | 42% | 0.422 | 23% | 0.231 | S | C | . | . | trans | -71.9 | 102.1 | 175.4 | 177.3 | 11.9 | 0 | 0 | 0 | 110 | N160 G190 N194 A195 | N160-D192 PolarHBondContact OD1-N 3.13Å; G190-D192 PolarHBondContact O-N 3.13Å; D192-N194 PolarHBondContact O-N 2.87Å; D192-N194 WeakPolarHBondContact OD1-CA 3.23Å; D192-N194 PolarHBondContact OD1-N 3.18Å; D192-A195 HydrophobicContact CB-CB 4.11Å; D192-A195 VanDerWaalsContact CG-N 3.33Å; D192-A195 VanDerWaalsContact O-CB 3.29Å; D192-A195 WeakPolarHBondContact O-CB 3.45Å; D192-A195 PolarHBondContact O-N 3.33Å; D192-A195 VanDerWaalsContact O-N 3.15Å; D192-A195 PolarHBondContact OD1-N 3.39Å; D192-A195 WeakPolarHBondContact OD2-CA 3.48Å; D192-A195 PolarHBondContact OD2-N 3.27Å | ||
| 193 | V | 94.4 | Very high | 91.8 | Very high | 13 Ų | 13 | 39.6 Ų | 39.6 | 8% | 0.079 | 23% | 0.231 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -64.3 | -20.2 | -179.8 | -172.9 | 0 | 0 | 0 | 0 | 112.2 | L171 A187 A191 P203 L219 C222 A224 | L171-V193 HydrophobicContact CD1-CG2 4.32Å; A187-V193 HydrophobicContact CB-CG2 4.46Å; A191-V193 PolarHBondContact O-N 3.15Å; V193-P203 WeakPolarHBondContact O-CD 3.42Å; V193-P203 WeakPolarHBondContact O-CG 3.35Å; V193-L219 HydrophobicContact CG1-CD2 4.09Å; V193-C222 HydrophobicContact CG1-CB 4.37Å; V193-C222 HydrophobicContact CG2-CB 3.97Å; V193-A224 HydrophobicContact CG1-CB 3.65Å |
| 194 | N | 94.5 | Very high | 92.2 | Very high | 52 Ų | 52 | 39.5 Ų | 39.5 | 28% | 0.278 | 23% | 0.23 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -107 | 10.7 | 179.6 | -63.9 | -58.2 | 0 | 0 | 0 | 113.1 | D192 N225 | D192-N194 PolarHBondContact O-N 2.87Å; D192-N194 WeakPolarHBondContact OD1-CA 3.23Å; D192-N194 PolarHBondContact OD1-N 3.18Å; N194-N225 PolarHBondContact OD1-N 3.44Å |
| 195 | A | 93.3 | Very high | 92.6 | Very high | 8 Ų | 8 | 38 Ų | 38 | 7% | 0.066 | 22% | 0.22 | C | C | . | . | trans | -53.1 | 145.7 | 175.1 | 0 | 0 | 0 | 0 | 0 | 110.7 | H172 D192 T202 P203 | H172-A195 PolarHBondContact CE1-O 3.25Å; H172-A195 PolarHBondContact NE2-O 2.94Å; D192-A195 HydrophobicContact CB-CB 4.11Å; D192-A195 VanDerWaalsContact CG-N 3.33Å; D192-A195 VanDerWaalsContact O-CB 3.29Å; D192-A195 WeakPolarHBondContact O-CB 3.45Å; D192-A195 PolarHBondContact O-N 3.33Å; D192-A195 VanDerWaalsContact O-N 3.15Å; D192-A195 PolarHBondContact OD1-N 3.39Å; D192-A195 WeakPolarHBondContact OD2-CA 3.48Å; D192-A195 PolarHBondContact OD2-N 3.27Å; A195-T202 WeakPolarHBondContact O-CA 3.42Å; A195-P203 WeakPolarHBondContact O-CD 3.25Å | ||
| 196 | I | 92.9 | Very high | 92.8 | Very high | 81 Ų | 81 | 38.3 Ų | 38.3 | 42% | 0.415 | 22% | 0.221 | S | C | . | . | trans | -107.4 | 142 | 177.7 | 57.9 | 172.5 | 0 | 0 | 0 | 111.1 | M201 T202 | I196-M201 WeakPolarHBondContact CA-O 3.44Å; I196-T202 HydrophobicContact CG2-CG2 4.01Å | ||
| 197 | N | 90.8 | Very high | 93 | Very high | 11 Ų | 11 | 38.3 Ų | 38.3 | 6% | 0.059 | 22% | 0.221 | C | C | . | . | trans | -89 | -175.8 | 169.3 | 69.9 | 15.3 | 0 | 0 | 0 | 111.8 | R168 A199 S200 M201 | R168-N197 HydrophobicContact CG-CB 4.24Å; N197-A199 VanDerWaalsContact C-N 3.25Å; N197-A199 PolarHBondContact O-N 2.65Å; N197-A199 WeakPolarHBondContact OD1-CA 3.27Å; N197-A199 WeakPolarHBondContact OD1-CB 3.41Å; N197-A199 PolarHBondContact OD1-N 3.24Å; N197-S200 WeakPolarHBondContact O-CA 3.36Å; N197-S200 PolarHBondContact O-N 3.47Å; N197-S200 PolarHBondContact OD1-N 3.22Å; N197-M201 PolarHBondContact N-O 3.19Å; N197-M201 WeakPolarHBondContact OD1-CB 3.3Å; N197-M201 PolarHBondContact OD1-N 3.47Å; N197-M201 PolarHBondContact OD1-O 3.26Å | ||
| 198 | E | 89.6 | Confident | 93.2 | Very high | 101 Ų | 101 | 37.1 Ų | 37.1 | 47% | 0.472 | 21% | 0.212 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -57.4 | -33.5 | 178.1 | -81.4 | 176.1 | -171.8 | 0 | 0 | 114.8 | N166 K167 S200 | N166-E198 VanDerWaalsContact C-CG 3.5Å; N166-E198 WeakPolarHBondContact CA-OE1 3.19Å; N166-E198 PolarHBondContact N-OE1 3.43Å; N166-E198 WeakPolarHBondContact O-CG 3.38Å; K167-E198 HydrophobicContact CB-CG 3.9Å; K167-E198 HydrophobicContact CD-CG 4.07Å; K167-E198 HydrophobicContact CG-CG 3.8Å; K167-E198 PolarHBondContact N-OE1 3.15Å; E198-S200 PolarHBondContact O-N 3.34Å |
| 199 | A | 89.4 | Confident | 93.3 | Very high | 48 Ų | 48 | 33.3 Ų | 33.3 | 40% | 0.397 | 20% | 0.196 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -77.3 | 7.9 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | N197 M201 V230 | N197-A199 VanDerWaalsContact C-N 3.25Å; N197-A199 PolarHBondContact O-N 2.65Å; N197-A199 WeakPolarHBondContact OD1-CA 3.27Å; N197-A199 WeakPolarHBondContact OD1-CB 3.41Å; N197-A199 PolarHBondContact OD1-N 3.24Å; A199-M201 HydrophobicContact CB-CE 3.95Å; A199-M201 HydrophobicContact CB-CG 4.04Å; A199-M201 PolarHBondContact O-N 2.67Å; A199-V230 VanDerWaalsContact O-CG1 3.26Å; A199-V230 WeakPolarHBondContact O-CG1 3.4Å |
| 200 | S | 92.6 | Very high | 93.3 | Very high | 27 Ų | 27 | 34 Ų | 34 | 19% | 0.189 | 20% | 0.198 | C | C | . | . | S | Bend | trans | 57.9 | 26.1 | -172.9 | -53.1 | 0 | 0 | 0 | 0 | 113.4 | N197 E198 | N197-S200 WeakPolarHBondContact O-CA 3.36Å; N197-S200 PolarHBondContact O-N 3.47Å; N197-S200 PolarHBondContact OD1-N 3.22Å; E198-S200 PolarHBondContact O-N 3.34Å |
| 201 | M | 94.7 | Very high | 93.5 | Very high | 45 Ų | 45 | 32 Ų | 32 | 22% | 0.222 | 18% | 0.176 | C | C | . | . | trans | -92.6 | 138.4 | 176.7 | -63.9 | -168.6 | -61.8 | 0 | 0 | 109.7 | H172 I196 N197 A199 H205 M206 V230 | H172-M201 PolarHBondContact NE2-O 3.18Å; I196-M201 WeakPolarHBondContact CA-O 3.44Å; N197-M201 PolarHBondContact N-O 3.19Å; N197-M201 WeakPolarHBondContact OD1-CB 3.3Å; N197-M201 PolarHBondContact OD1-N 3.47Å; N197-M201 PolarHBondContact OD1-O 3.26Å; A199-M201 HydrophobicContact CB-CE 3.95Å; A199-M201 HydrophobicContact CB-CG 4.04Å; A199-M201 PolarHBondContact O-N 2.67Å; M201-H205 HydrophobicContact CB-CB 3.91Å; M201-H205 HydrophobicContact CG-CB 4.29Å; M201-M206 HydrophobicContact CB-CG 4.48Å; M201-M206 HydrophobicContact CE-CG 3.93Å; M201-V230 HydrophobicContact CG-CG1 4.48Å; M201-V230 HydrophobicContact CG-CG2 4.12Å | ||
| 202 | T | 95.6 | Very high | 93.4 | Very high | 4 Ų | 4 | 32.6 Ų | 32.6 | 3% | 0.025 | 18% | 0.177 | C | C | . | . | trans | -82.5 | 165.9 | 167.2 | 70.7 | 0 | 0 | 0 | 0 | 110.9 | A195 I196 L204 H205 M206 C228 | A195-T202 WeakPolarHBondContact O-CA 3.42Å; I196-T202 HydrophobicContact CG2-CG2 4.01Å; T202-L204 PolarHBondContact O-N 3.15Å; T202-L204 PolarHBondContact OG1-N 2.95Å; T202-H205 PolarHBondContact N-ND1 3.42Å; T202-H205 WeakPolarHBondContact O-CB 3.13Å; T202-H205 PolarHBondContact O-N 3.29Å; T202-H205 PolarHBondContact OG1-N 3.16Å; T202-H205 PolarHBondContact OG1-ND1 2.84Å; T202-M206 PolarHBondContact O-N 3.14Å; T202-C228 HydrophobicContact CG2-CB 4.03Å | ||
| 203 | P | 95.3 | Very high | 93.3 | Very high | 0 Ų | 0 | 32.1 Ų | 32.1 | 0% | 0 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -48.2 | -44.4 | 170.2 | -33.1 | 38.2 | 0 | 0 | 0 | 112.8 | L171 H172 I175 V193 A195 H205 M206 A207 L219 | L171-P203 HydrophobicContact CB-CG 4.03Å; H172-P203 WeakPolarHBondContact NE2-CD 3.49Å; I175-P203 VanDerWaalsContact CD1-CA 3.5Å; I175-P203 HydrophobicContact CD1-CB 3.44Å; I175-P203 VanDerWaalsContact CD1-CB 3.44Å; I175-P203 WeakPolarHBondContact CD1-O 3.12Å; V193-P203 WeakPolarHBondContact O-CD 3.42Å; V193-P203 WeakPolarHBondContact O-CG 3.35Å; A195-P203 WeakPolarHBondContact O-CD 3.25Å; P203-H205 VanDerWaalsContact C-N 3.34Å; P203-H205 PolarHBondContact O-N 2.95Å; P203-M206 PolarHBondContact O-N 3.33Å; P203-M206 VanDerWaalsContact O-N 3.15Å; P203-A207 PolarHBondContact O-N 3.26Å; P203-L219 HydrophobicContact CB-CD1 4.14Å; P203-L219 HydrophobicContact CB-CD2 3.8Å |
| 204 | L | 96.9 | Very high | 93.1 | Very high | 0 Ų | 0 | 36.3 Ų | 36.3 | 0% | 0 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -65 | -34.3 | 179.8 | -173.9 | 62.1 | 0 | 0 | 0 | 113.1 | T202 A207 A208 M216 L219 I220 A224 V226 P237 L263 | T202-L204 PolarHBondContact O-N 3.15Å; T202-L204 PolarHBondContact OG1-N 2.95Å; L204-A207 PolarHBondContact O-N 3.44Å; L204-A208 VanDerWaalsContact O-CB 3.22Å; L204-A208 WeakPolarHBondContact O-CB 3.48Å; L204-A208 PolarHBondContact O-N 3.41Å; L204-M216 HydrophobicContact CD1-CB 4.16Å; L204-M216 HydrophobicContact CD1-CG 4.1Å; L204-L219 HydrophobicContact CD1-CB 4.34Å; L204-L219 HydrophobicContact CD1-CD1 4.44Å; L204-I220 HydrophobicContact CD1-CG1 4.19Å; L204-I220 HydrophobicContact CD2-CG1 4.41Å; L204-A224 HydrophobicContact CB-CB 4.18Å; L204-A224 HydrophobicContact CD2-CB 4.04Å; L204-V226 HydrophobicContact CD2-CB 4.34Å; L204-V226 HydrophobicContact CD2-CG1 4.07Å; L204-P237 HydrophobicContact CD2-CB 4.29Å; L204-P237 HydrophobicContact CD2-CG 4.03Å; L204-P237 HydrophobicContact CG-CB 4.07Å; L204-P237 HydrophobicContact CG-CG 4.08Å; L204-L263 HydrophobicContact CD1-CD2 4.38Å; L204-L263 HydrophobicContact CD2-CD2 4.24Å; L204-L263 HydrophobicContact CG-CD2 4.5Å |
| 205 | H | 96.8 | Very high | 92.9 | Very high | 1 Ų | 1 | 33.9 Ų | 33.9 | 1% | 0.005 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -62.7 | -42.8 | 172.9 | -71.6 | 98.7 | 0 | 0 | 0 | 111.8 | M201 T202 P203 A208 N209 C228 V230 N235 P237 L240 | M201-H205 HydrophobicContact CB-CB 3.91Å; M201-H205 HydrophobicContact CG-CB 4.29Å; T202-H205 PolarHBondContact N-ND1 3.42Å; T202-H205 WeakPolarHBondContact O-CB 3.13Å; T202-H205 PolarHBondContact O-N 3.29Å; T202-H205 PolarHBondContact OG1-N 3.16Å; T202-H205 PolarHBondContact OG1-ND1 2.84Å; P203-H205 VanDerWaalsContact C-N 3.34Å; P203-H205 PolarHBondContact O-N 2.95Å; H205-A208 PolarHBondContact O-N 3.13Å; H205-N209 WeakPolarHBondContact O-CB 3.28Å; H205-N209 PolarHBondContact O-N 3.45Å; H205-C228 PolarHBondContact CE1-O 3.38Å; H205-C228 VanDerWaalsContact CE1-O 3.27Å; H205-C228 PolarHBondContact NE2-O 2.94Å; H205-C228 VanDerWaalsContact NE2-O 3.08Å; H205-V230 VanDerWaalsContact CD2-CG2 3.41Å; H205-V230 WeakPolarHBondContact CD2-CG2 3.39Å; H205-V230 WeakPolarHBondContact NE2-CG2 3.22Å; H205-N235 PolarHBondContact NE2-O 3.45Å; H205-P237 VanDerWaalsContact NE2-CD 3.35Å; H205-P237 WeakPolarHBondContact NE2-CD 3.36Å; H205-L240 HydrophobicContact CB-CD1 3.83Å |
| 206 | M | 94.6 | Very high | 93 | Very high | 22 Ų | 22 | 33.5 Ų | 33.5 | 11% | 0.108 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -64.8 | -46 | 177.8 | -72.7 | -173 | 58.5 | 0 | 0 | 111.6 | H172 I175 A176 M201 T202 P203 A208 N209 M210 | H172-M206 HydrophobicContact CB-SD 4.15Å; H172-M206 VanDerWaalsContact CD2-SD 3.54Å; I175-M206 HydrophobicContact CG2-CB 3.86Å; A176-M206 HydrophobicContact CB-CE 4.22Å; M201-M206 HydrophobicContact CB-CG 4.48Å; M201-M206 HydrophobicContact CE-CG 3.93Å; T202-M206 PolarHBondContact O-N 3.14Å; P203-M206 PolarHBondContact O-N 3.33Å; P203-M206 VanDerWaalsContact O-N 3.15Å; M206-A208 VanDerWaalsContact C-N 3.33Å; M206-A208 PolarHBondContact O-N 3.08Å; M206-N209 PolarHBondContact O-N 3.15Å; M206-M210 WeakPolarHBondContact O-CG 3.13Å; M206-M210 PolarHBondContact O-N 3.23Å |
| 207 | A | 94.4 | Very high | 93.1 | Very high | 0 Ų | 0 | 33.1 Ų | 33.1 | 0% | 0 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -61.5 | -41.6 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | I175 P203 L204 M210 L211 N212 M215 M216 L219 | I175-A207 HydrophobicContact CG2-CB 4.45Å; P203-A207 PolarHBondContact O-N 3.26Å; L204-A207 PolarHBondContact O-N 3.44Å; A207-M210 PolarHBondContact O-N 2.94Å; A207-L211 PolarHBondContact O-N 2.9Å; A207-L211 VanDerWaalsContact O-N 3.08Å; A207-N212 PolarHBondContact O-N 2.89Å; A207-M215 HydrophobicContact CB-CB 3.93Å; A207-M216 HydrophobicContact CB-CG 3.69Å; A207-L219 HydrophobicContact CB-CD1 3.82Å |
| 208 | A | 95 | Very high | 93.2 | Very high | 0 Ų | 0 | 35.8 Ų | 35.8 | 0% | 0 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -64 | -39.8 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | L204 H205 M206 M210 L211 M216 P237 A241 L263 | L204-A208 VanDerWaalsContact O-CB 3.22Å; L204-A208 WeakPolarHBondContact O-CB 3.48Å; L204-A208 PolarHBondContact O-N 3.41Å; H205-A208 PolarHBondContact O-N 3.13Å; M206-A208 VanDerWaalsContact C-N 3.33Å; M206-A208 PolarHBondContact O-N 3.08Å; A208-M210 VanDerWaalsContact C-N 3.29Å; A208-M210 PolarHBondContact O-N 3.27Å; A208-L211 WeakPolarHBondContact O-CD2 3.47Å; A208-L211 PolarHBondContact O-N 2.99Å; A208-M216 HydrophobicContact CB-CE 4.35Å; A208-M216 HydrophobicContact CB-SD 4.38Å; A208-P237 HydrophobicContact CB-CB 4.06Å; A208-P237 WeakPolarHBondContact CB-O 3.24Å; A208-A241 HydrophobicContact CB-CB 4.16Å; A208-L263 HydrophobicContact CB-CD1 4.47Å |
| 209 | N | 92.6 | Very high | 93.4 | Very high | 77 Ų | 77 | 31.1 Ų | 31.1 | 41% | 0.412 | 16% | 0.162 | S | C | . | . | H | α-helix | trans | -66.3 | -32.4 | 175.6 | -168.5 | 64.1 | 0 | 0 | 0 | 112 | H205 M206 L211 T244 | H205-N209 WeakPolarHBondContact O-CB 3.28Å; H205-N209 PolarHBondContact O-N 3.45Å; M206-N209 PolarHBondContact O-N 3.15Å; N209-L211 VanDerWaalsContact C-N 3.33Å; N209-T244 WeakPolarHBondContact O-CG2 3.34Å; N209-T244 WeakPolarHBondContact OD1-CG2 3.33Å |
| 210 | M | 90.2 | Very high | 93.8 | Very high | 85 Ų | 85 | 29.9 Ų | 29.9 | 42% | 0.419 | 15% | 0.148 | S | C | . | . | H | α-helix | trans | -81.3 | -9.3 | 175.4 | -66.8 | 172.9 | 70.3 | 0 | 0 | 113.8 | I175 M206 A207 A208 N212 | I175-M210 HydrophobicContact CG2-SD 3.83Å; M206-M210 WeakPolarHBondContact O-CG 3.13Å; M206-M210 PolarHBondContact O-N 3.23Å; A207-M210 PolarHBondContact O-N 2.94Å; A208-M210 VanDerWaalsContact C-N 3.29Å; A208-M210 PolarHBondContact O-N 3.27Å; M210-N212 HydrophobicContact CB-CB 4.43Å; M210-N212 PolarHBondContact O-N 3.06Å |
| 211 | L | 92.6 | Very high | 93.8 | Very high | 9 Ų | 9 | 32.5 Ų | 32.5 | 5% | 0.047 | 17% | 0.172 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 53.8 | 38.5 | -172.5 | -58.2 | 175.8 | 0 | 0 | 0 | 113 | A207 A208 N209 A241 T244 A245 L253 C259 | A207-L211 PolarHBondContact O-N 2.9Å; A207-L211 VanDerWaalsContact O-N 3.08Å; A208-L211 WeakPolarHBondContact O-CD2 3.47Å; A208-L211 PolarHBondContact O-N 2.99Å; N209-L211 VanDerWaalsContact C-N 3.33Å; L211-A241 HydrophobicContact CD2-CB 4.12Å; L211-A241 WeakPolarHBondContact CD2-O 3.47Å; L211-T244 WeakPolarHBondContact CD2-OG1 3.2Å; L211-T244 WeakPolarHBondContact CG-OG1 3.19Å; L211-A245 HydrophobicContact CD1-CB 3.99Å; L211-A245 HydrophobicContact CD2-CB 4.21Å; L211-L253 HydrophobicContact CD1-CD1 4.37Å; L211-C259 VanDerWaalsContact C-SG 3.51Å; L211-C259 HydrophobicContact CD2-CB 4.37Å; L211-C259 PolarHBondContact O-SG 2.8Å; L211-C259 VanDerWaalsContact O-SG 3.36Å |
| 212 | N | 90.8 | Very high | 93.7 | Very high | 21 Ų | 21 | 32.4 Ų | 32.4 | 11% | 0.112 | 18% | 0.175 | C | C | . | . | trans | -95.4 | 100.7 | 178.2 | -172.4 | -39.1 | 0 | 0 | 0 | 110.1 | Y180 A207 M210 E214 M215 M216 | Y180-N212 WeakPolarHBondContact CE1-OD1 3.35Å; Y180-N212 PolarHBondContact OH-ND2 3.48Å; A207-N212 PolarHBondContact O-N 2.89Å; M210-N212 HydrophobicContact CB-CB 4.43Å; M210-N212 PolarHBondContact O-N 3.06Å; N212-E214 PolarHBondContact OD1-N 3.21Å; N212-E214 PolarHBondContact OD1-OE2 3.5Å; N212-M215 HydrophobicContact CB-CB 4.2Å; N212-M215 HydrophobicContact CB-CG 4.28Å; N212-M215 HydrophobicContact CB-SD 4.2Å; N212-M215 PolarHBondContact OD1-N 3.1Å; N212-M216 WeakPolarHBondContact O-CG 3.42Å; N212-M216 PolarHBondContact O-N 2.95Å; N212-M216 VanDerWaalsContact O-N 3.16Å | ||
| 213 | K | 91.6 | Very high | 93.6 | Very high | 69 Ų | 69 | 34.7 Ų | 34.7 | 30% | 0.3 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -63.9 | -45 | -174.4 | -170.2 | -170.8 | 178.8 | -116.8 | 0 | 111.5 | M215 M216 E217 L262 | K213-M215 VanDerWaalsContact C-N 3.34Å; K213-M215 PolarHBondContact O-N 3.14Å; K213-M216 WeakPolarHBondContact O-CB 3.14Å; K213-M216 PolarHBondContact O-N 2.85Å; K213-M216 VanDerWaalsContact O-N 3.13Å; K213-E217 WeakPolarHBondContact CE-OE1 3.45Å; K213-E217 HydrophobicContact CG-CG 4.44Å; K213-E217 IonicContact NZ-OE1 3.92Å; K213-E217 PolarHBondContact NZ-OE1 2.78Å; K213-E217 IonicContact NZ-OE2 2.89Å; K213-E217 WeakPolarHBondContact O-CG 3.29Å; K213-E217 PolarHBondContact O-N 3.06Å; K213-L262 HydrophobicContact CG-CD2 4.26Å |
| 214 | E | 90.6 | Very high | 93.7 | Very high | 102 Ų | 102 | 35 Ų | 35 | 48% | 0.477 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -63.3 | -40.9 | -176.2 | -64 | 75.8 | -165.5 | 0 | 0 | 111.1 | Y180 N212 E217 M218 | Y180-E214 HydrophobicContact CD1-CB 4.01Å; Y180-E214 HydrophobicContact CE1-CB 3.66Å; N212-E214 PolarHBondContact OD1-N 3.21Å; N212-E214 PolarHBondContact OD1-OE2 3.5Å; E214-E217 PolarHBondContact O-N 3.35Å; E214-M218 WeakPolarHBondContact O-CG 3.5Å; E214-M218 PolarHBondContact O-N 3.48Å; E214-M218 VanDerWaalsContact O-N 3.08Å |
| 215 | M | 91.4 | Very high | 93.6 | Very high | 0 Ų | 0 | 38.7 Ų | 38.7 | 0% | 0 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -64.3 | -41.5 | 173.4 | -72.4 | -175.4 | 169.9 | 0 | 0 | 112.4 | I175 G178 Y180 L183 A207 N212 K213 M218 L219 | I175-M215 HydrophobicContact CB-SD 4.19Å; I175-M215 HydrophobicContact CG1-SD 4.21Å; I175-M215 HydrophobicContact CG2-SD 3.85Å; G178-M215 VanDerWaalsContact C-CE 3.43Å; Y180-M215 HydrophobicContact CD1-CE 4.38Å; Y180-M215 HydrophobicContact CD1-CG 3.81Å; Y180-M215 HydrophobicContact CE1-CE 4.13Å; Y180-M215 HydrophobicContact CE1-CG 3.59Å; L183-M215 HydrophobicContact CD1-CB 4.25Å; L183-M215 HydrophobicContact CD1-CG 3.99Å; A207-M215 HydrophobicContact CB-CB 3.93Å; N212-M215 HydrophobicContact CB-CB 4.2Å; N212-M215 HydrophobicContact CB-CG 4.28Å; N212-M215 HydrophobicContact CB-SD 4.2Å; N212-M215 PolarHBondContact OD1-N 3.1Å; K213-M215 VanDerWaalsContact C-N 3.34Å; K213-M215 PolarHBondContact O-N 3.14Å; M215-M218 PolarHBondContact O-N 2.8Å; M215-L219 WeakPolarHBondContact O-CB 3.26Å; M215-L219 WeakPolarHBondContact O-CD1 3.19Å; M215-L219 WeakPolarHBondContact O-CG 3.32Å; M215-L219 PolarHBondContact O-N 3.25Å |
| 216 | M | 95.1 | Very high | 93.7 | Very high | 0 Ų | 0 | 39.2 Ų | 39.2 | 0% | 0 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -63.9 | -44.1 | 178.2 | -67.4 | 167.9 | 63 | 0 | 0 | 111.2 | L204 A207 A208 N212 K213 M218 L219 I220 C259 L262 L263 | L204-M216 HydrophobicContact CD1-CB 4.16Å; L204-M216 HydrophobicContact CD1-CG 4.1Å; A207-M216 HydrophobicContact CB-CG 3.69Å; A208-M216 HydrophobicContact CB-CE 4.35Å; A208-M216 HydrophobicContact CB-SD 4.38Å; N212-M216 WeakPolarHBondContact O-CG 3.42Å; N212-M216 PolarHBondContact O-N 2.95Å; N212-M216 VanDerWaalsContact O-N 3.16Å; K213-M216 WeakPolarHBondContact O-CB 3.14Å; K213-M216 PolarHBondContact O-N 2.85Å; K213-M216 VanDerWaalsContact O-N 3.13Å; M216-M218 PolarHBondContact O-N 3.29Å; M216-L219 PolarHBondContact O-N 3.12Å; M216-I220 WeakPolarHBondContact O-CB 3.42Å; M216-I220 WeakPolarHBondContact O-CD1 3.35Å; M216-I220 WeakPolarHBondContact O-CG1 3.42Å; M216-I220 PolarHBondContact O-N 3.23Å; M216-C259 HydrophobicContact CE-CB 3.95Å; M216-C259 WeakPolarHBondContact CE-O 3.39Å; M216-C259 HydrophobicContact SD-CB 3.72Å; M216-L262 HydrophobicContact CB-CD2 3.65Å; M216-L262 HydrophobicContact CE-CD2 4.42Å; M216-L263 HydrophobicContact CE-CD1 3.46Å; M216-L263 VanDerWaalsContact CE-CD1 3.46Å; M216-L263 HydrophobicContact CE-CD2 3.75Å; M216-L263 HydrophobicContact CE-CG 3.34Å |
| 217 | E | 94.3 | Very high | 93.8 | Very high | 73 Ų | 73 | 40.2 Ų | 40.2 | 34% | 0.341 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -58.2 | -47.8 | 176.3 | -74.6 | 179.7 | 167.4 | 0 | 0 | 111.1 | K213 E214 I220 A221 L262 | K213-E217 WeakPolarHBondContact CE-OE1 3.45Å; K213-E217 HydrophobicContact CG-CG 4.44Å; K213-E217 IonicContact NZ-OE1 3.92Å; K213-E217 PolarHBondContact NZ-OE1 2.78Å; K213-E217 IonicContact NZ-OE2 2.89Å; K213-E217 WeakPolarHBondContact O-CG 3.29Å; K213-E217 PolarHBondContact O-N 3.06Å; E214-E217 PolarHBondContact O-N 3.35Å; E217-I220 PolarHBondContact O-N 2.81Å; E217-A221 VanDerWaalsContact O-CB 3.32Å; E217-A221 WeakPolarHBondContact O-CB 3.34Å; E217-A221 PolarHBondContact O-N 3Å; E217-L262 HydrophobicContact CB-CD2 4.4Å; E217-L262 HydrophobicContact CG-CD1 3.67Å; E217-L262 HydrophobicContact CG-CD2 3.46Å; E217-L262 VanDerWaalsContact CG-CD2 3.46Å; E217-L262 HydrophobicContact CG-CG 4.21Å |
| 218 | M | 93.1 | Very high | 93.9 | Very high | 68 Ų | 68 | 41.5 Ų | 41.5 | 34% | 0.335 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -63 | -44.6 | 178.3 | -71.3 | -57.2 | -56.8 | 0 | 0 | 112.6 | L183 E214 M215 M216 A221 C222 | L183-M218 HydrophobicContact CD1-CB 4.49Å; E214-M218 WeakPolarHBondContact O-CG 3.5Å; E214-M218 PolarHBondContact O-N 3.48Å; E214-M218 VanDerWaalsContact O-N 3.08Å; M215-M218 PolarHBondContact O-N 2.8Å; M216-M218 PolarHBondContact O-N 3.29Å; M218-A221 PolarHBondContact O-N 3.2Å; M218-C222 WeakPolarHBondContact O-CB 3.38Å; M218-C222 PolarHBondContact O-N 3.02Å; M218-C222 PolarHBondContact O-SG 3.16Å |
| 219 | L | 94.9 | Very high | 93.9 | Very high | 3 Ų | 3 | 44.1 Ų | 44.1 | 2% | 0.016 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -64.6 | -43 | 178.9 | -71 | 165.9 | 0 | 0 | 0 | 111.7 | I175 L183 V193 P203 L204 A207 M215 M216 A221 C222 G223 A224 | I175-L219 HydrophobicContact CD1-CD1 3.61Å; I175-L219 HydrophobicContact CD1-CD2 4.36Å; L183-L219 HydrophobicContact CD2-CD2 4.46Å; V193-L219 HydrophobicContact CG1-CD2 4.09Å; P203-L219 HydrophobicContact CB-CD1 4.14Å; P203-L219 HydrophobicContact CB-CD2 3.8Å; L204-L219 HydrophobicContact CD1-CB 4.34Å; L204-L219 HydrophobicContact CD1-CD1 4.44Å; A207-L219 HydrophobicContact CB-CD1 3.82Å; M215-L219 WeakPolarHBondContact O-CB 3.26Å; M215-L219 WeakPolarHBondContact O-CD1 3.19Å; M215-L219 WeakPolarHBondContact O-CG 3.32Å; M215-L219 PolarHBondContact O-N 3.25Å; M216-L219 PolarHBondContact O-N 3.12Å; L219-A221 VanDerWaalsContact C-N 3.34Å; L219-C222 CarbonylContact O-C 3.53Å; L219-C222 PolarHBondContact O-N 3.03Å; L219-C222 VanDerWaalsContact O-N 3.16Å; L219-G223 PolarHBondContact O-N 3.21Å; L219-A224 HydrophobicContact CB-CB 4.01Å; L219-A224 WeakPolarHBondContact O-CB 3.29Å; L219-A224 PolarHBondContact O-N 2.92Å |
| 220 | I | 95.9 | Very high | 94.1 | Very high | 21 Ų | 21 | 40.7 Ų | 40.7 | 11% | 0.108 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -62.7 | -43.7 | 176.1 | -68.1 | 167.2 | 0 | 0 | 0 | 110.1 | L204 M216 E217 C222 G223 V226 L262 L263 H266 | L204-I220 HydrophobicContact CD1-CG1 4.19Å; L204-I220 HydrophobicContact CD2-CG1 4.41Å; M216-I220 WeakPolarHBondContact O-CB 3.42Å; M216-I220 WeakPolarHBondContact O-CD1 3.35Å; M216-I220 WeakPolarHBondContact O-CG1 3.42Å; M216-I220 PolarHBondContact O-N 3.23Å; E217-I220 PolarHBondContact O-N 2.81Å; I220-C222 PolarHBondContact O-N 3.26Å; I220-G223 PolarHBondContact O-N 2.95Å; I220-V226 HydrophobicContact CD1-CG1 4.19Å; I220-V226 HydrophobicContact CG1-CG1 3.99Å; I220-L262 HydrophobicContact CD1-CD2 4.1Å; I220-L262 HydrophobicContact CD1-CG 4.07Å; I220-L263 HydrophobicContact CD1-CD2 4.34Å; I220-H266 HydrophobicContact CD1-CB 4.38Å; I220-H266 HydrophobicContact CG2-CB 4.15Å |
| 221 | A | 94 | Very high | 94.2 | Very high | 83 Ų | 83 | 40 Ų | 40 | 69% | 0.686 | 25% | 0.246 | S | C | * | . | H | α-helix | trans | -61.8 | -30.3 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | E217 M218 L219 G223 | E217-A221 VanDerWaalsContact O-CB 3.32Å; E217-A221 WeakPolarHBondContact O-CB 3.34Å; E217-A221 PolarHBondContact O-N 3Å; M218-A221 PolarHBondContact O-N 3.2Å; L219-A221 VanDerWaalsContact C-N 3.34Å; A221-G223 VanDerWaalsContact C-N 3.27Å; A221-G223 PolarHBondContact O-N 3.44Å |
| 222 | C | 92.2 | Very high | 94.2 | Very high | 43 Ų | 43 | 43.2 Ų | 43.2 | 29% | 0.291 | 27% | 0.27 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -82.9 | 5.8 | 174.2 | -61.3 | 0 | 0 | 0 | 0 | 113.7 | A187 V193 M218 L219 I220 | A187-C222 HydrophobicContact CB-CB 3.91Å; A187-C222 VanDerWaalsContact CB-SG 3.59Å; V193-C222 HydrophobicContact CG1-CB 4.37Å; V193-C222 HydrophobicContact CG2-CB 3.97Å; M218-C222 WeakPolarHBondContact O-CB 3.38Å; M218-C222 PolarHBondContact O-N 3.02Å; M218-C222 PolarHBondContact O-SG 3.16Å; L219-C222 CarbonylContact O-C 3.53Å; L219-C222 PolarHBondContact O-N 3.03Å; L219-C222 VanDerWaalsContact O-N 3.16Å; I220-C222 PolarHBondContact O-N 3.26Å |
| 223 | G | 93.7 | Very high | 94.4 | Very high | 51 Ų | 51 | 44.9 Ų | 44.9 | 53% | 0.526 | 28% | 0.28 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 89.6 | 23.1 | 176.9 | 0 | 0 | 0 | 0 | 0 | 115.3 | L219 I220 A221 N225 | L219-G223 PolarHBondContact O-N 3.21Å; I220-G223 PolarHBondContact O-N 2.95Å; A221-G223 VanDerWaalsContact C-N 3.27Å; A221-G223 PolarHBondContact O-N 3.44Å; G223-N225 PolarHBondContact O-N 3.47Å |
| 224 | A | 96.3 | Very high | 94.5 | Very high | 8 Ų | 8 | 41.9 Ų | 41.9 | 7% | 0.066 | 27% | 0.269 | C | S | . | . | trans | -60 | 132.5 | 171.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | V193 L204 L219 V226 | V193-A224 HydrophobicContact CG1-CB 3.65Å; L204-A224 HydrophobicContact CB-CB 4.18Å; L204-A224 HydrophobicContact CD2-CB 4.04Å; L219-A224 HydrophobicContact CB-CB 4.01Å; L219-A224 WeakPolarHBondContact O-CB 3.29Å; L219-A224 PolarHBondContact O-N 2.92Å; A224-V226 PolarHBondContact O-N 2.94Å | ||
| 225 | N | 96.6 | Very high | 94.8 | Very high | 76 Ų | 76 | 38.4 Ų | 38.4 | 41% | 0.406 | 25% | 0.254 | S | S | . | . | trans | -77 | 109.4 | 174.5 | 178 | -0.7 | 0 | 0 | 0 | 110.3 | N194 G223 N227 C228 | N194-N225 PolarHBondContact OD1-N 3.44Å; G223-N225 PolarHBondContact O-N 3.47Å; N225-N227 PolarHBondContact O-N 3.1Å; N225-N227 VanDerWaalsContact O-N 3.13Å; N225-N227 PolarHBondContact OD1-N 2.94Å; N225-C228 VanDerWaalsContact CB-SG 3.57Å; N225-C228 VanDerWaalsContact CG-SG 3.6Å; N225-C228 PolarHBondContact ND2-SG 3.5Å; N225-C228 VanDerWaalsContact ND2-SG 3.44Å; N225-C228 PolarHBondContact O-N 3.2Å | ||
| 226 | V | 97.6 | Very high | 95.1 | Very high | 12 Ų | 12 | 39 Ų | 39 | 7% | 0.073 | 26% | 0.257 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -64.5 | -14.2 | -179.1 | -60.2 | 0 | 0 | 0 | 0 | 114.6 | L204 I220 A224 P237 L263 H266 | L204-V226 HydrophobicContact CD2-CB 4.34Å; L204-V226 HydrophobicContact CD2-CG1 4.07Å; I220-V226 HydrophobicContact CD1-CG1 4.19Å; I220-V226 HydrophobicContact CG1-CG1 3.99Å; A224-V226 PolarHBondContact O-N 2.94Å; V226-P237 WeakPolarHBondContact O-CD 3.43Å; V226-L263 HydrophobicContact CG1-CD2 4.5Å; V226-H266 HydrophobicContact CG1-CB 4.19Å; V226-H266 WeakPolarHBondContact CG2-O 3.41Å |
| 227 | N | 97.5 | Very high | 95.2 | Very high | 44 Ų | 44 | 39 Ų | 39 | 24% | 0.235 | 26% | 0.257 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -113.5 | 9.1 | -173.7 | -71.7 | -53.7 | 0 | 0 | 0 | 113.7 | N225 A229 G267 A268 K269 | N225-N227 PolarHBondContact O-N 3.1Å; N225-N227 VanDerWaalsContact O-N 3.13Å; N225-N227 PolarHBondContact OD1-N 2.94Å; N227-A229 PolarHBondContact O-N 2.94Å; N227-G267 PolarHBondContact ND2-O 3.49Å; N227-A268 WeakPolarHBondContact OD1-CA 3.43Å; N227-K269 WeakPolarHBondContact OD1-CG 3.37Å; N227-K269 PolarHBondContact OD1-N 2.79Å |
| 228 | C | 96.1 | Very high | 95.4 | Very high | 27 Ų | 27 | 35.6 Ų | 35.6 | 18% | 0.182 | 24% | 0.242 | C | C | . | . | trans | -56 | 139.3 | 171.9 | -78.1 | 0 | 0 | 0 | 0 | 110.2 | T202 H205 N225 P237 | T202-C228 HydrophobicContact CG2-CB 4.03Å; H205-C228 PolarHBondContact CE1-O 3.38Å; H205-C228 VanDerWaalsContact CE1-O 3.27Å; H205-C228 PolarHBondContact NE2-O 2.94Å; H205-C228 VanDerWaalsContact NE2-O 3.08Å; N225-C228 VanDerWaalsContact CB-SG 3.57Å; N225-C228 VanDerWaalsContact CG-SG 3.6Å; N225-C228 PolarHBondContact ND2-SG 3.5Å; N225-C228 VanDerWaalsContact ND2-SG 3.44Å; N225-C228 PolarHBondContact O-N 3.2Å; C228-P237 VanDerWaalsContact O-CD 3.29Å; C228-P237 WeakPolarHBondContact O-CD 3.27Å | ||
| 229 | A | 95.5 | Very high | 95.6 | Very high | 54 Ų | 54 | 32.6 Ų | 32.6 | 45% | 0.446 | 23% | 0.227 | S | C | . | . | trans | -106.4 | 136 | 174.1 | 0 | 0 | 0 | 0 | 0 | 109.2 | N227 S231 N235 | N227-A229 PolarHBondContact O-N 2.94Å; A229-S231 PolarHBondContact O-N 3.34Å; A229-N235 WeakPolarHBondContact CA-O 3.48Å | ||
| 230 | V | 95.8 | Very high | 95.6 | Very high | 5 Ų | 5 | 33.6 Ų | 33.6 | 3% | 0.03 | 23% | 0.232 | C | C | . | . | trans | -65.3 | 119.1 | 172.8 | 177.1 | 0 | 0 | 0 | 0 | 109.1 | A199 M201 H205 S232 T233 G234 N235 | A199-V230 VanDerWaalsContact O-CG1 3.26Å; A199-V230 WeakPolarHBondContact O-CG1 3.4Å; M201-V230 HydrophobicContact CG-CG1 4.48Å; M201-V230 HydrophobicContact CG-CG2 4.12Å; H205-V230 VanDerWaalsContact CD2-CG2 3.41Å; H205-V230 WeakPolarHBondContact CD2-CG2 3.39Å; H205-V230 WeakPolarHBondContact NE2-CG2 3.22Å; V230-S232 WeakPolarHBondContact CG1-OG 3.38Å; V230-S232 PolarHBondContact O-N 3.35Å; V230-T233 PolarHBondContact O-N 3.2Å; V230-T233 VanDerWaalsContact O-N 3.09Å; V230-G234 WeakPolarHBondContact O-CA 3.22Å; V230-G234 PolarHBondContact O-N 3.2Å; V230-N235 WeakPolarHBondContact CG2-O 3.45Å; V230-N235 PolarHBondContact N-O 2.89Å | ||
| 231 | S | 92.5 | Very high | 95.6 | Very high | 70 Ų | 70 | 32.6 Ų | 32.6 | 49% | 0.49 | 23% | 0.227 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -57.5 | -25.2 | -172.9 | -51.9 | 0 | 0 | 0 | 0 | 115.1 | A229 Y275 | A229-S231 PolarHBondContact O-N 3.34Å; S231-Y275 WeakPolarHBondContact O-CE2 3.32Å; S231-Y275 PolarHBondContact O-OH 2.76Å |
| 232 | S | 92.1 | Very high | 95.7 | Very high | 78 Ų | 78 | 28.6 Ų | 28.6 | 55% | 0.545 | 19% | 0.194 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -85.3 | -24.4 | -179.4 | 58.5 | 0 | 0 | 0 | 0 | 114.3 | V230 | V230-S232 WeakPolarHBondContact CG1-OG 3.38Å; V230-S232 PolarHBondContact O-N 3.35Å |
| 233 | T | 94.6 | Very high | 95.7 | Very high | 55 Ų | 55 | 29.3 Ų | 29.3 | 34% | 0.337 | 20% | 0.199 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -125.8 | -23.8 | -172.9 | 55.6 | 0 | 0 | 0 | 0 | 113.9 | V230 N235 D274 Y275 | V230-T233 PolarHBondContact O-N 3.2Å; V230-T233 VanDerWaalsContact O-N 3.09Å; T233-N235 WeakPolarHBondContact OG1-CB 3.39Å; T233-N235 PolarHBondContact OG1-N 3.08Å; T233-N235 PolarHBondContact OG1-ND2 3.27Å; T233-D274 WeakPolarHBondContact O-CB 3.37Å; T233-Y275 WeakPolarHBondContact O-CD2 3.29Å; T233-Y275 PolarHBondContact O-N 3.43Å |
| 234 | G | 95.6 | Very high | 95.7 | Very high | 6 Ų | 6 | 28 Ų | 28 | 6% | 0.062 | 18% | 0.181 | C | C | . | . | trans | 78.2 | 4.6 | -168.3 | 0 | 0 | 0 | 0 | 0 | 113.6 | V230 | V230-G234 WeakPolarHBondContact O-CA 3.22Å; V230-G234 PolarHBondContact O-N 3.2Å | ||
| 235 | N | 96.3 | Very high | 95.4 | Very high | 29 Ų | 29 | 27.7 Ų | 27.7 | 16% | 0.155 | 18% | 0.178 | C | C | . | . | trans | -69 | 135.5 | -179.3 | -73.9 | -31.7 | 0 | 0 | 0 | 111.4 | H205 A229 V230 T233 K239 L240 | H205-N235 PolarHBondContact NE2-O 3.45Å; A229-N235 WeakPolarHBondContact CA-O 3.48Å; V230-N235 WeakPolarHBondContact CG2-O 3.45Å; V230-N235 PolarHBondContact N-O 2.89Å; T233-N235 WeakPolarHBondContact OG1-CB 3.39Å; T233-N235 PolarHBondContact OG1-N 3.08Å; T233-N235 PolarHBondContact OG1-ND2 3.27Å; N235-K239 HydrophobicContact CB-CG 4.35Å; N235-K239 WeakPolarHBondContact OD1-CG 3.36Å; N235-L240 HydrophobicContact CB-CD2 3.93Å; N235-L240 HydrophobicContact CB-CG 4.2Å | ||
| 236 | T | 97.5 | Very high | 95 | Very high | 12 Ų | 12 | 24.5 Ų | 24.5 | 7% | 0.074 | 16% | 0.161 | C | C | . | . | trans | -90.5 | 166.3 | 170.1 | 62.9 | 0 | 0 | 0 | 0 | 111.1 | L238 K239 L240 A272 | T236-L238 PolarHBondContact O-N 3.2Å; T236-K239 PolarHBondContact O-N 3.26Å; T236-K239 VanDerWaalsContact O-N 3.12Å; T236-K239 PolarHBondContact OG1-N 3.31Å; T236-L240 PolarHBondContact O-N 3.08Å; T236-A272 HydrophobicContact CG2-CB 3.82Å | ||
| 237 | P | 97.6 | Very high | 94.5 | Very high | 0 Ų | 0 | 26.2 Ų | 26.2 | 0% | 0 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -55.5 | -37.8 | 173 | -25.5 | 34.8 | 0 | 0 | 0 | 112.2 | L204 H205 A208 V226 C228 L240 A241 L263 | L204-P237 HydrophobicContact CD2-CB 4.29Å; L204-P237 HydrophobicContact CD2-CG 4.03Å; L204-P237 HydrophobicContact CG-CB 4.07Å; L204-P237 HydrophobicContact CG-CG 4.08Å; H205-P237 VanDerWaalsContact NE2-CD 3.35Å; H205-P237 WeakPolarHBondContact NE2-CD 3.36Å; A208-P237 HydrophobicContact CB-CB 4.06Å; A208-P237 WeakPolarHBondContact CB-O 3.24Å; V226-P237 WeakPolarHBondContact O-CD 3.43Å; C228-P237 VanDerWaalsContact O-CD 3.29Å; C228-P237 WeakPolarHBondContact O-CD 3.27Å; P237-L240 PolarHBondContact O-N 3.24Å; P237-A241 WeakPolarHBondContact O-CB 3.33Å; P237-A241 PolarHBondContact O-N 2.9Å; P237-L263 HydrophobicContact CB-CD1 4.23Å; P237-L263 HydrophobicContact CB-CD2 4.16Å |
| 238 | L | 97.9 | Very high | 93.3 | Very high | 2 Ų | 2 | 33.1 Ų | 33.1 | 1% | 0.01 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -60.8 | -48.2 | 176.5 | 178.9 | 66.9 | 0 | 0 | 0 | 111.8 | T236 L240 A241 V242 I260 L263 L264 A268 A280 | T236-L238 PolarHBondContact O-N 3.2Å; L238-L240 VanDerWaalsContact C-N 3.34Å; L238-L240 PolarHBondContact O-N 3.18Å; L238-A241 PolarHBondContact O-N 2.62Å; L238-V242 HydrophobicContact CD1-CG2 4.43Å; L238-V242 WeakPolarHBondContact O-CG2 3.3Å; L238-V242 PolarHBondContact O-N 3.23Å; L238-I260 HydrophobicContact CD1-CG2 3.85Å; L238-L263 HydrophobicContact CB-CD1 4.34Å; L238-L263 HydrophobicContact CD1-CB 4.23Å; L238-L263 HydrophobicContact CD1-CD1 4.47Å; L238-L264 HydrophobicContact CD1-CD2 4.01Å; L238-L264 HydrophobicContact CD1-CG 3.95Å; L238-L264 HydrophobicContact CD2-CD2 3.73Å; L238-A268 HydrophobicContact CB-CB 4.13Å; L238-A268 HydrophobicContact CD2-CB 4.15Å; L238-A280 HydrophobicContact CD2-CB 4.22Å; L238-A280 HydrophobicContact CG-CB 4.2Å |
| 239 | K | 96.4 | Very high | 92.1 | Very high | 6 Ų | 6 | 35.1 Ų | 35.1 | 3% | 0.026 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -61.7 | -42.2 | 179.2 | 178.6 | 72.9 | 177.8 | -161 | 0 | 111.3 | N235 T236 V242 C243 D274 T279 E283 | N235-K239 HydrophobicContact CB-CG 4.35Å; N235-K239 WeakPolarHBondContact OD1-CG 3.36Å; T236-K239 PolarHBondContact O-N 3.26Å; T236-K239 VanDerWaalsContact O-N 3.12Å; T236-K239 PolarHBondContact OG1-N 3.31Å; K239-V242 PolarHBondContact O-N 3.13Å; K239-C243 WeakPolarHBondContact O-CB 3.09Å; K239-C243 PolarHBondContact O-N 3.45Å; K239-D274 IonicContact NZ-OD2 2.68Å; K239-T279 PolarHBondContact NZ-O 3.3Å; K239-E283 HydrophobicContact CD-CG 3.78Å; K239-E283 VanDerWaalsContact CE-OE1 3.27Å; K239-E283 WeakPolarHBondContact CE-OE1 3.49Å; K239-E283 IonicContact NZ-OE1 3.81Å; K239-E283 PolarHBondContact NZ-OE1 3.06Å |
| 240 | L | 95.6 | Very high | 90.9 | Very high | 23 Ų | 23 | 32.7 Ų | 32.7 | 12% | 0.12 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -63.4 | -48 | 175.9 | -66 | -176.6 | 0 | 0 | 0 | 111.9 | H205 N235 T236 P237 L238 V242 C243 T244 | H205-L240 HydrophobicContact CB-CD1 3.83Å; N235-L240 HydrophobicContact CB-CD2 3.93Å; N235-L240 HydrophobicContact CB-CG 4.2Å; T236-L240 PolarHBondContact O-N 3.08Å; P237-L240 PolarHBondContact O-N 3.24Å; L238-L240 VanDerWaalsContact C-N 3.34Å; L238-L240 PolarHBondContact O-N 3.18Å; L240-V242 VanDerWaalsContact C-N 3.29Å; L240-V242 PolarHBondContact O-N 3.11Å; L240-C243 PolarHBondContact O-N 3.43Å; L240-T244 WeakPolarHBondContact O-CG2 3.46Å; L240-T244 PolarHBondContact O-N 3.12Å; L240-T244 PolarHBondContact O-OG1 3.28Å; L240-T244 VanDerWaalsContact O-OG1 3.1Å |
| 241 | A | 95.6 | Very high | 89.6 | Confident | 0 Ų | 0 | 37.5 Ų | 37.5 | 0% | 0 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -58.7 | -40.4 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | A208 L211 P237 L238 T244 A245 I260 L263 | A208-A241 HydrophobicContact CB-CB 4.16Å; L211-A241 HydrophobicContact CD2-CB 4.12Å; L211-A241 WeakPolarHBondContact CD2-O 3.47Å; P237-A241 WeakPolarHBondContact O-CB 3.33Å; P237-A241 PolarHBondContact O-N 2.9Å; L238-A241 PolarHBondContact O-N 2.62Å; A241-T244 PolarHBondContact O-OG1 3.37Å; A241-A245 WeakPolarHBondContact O-CB 3.4Å; A241-A245 PolarHBondContact O-N 3.21Å; A241-I260 HydrophobicContact CB-CG1 4.03Å; A241-L263 HydrophobicContact CB-CD1 4.07Å |
| 242 | V | 95.8 | Very high | 88.1 | Confident | 0 Ų | 0 | 41.6 Ų | 41.6 | 0% | 0 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -67.7 | -43.1 | 176.7 | 171.6 | 0 | 0 | 0 | 0 | 111.6 | L238 K239 L240 S246 I260 A280 E283 A284 I292 L296 | L238-V242 HydrophobicContact CD1-CG2 4.43Å; L238-V242 WeakPolarHBondContact O-CG2 3.3Å; L238-V242 PolarHBondContact O-N 3.23Å; K239-V242 PolarHBondContact O-N 3.13Å; L240-V242 VanDerWaalsContact C-N 3.29Å; L240-V242 PolarHBondContact O-N 3.11Å; V242-S246 WeakPolarHBondContact O-CB 3.47Å; V242-S246 PolarHBondContact O-N 3.07Å; V242-S246 PolarHBondContact O-OG 2.76Å; V242-I260 HydrophobicContact CB-CD1 4.48Å; V242-I260 HydrophobicContact CG2-CD1 3.76Å; V242-I260 HydrophobicContact CG2-CG1 3.88Å; V242-I260 HydrophobicContact CG2-CG2 4.12Å; V242-A280 WeakPolarHBondContact CG1-O 3.49Å; V242-A280 HydrophobicContact CG2-CB 4.18Å; V242-E283 HydrophobicContact CG1-CB 3.91Å; V242-A284 HydrophobicContact CG1-CB 3.9Å; V242-I292 HydrophobicContact CG1-CG2 4.01Å; V242-I292 HydrophobicContact CG2-CG2 4.12Å; V242-L296 HydrophobicContact CG2-CD1 4.36Å; V242-L296 HydrophobicContact CG2-CD2 4.48Å |
| 243 | C | 93.3 | Very high | 86.7 | Confident | 58 Ų | 58 | 42.2 Ų | 42.2 | 39% | 0.392 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -60.1 | -49.6 | 178.1 | -178.6 | 0 | 0 | 0 | 0 | 111.2 | K239 L240 S246 S247 E283 | K239-C243 WeakPolarHBondContact O-CB 3.09Å; K239-C243 PolarHBondContact O-N 3.45Å; L240-C243 PolarHBondContact O-N 3.43Å; C243-S246 PolarHBondContact O-N 3.21Å; C243-S247 PolarHBondContact O-N 3.47Å; C243-S247 VanDerWaalsContact O-N 3.08Å; C243-E283 HydrophobicContact CB-CG 4.44Å |
| 244 | T | 92.4 | Very high | 85.4 | Confident | 24 Ų | 24 | 42.9 Ų | 42.9 | 15% | 0.147 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -67.4 | -43.5 | -179.2 | 56.3 | 0 | 0 | 0 | 0 | 111.7 | N209 L211 L240 A241 S246 S247 G250 | N209-T244 WeakPolarHBondContact O-CG2 3.34Å; N209-T244 WeakPolarHBondContact OD1-CG2 3.33Å; L211-T244 WeakPolarHBondContact CD2-OG1 3.2Å; L211-T244 WeakPolarHBondContact CG-OG1 3.19Å; L240-T244 WeakPolarHBondContact O-CG2 3.46Å; L240-T244 PolarHBondContact O-N 3.12Å; L240-T244 PolarHBondContact O-OG1 3.28Å; L240-T244 VanDerWaalsContact O-OG1 3.1Å; A241-T244 PolarHBondContact O-OG1 3.37Å; T244-S246 VanDerWaalsContact C-N 3.3Å; T244-S246 PolarHBondContact O-N 2.85Å; T244-S247 WeakPolarHBondContact O-CB 3.36Å; T244-S247 PolarHBondContact O-N 3.4Å; T244-S247 PolarHBondContact O-OG 2.96Å; T244-G250 WeakPolarHBondContact O-CA 3.37Å |
| 245 | A | 91.8 | Very high | 84.5 | Confident | 0 Ų | 0 | 44.5 Ų | 44.5 | 0% | 0 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -64.1 | -35.1 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112 | L211 A241 S247 G250 I260 R289 I292 | L211-A245 HydrophobicContact CD1-CB 3.99Å; L211-A245 HydrophobicContact CD2-CB 4.21Å; A241-A245 WeakPolarHBondContact O-CB 3.4Å; A241-A245 PolarHBondContact O-N 3.21Å; A245-S247 VanDerWaalsContact C-N 3.31Å; A245-S247 PolarHBondContact O-N 3.05Å; A245-G250 CarbonylContact O-C 3.55Å; A245-I260 HydrophobicContact CB-CD1 4.05Å; A245-R289 PolarHBondContact O-NE 3.37Å; A245-R289 PolarHBondContact O-NH1 3.17Å; A245-I292 HydrophobicContact CB-CD1 3.61Å |
| 246 | S | 88.2 | Confident | 84 | Confident | 9 Ų | 9 | 43.1 Ų | 43.1 | 6% | 0.063 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -74.6 | -21.7 | 179.5 | -61.9 | 0 | 0 | 0 | 0 | 113.5 | V242 C243 T244 R251 | V242-S246 WeakPolarHBondContact O-CB 3.47Å; V242-S246 PolarHBondContact O-N 3.07Å; V242-S246 PolarHBondContact O-OG 2.76Å; C243-S246 PolarHBondContact O-N 3.21Å; T244-S246 VanDerWaalsContact C-N 3.3Å; T244-S246 PolarHBondContact O-N 2.85Å; S246-R251 PolarHBondContact O-NE 2.77Å; S246-R251 PolarHBondContact O-NH2 3.27Å |
| 247 | S | 86.1 | Confident | 83.7 | Confident | 49 Ų | 49 | 44.2 Ų | 44.2 | 34% | 0.343 | 26% | 0.26 | S | S | . | . | S | Bend | trans | -63.6 | 158.1 | 174.3 | 83.6 | 0 | 0 | 0 | 0 | 112.6 | C243 T244 A245 A249 G250 R251 | C243-S247 PolarHBondContact O-N 3.47Å; C243-S247 VanDerWaalsContact O-N 3.08Å; T244-S247 WeakPolarHBondContact O-CB 3.36Å; T244-S247 PolarHBondContact O-N 3.4Å; T244-S247 PolarHBondContact O-OG 2.96Å; A245-S247 VanDerWaalsContact C-N 3.31Å; A245-S247 PolarHBondContact O-N 3.05Å; S247-A249 VanDerWaalsContact C-N 3.28Å; S247-A249 PolarHBondContact O-N 3.02Å; S247-G250 PolarHBondContact O-N 3.09Å; S247-G250 PolarHBondContact OG-N 2.8Å; S247-R251 VanDerWaalsContact O-CG 3.24Å; S247-R251 WeakPolarHBondContact O-CG 3.12Å; S247-R251 PolarHBondContact O-N 3Å |
| 248 | K | 73.3 | Confident | 83.5 | Confident | 188 Ų | 188 | 46.8 Ų | 46.8 | 82% | 0.817 | 28% | 0.278 | S | S | * | . | H | α-helix | trans | -57.4 | -40.1 | 179.5 | -169 | 176.3 | -179.1 | -178.3 | 0 | 112.2 | R251 | K248-R251 PolarHBondContact O-N 3.04Å |
| 249 | A | 71 | Confident | 83.4 | Confident | 69 Ų | 69 | 46.7 Ų | 46.7 | 57% | 0.57 | 28% | 0.278 | S | S | * | . | H | α-helix | trans | -66.7 | -42.9 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112 | S247 R251 L252 | S247-A249 VanDerWaalsContact C-N 3.28Å; S247-A249 PolarHBondContact O-N 3.02Å; A249-R251 PolarHBondContact O-N 2.95Å; A249-L252 PolarHBondContact O-N 3.5Å |
| 250 | G | 69.9 | Low | 83.4 | Confident | 3 Ų | 3 | 46.4 Ų | 46.4 | 3% | 0.031 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -71 | -10.3 | 178.8 | 0 | 0 | 0 | 0 | 0 | 115.2 | T244 A245 S247 R289 | T244-G250 WeakPolarHBondContact O-CA 3.37Å; A245-G250 CarbonylContact O-C 3.55Å; S247-G250 PolarHBondContact O-N 3.09Å; S247-G250 PolarHBondContact OG-N 2.8Å; G250-R289 PolarHBondContact O-NH1 2.87Å |
| 251 | R | 67.3 | Low | 83.4 | Confident | 107 Ų | 107 | 50.8 Ų | 50.8 | 40% | 0.404 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -70.8 | -31.2 | 171.2 | -51.5 | -158.8 | -171.6 | -169.6 | -1.3 | 113.4 | S246 S247 K248 A249 L253 G287 R289 | S246-R251 PolarHBondContact O-NE 2.77Å; S246-R251 PolarHBondContact O-NH2 3.27Å; S247-R251 VanDerWaalsContact O-CG 3.24Å; S247-R251 WeakPolarHBondContact O-CG 3.12Å; S247-R251 PolarHBondContact O-N 3Å; K248-R251 PolarHBondContact O-N 3.04Å; A249-R251 PolarHBondContact O-N 2.95Å; R251-L253 VanDerWaalsContact C-N 3.3Å; R251-G287 PolarHBondContact NH2-O 3Å; R251-R289 VanDerWaalsContact CA-NH1 3.26Å |
| 252 | L | 61.8 | Low | 83.5 | Confident | 155 Ų | 155 | 51.5 Ų | 51.5 | 81% | 0.812 | 30% | 0.295 | S | S | * | . | H | α-helix | trans | -76.7 | -26.1 | 178.8 | -60.1 | 172.4 | 0 | 0 | 0 | 111.2 | A249 G254 | A249-L252 PolarHBondContact O-N 3.5Å; L252-G254 PolarHBondContact O-N 3.38Å |
| 253 | L | 62.2 | Low | 83.6 | Confident | 92 Ų | 92 | 51.5 Ų | 51.5 | 48% | 0.482 | 30% | 0.295 | S | S | . | . | trans | -85.7 | 88.7 | 176.7 | -55.2 | 176.1 | 0 | 0 | 0 | 109.1 | L211 R251 A255 G256 | L211-L253 HydrophobicContact CD1-CD1 4.37Å; R251-L253 VanDerWaalsContact C-N 3.3Å; L253-A255 PolarHBondContact O-N 3.48Å; L253-G256 PolarHBondContact O-N 3.02Å; L253-G256 VanDerWaalsContact O-N 3.15Å | ||
| 254 | G | 67.5 | Low | 83.8 | Confident | 68 Ų | 68 | 49.1 Ų | 49.1 | 70% | 0.701 | 28% | 0.278 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -52.5 | -15.7 | 175.9 | 0 | 0 | 0 | 0 | 0 | 114.6 | L252 G256 | L252-G254 PolarHBondContact O-N 3.38Å; G254-G256 VanDerWaalsContact C-N 3.26Å; G254-G256 PolarHBondContact O-N 3.34Å |
| 255 | A | 76.8 | Confident | 84.1 | Confident | 40 Ų | 40 | 52 Ų | 52 | 33% | 0.331 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -63.5 | -20.2 | 176.2 | 0 | 0 | 0 | 0 | 0 | 115.2 | L253 V257 S258 C259 | L253-A255 PolarHBondContact O-N 3.48Å; A255-V257 PolarHBondContact O-N 2.89Å; A255-S258 PolarHBondContact O-N 3.46Å; A255-C259 PolarHBondContact O-N 3.49Å; A255-C259 PolarHBondContact O-SG 3.21Å |
| 256 | G | 85.5 | Confident | 84.4 | Confident | 0 Ų | 0 | 56.8 Ų | 56.8 | 0% | 0 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -59.8 | -42.4 | -171.9 | 0 | 0 | 0 | 0 | 0 | 114.6 | L253 G254 C259 I260 | L253-G256 PolarHBondContact O-N 3.02Å; L253-G256 VanDerWaalsContact O-N 3.15Å; G254-G256 VanDerWaalsContact C-N 3.26Å; G254-G256 PolarHBondContact O-N 3.34Å; G256-C259 PolarHBondContact O-N 3.22Å; G256-I260 VanDerWaalsContact O-CD1 3.3Å; G256-I260 WeakPolarHBondContact O-CD1 3.33Å; G256-I260 VanDerWaalsContact O-CG1 3.23Å; G256-I260 WeakPolarHBondContact O-CG1 3.46Å; G256-I260 PolarHBondContact O-N 3.44Å; G256-I260 VanDerWaalsContact O-N 3.13Å |
| 257 | V | 92.1 | Very high | 84.8 | Confident | 36 Ų | 36 | 58.5 Ų | 58.5 | 22% | 0.218 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -66.5 | -39.7 | 179.5 | 179.6 | 0 | 0 | 0 | 0 | 111.1 | A255 I260 R261 A291 I292 L295 | A255-V257 PolarHBondContact O-N 2.89Å; V257-I260 PolarHBondContact O-N 3.03Å; V257-R261 WeakPolarHBondContact O-CB 3.44Å; V257-R261 PolarHBondContact O-N 3.38Å; V257-A291 HydrophobicContact CG2-CB 4.06Å; V257-I292 HydrophobicContact CG2-CG1 4.33Å; V257-L295 HydrophobicContact CG1-CD2 3.93Å |
| 258 | S | 93.6 | Very high | 85.3 | Confident | 54 Ų | 54 | 56.7 Ų | 56.7 | 38% | 0.378 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -65.4 | -39.7 | 178.6 | -55.7 | 0 | 0 | 0 | 0 | 112.3 | A255 R261 L262 | A255-S258 PolarHBondContact O-N 3.46Å; S258-R261 PolarHBondContact O-N 3.23Å; S258-L262 WeakPolarHBondContact O-CB 3.28Å; S258-L262 PolarHBondContact O-N 3.25Å |
| 259 | C | 94.9 | Very high | 86.5 | Confident | 0 Ų | 0 | 54.3 Ų | 54.3 | 0% | 0 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -65.5 | -43.4 | 176 | -64.2 | 0 | 0 | 0 | 0 | 112.2 | L211 M216 A255 G256 L262 L263 | L211-C259 VanDerWaalsContact C-SG 3.51Å; L211-C259 HydrophobicContact CD2-CB 4.37Å; L211-C259 PolarHBondContact O-SG 2.8Å; L211-C259 VanDerWaalsContact O-SG 3.36Å; M216-C259 HydrophobicContact CE-CB 3.95Å; M216-C259 WeakPolarHBondContact CE-O 3.39Å; M216-C259 HydrophobicContact SD-CB 3.72Å; A255-C259 PolarHBondContact O-N 3.49Å; A255-C259 PolarHBondContact O-SG 3.21Å; G256-C259 PolarHBondContact O-N 3.22Å; C259-L262 WeakPolarHBondContact O-CB 3.27Å; C259-L262 PolarHBondContact O-N 3.22Å; C259-L263 PolarHBondContact O-N 3.19Å; C259-L263 VanDerWaalsContact O-N 3.15Å |
| 260 | I | 96.6 | Very high | 87.7 | Confident | 0 Ų | 0 | 51.9 Ų | 51.9 | 0% | 0 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -63.4 | -44.7 | 176.8 | -65.4 | 160.3 | 0 | 0 | 0 | 110 | L238 A241 V242 A245 G256 V257 L262 L263 L264 I292 L295 L296 | L238-I260 HydrophobicContact CD1-CG2 3.85Å; A241-I260 HydrophobicContact CB-CG1 4.03Å; V242-I260 HydrophobicContact CB-CD1 4.48Å; V242-I260 HydrophobicContact CG2-CD1 3.76Å; V242-I260 HydrophobicContact CG2-CG1 3.88Å; V242-I260 HydrophobicContact CG2-CG2 4.12Å; A245-I260 HydrophobicContact CB-CD1 4.05Å; G256-I260 VanDerWaalsContact O-CD1 3.3Å; G256-I260 WeakPolarHBondContact O-CD1 3.33Å; G256-I260 VanDerWaalsContact O-CG1 3.23Å; G256-I260 WeakPolarHBondContact O-CG1 3.46Å; G256-I260 PolarHBondContact O-N 3.44Å; G256-I260 VanDerWaalsContact O-N 3.13Å; V257-I260 PolarHBondContact O-N 3.03Å; I260-L262 VanDerWaalsContact C-N 3.33Å; I260-L262 PolarHBondContact O-N 3.31Å; I260-L263 PolarHBondContact O-N 3.21Å; I260-L264 HydrophobicContact CG2-CD1 3.86Å; I260-L264 HydrophobicContact CG2-CG 4.49Å; I260-L264 WeakPolarHBondContact O-CG 3.38Å; I260-L264 PolarHBondContact O-N 3.02Å; I260-L264 VanDerWaalsContact O-N 3.07Å; I260-I292 HydrophobicContact CD1-CB 4.48Å; I260-I292 HydrophobicContact CD1-CD1 3.71Å; I260-I292 HydrophobicContact CD1-CG1 3.81Å; I260-I292 HydrophobicContact CD1-CG2 3.92Å; I260-L295 HydrophobicContact CB-CD2 3.93Å; I260-L295 HydrophobicContact CG2-CD2 3.62Å; I260-L295 HydrophobicContact CG2-CG 4.34Å; I260-L296 HydrophobicContact CG2-CD2 4.44Å |
| 261 | R | 96.6 | Very high | 88.9 | Confident | 115 Ų | 115 | 54.5 Ų | 54.5 | 43% | 0.434 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -59.2 | -45.9 | 177.4 | -177.4 | 177.4 | -63.4 | -76.7 | 2.4 | 111 | V257 S258 L263 L264 T265 L295 | V257-R261 WeakPolarHBondContact O-CB 3.44Å; V257-R261 PolarHBondContact O-N 3.38Å; S258-R261 PolarHBondContact O-N 3.23Å; R261-L263 PolarHBondContact O-N 3.31Å; R261-L264 PolarHBondContact O-N 3.15Å; R261-T265 HydrophobicContact CG-CG2 4.26Å; R261-T265 WeakPolarHBondContact O-CG2 3.46Å; R261-T265 PolarHBondContact O-N 3.19Å; R261-T265 PolarHBondContact O-OG1 3.19Å; R261-L295 HydrophobicContact CB-CD1 4.28Å; R261-L295 HydrophobicContact CB-CD2 3.96Å; R261-L295 HydrophobicContact CG-CD1 4.38Å; R261-L295 VanDerWaalsContact CZ-CD1 3.5Å |
| 262 | L | 97.4 | Very high | 90.4 | Very high | 14 Ų | 14 | 50.7 Ų | 50.7 | 7% | 0.073 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -55.7 | -49.8 | 178.2 | 180 | 72.1 | 0 | 0 | 0 | 111.7 | K213 M216 E217 I220 S258 C259 I260 L264 T265 H266 | K213-L262 HydrophobicContact CG-CD2 4.26Å; M216-L262 HydrophobicContact CB-CD2 3.65Å; M216-L262 HydrophobicContact CE-CD2 4.42Å; E217-L262 HydrophobicContact CB-CD2 4.4Å; E217-L262 HydrophobicContact CG-CD1 3.67Å; E217-L262 HydrophobicContact CG-CD2 3.46Å; E217-L262 VanDerWaalsContact CG-CD2 3.46Å; E217-L262 HydrophobicContact CG-CG 4.21Å; I220-L262 HydrophobicContact CD1-CD2 4.1Å; I220-L262 HydrophobicContact CD1-CG 4.07Å; S258-L262 WeakPolarHBondContact O-CB 3.28Å; S258-L262 PolarHBondContact O-N 3.25Å; C259-L262 WeakPolarHBondContact O-CB 3.27Å; C259-L262 PolarHBondContact O-N 3.22Å; I260-L262 VanDerWaalsContact C-N 3.33Å; I260-L262 PolarHBondContact O-N 3.31Å; L262-L264 PolarHBondContact O-N 2.99Å; L262-T265 WeakPolarHBondContact CA-OG1 3.47Å; L262-T265 PolarHBondContact O-N 2.84Å; L262-T265 PolarHBondContact O-OG1 3.21Å; L262-H266 PolarHBondContact O-CD2 3.32Å; L262-H266 VanDerWaalsContact O-CD2 3.23Å; L262-H266 PolarHBondContact O-N 3.2Å; L262-H266 VanDerWaalsContact O-N 3.1Å |
| 263 | L | 97.8 | Very high | 92 | Very high | 0 Ų | 0 | 48.1 Ų | 48.1 | 0% | 0 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -60.2 | -45.4 | 178.5 | -71.8 | 169.8 | 0 | 0 | 0 | 111.9 | L204 A208 M216 I220 V226 P237 L238 A241 C259 I260 R261 H266 G267 A268 | L204-L263 HydrophobicContact CD1-CD2 4.38Å; L204-L263 HydrophobicContact CD2-CD2 4.24Å; L204-L263 HydrophobicContact CG-CD2 4.5Å; A208-L263 HydrophobicContact CB-CD1 4.47Å; M216-L263 HydrophobicContact CE-CD1 3.46Å; M216-L263 VanDerWaalsContact CE-CD1 3.46Å; M216-L263 HydrophobicContact CE-CD2 3.75Å; M216-L263 HydrophobicContact CE-CG 3.34Å; I220-L263 HydrophobicContact CD1-CD2 4.34Å; V226-L263 HydrophobicContact CG1-CD2 4.5Å; P237-L263 HydrophobicContact CB-CD1 4.23Å; P237-L263 HydrophobicContact CB-CD2 4.16Å; L238-L263 HydrophobicContact CB-CD1 4.34Å; L238-L263 HydrophobicContact CD1-CB 4.23Å; L238-L263 HydrophobicContact CD1-CD1 4.47Å; A241-L263 HydrophobicContact CB-CD1 4.07Å; C259-L263 PolarHBondContact O-N 3.19Å; C259-L263 VanDerWaalsContact O-N 3.15Å; I260-L263 PolarHBondContact O-N 3.21Å; R261-L263 PolarHBondContact O-N 3.31Å; L263-H266 CarbonylContact O-C 3.51Å; L263-H266 PolarHBondContact O-N 3.17Å; L263-G267 PolarHBondContact O-N 3.36Å; L263-A268 HydrophobicContact CB-CB 3.94Å; L263-A268 WeakPolarHBondContact O-CB 3.42Å; L263-A268 PolarHBondContact O-N 2.69Å |
| 264 | L | 97.8 | Very high | 93.7 | Very high | 8 Ų | 8 | 44.5 Ų | 44.5 | 4% | 0.042 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -63.3 | -43.5 | 179.3 | -69.3 | 168.4 | 0 | 0 | 0 | 111.9 | L238 I260 R261 L262 H266 G267 V270 L295 L296 F299 | L238-L264 HydrophobicContact CD1-CD2 4.01Å; L238-L264 HydrophobicContact CD1-CG 3.95Å; L238-L264 HydrophobicContact CD2-CD2 3.73Å; I260-L264 HydrophobicContact CG2-CD1 3.86Å; I260-L264 HydrophobicContact CG2-CG 4.49Å; I260-L264 WeakPolarHBondContact O-CG 3.38Å; I260-L264 PolarHBondContact O-N 3.02Å; I260-L264 VanDerWaalsContact O-N 3.07Å; R261-L264 PolarHBondContact O-N 3.15Å; L262-L264 PolarHBondContact O-N 2.99Å; L264-H266 PolarHBondContact O-N 2.83Å; L264-G267 PolarHBondContact O-N 2.84Å; L264-G267 VanDerWaalsContact O-N 3.09Å; L264-V270 HydrophobicContact CD2-CB 4.03Å; L264-V270 HydrophobicContact CD2-CG2 4.02Å; L264-L295 HydrophobicContact CD1-CD1 4.29Å; L264-L295 HydrophobicContact CD1-CD2 4.35Å; L264-L295 HydrophobicContact CD1-CG 3.9Å; L264-L296 HydrophobicContact CD1-CD2 4.21Å; L264-F299 HydrophobicContact CB-CD1 3.66Å; L264-F299 HydrophobicContact CB-CD2 4.05Å; L264-F299 HydrophobicContact CB-CE1 3.64Å; L264-F299 HydrophobicContact CB-CE2 4.03Å; L264-F299 HydrophobicContact CB-CG 3.85Å; L264-F299 HydrophobicContact CB-CZ 3.82Å; L264-F299 HydrophobicContact CD1-CB 4.17Å; L264-F299 HydrophobicContact CD1-CD2 3.7Å; L264-F299 HydrophobicContact CD1-CE2 4.17Å; L264-F299 HydrophobicContact CD1-CG 3.91Å; L264-F299 HydrophobicContact CD2-CB 4.09Å; L264-F299 HydrophobicContact CD2-CD1 4.47Å; L264-F299 HydrophobicContact CD2-CG 4.25Å; L264-F299 HydrophobicContact CG-CD1 4.45Å; L264-F299 HydrophobicContact CG-CD2 4.4Å; L264-F299 HydrophobicContact CG-CG 4.22Å |
| 265 | T | 97.4 | Very high | 95 | Very high | 84 Ų | 84 | 46.7 Ų | 46.7 | 52% | 0.515 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -64.7 | -25.5 | 176.9 | 48.9 | 0 | 0 | 0 | 0 | 113.2 | R261 L262 G267 F299 | R261-T265 HydrophobicContact CG-CG2 4.26Å; R261-T265 WeakPolarHBondContact O-CG2 3.46Å; R261-T265 PolarHBondContact O-N 3.19Å; R261-T265 PolarHBondContact O-OG1 3.19Å; L262-T265 WeakPolarHBondContact CA-OG1 3.47Å; L262-T265 PolarHBondContact O-N 2.84Å; L262-T265 PolarHBondContact O-OG1 3.21Å; T265-G267 VanDerWaalsContact C-N 3.34Å; T265-F299 HydrophobicContact CG2-CE1 4.41Å; T265-F299 HydrophobicContact CG2-CZ 3.87Å |
| 266 | H | 97.8 | Very high | 95.9 | Very high | 101 Ų | 101 | 51.6 Ų | 51.6 | 47% | 0.468 | 26% | 0.264 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -94.1 | 17 | 175.6 | -76 | -77.6 | 0 | 0 | 0 | 113.6 | I220 V226 L262 L263 L264 | I220-H266 HydrophobicContact CD1-CB 4.38Å; I220-H266 HydrophobicContact CG2-CB 4.15Å; V226-H266 HydrophobicContact CG1-CB 4.19Å; V226-H266 WeakPolarHBondContact CG2-O 3.41Å; L262-H266 PolarHBondContact O-CD2 3.32Å; L262-H266 VanDerWaalsContact O-CD2 3.23Å; L262-H266 PolarHBondContact O-N 3.2Å; L262-H266 VanDerWaalsContact O-N 3.1Å; L263-H266 CarbonylContact O-C 3.51Å; L263-H266 PolarHBondContact O-N 3.17Å; L264-H266 PolarHBondContact O-N 2.83Å |
| 267 | G | 96.6 | Very high | 96.5 | Very high | 46 Ų | 46 | 51.9 Ų | 51.9 | 47% | 0.474 | 27% | 0.267 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 87.1 | 24.1 | 170.6 | 0 | 0 | 0 | 0 | 0 | 115 | N227 L263 L264 T265 K269 | N227-G267 PolarHBondContact ND2-O 3.49Å; L263-G267 PolarHBondContact O-N 3.36Å; L264-G267 PolarHBondContact O-N 2.84Å; L264-G267 VanDerWaalsContact O-N 3.09Å; T265-G267 VanDerWaalsContact C-N 3.34Å; G267-K269 PolarHBondContact O-N 3.32Å |
| 268 | A | 97.9 | Very high | 96.7 | Very high | 10 Ų | 10 | 51.5 Ų | 51.5 | 8% | 0.083 | 26% | 0.263 | C | S | . | . | trans | -61.5 | 129.4 | 168.9 | 0 | 0 | 0 | 0 | 0 | 110.8 | N227 L238 L263 V270 | N227-A268 WeakPolarHBondContact OD1-CA 3.43Å; L238-A268 HydrophobicContact CB-CB 4.13Å; L238-A268 HydrophobicContact CD2-CB 4.15Å; L263-A268 HydrophobicContact CB-CB 3.94Å; L263-A268 WeakPolarHBondContact O-CB 3.42Å; L263-A268 PolarHBondContact O-N 2.69Å; A268-V270 PolarHBondContact O-N 3.15Å | ||
| 269 | K | 97.4 | Very high | 96.9 | Very high | 139 Ų | 139 | 48.9 Ų | 48.9 | 60% | 0.604 | 25% | 0.245 | S | C | * | . | trans | -69.5 | 98.2 | 178.7 | -70 | 174.5 | -177.3 | -179.8 | 0 | 109.9 | N227 G267 N271 A272 | N227-K269 WeakPolarHBondContact OD1-CG 3.37Å; N227-K269 PolarHBondContact OD1-N 2.79Å; G267-K269 PolarHBondContact O-N 3.32Å; K269-N271 PolarHBondContact O-N 3.31Å; K269-N271 VanDerWaalsContact O-N 3.13Å; K269-A272 HydrophobicContact CB-CB 4.03Å; K269-A272 WeakPolarHBondContact O-CB 3.17Å; K269-A272 PolarHBondContact O-N 3.43Å; K269-A272 VanDerWaalsContact O-N 3.08Å | ||
| 270 | V | 96.6 | Very high | 97 | Very high | 17 Ų | 17 | 49 Ų | 49 | 10% | 0.103 | 25% | 0.246 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -54.1 | -34.1 | -177.8 | 73.1 | 0 | 0 | 0 | 0 | 113.6 | L264 A268 L296 F299 A301 | L264-V270 HydrophobicContact CD2-CB 4.03Å; L264-V270 HydrophobicContact CD2-CG2 4.02Å; A268-V270 PolarHBondContact O-N 3.15Å; V270-L296 HydrophobicContact CG2-CD2 3.88Å; V270-F299 WeakPolarHBondContact CG1-O 3.3Å; V270-A301 HydrophobicContact CG2-CB 3.68Å |
| 271 | N | 96.1 | Very high | 97 | Very high | 59 Ų | 59 | 49 Ų | 49 | 32% | 0.316 | 25% | 0.246 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -100.3 | 13.5 | -175.6 | -68.6 | -41.1 | 0 | 0 | 0 | 113.3 | K269 Q273 T279 E300 N302 I305 | K269-N271 PolarHBondContact O-N 3.31Å; K269-N271 VanDerWaalsContact O-N 3.13Å; N271-Q273 PolarHBondContact O-N 3.24Å; N271-T279 WeakPolarHBondContact O-CG2 3.35Å; N271-E300 PolarHBondContact ND2-O 2.94Å; N271-E300 VanDerWaalsContact ND2-O 3.16Å; N271-N302 PolarHBondContact OD1-N 2.87Å; N271-I305 HydrophobicContact CB-CD1 3.73Å |
| 272 | A | 97.3 | Very high | 97 | Very high | 27 Ų | 27 | 43.5 Ų | 43.5 | 22% | 0.223 | 23% | 0.225 | C | C | . | . | trans | -61.9 | 130.4 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111 | T236 K269 T279 | T236-A272 HydrophobicContact CG2-CB 3.82Å; K269-A272 HydrophobicContact CB-CB 4.03Å; K269-A272 WeakPolarHBondContact O-CB 3.17Å; K269-A272 PolarHBondContact O-N 3.43Å; K269-A272 VanDerWaalsContact O-N 3.08Å; A272-T279 WeakPolarHBondContact O-CA 3.43Å | ||
| 273 | Q | 96.8 | Very high | 96.9 | Very high | 101 Ų | 101 | 44.3 Ų | 44.3 | 47% | 0.472 | 23% | 0.229 | S | C | . | . | trans | -100.3 | 136.5 | 179.6 | -72.3 | -178.3 | -71.6 | 0 | 0 | 110.9 | N271 G277 T279 I305 L306 | N271-Q273 PolarHBondContact O-N 3.24Å; Q273-G277 PolarHBondContact NE2-O 3.03Å; Q273-T279 HydrophobicContact CG-CG2 3.49Å; Q273-T279 VanDerWaalsContact CG-CG2 3.49Å; Q273-I305 HydrophobicContact CG-CG2 4.21Å; Q273-I305 VanDerWaalsContact NE2-CG2 3.31Å; Q273-L306 PolarHBondContact NE2-O 3.42Å; Q273-L306 VanDerWaalsContact NE2-O 3.12Å | ||
| 274 | D | 96.4 | Very high | 96.7 | Very high | 16 Ų | 16 | 44.3 Ų | 44.3 | 9% | 0.086 | 23% | 0.229 | C | C | . | . | trans | -76.4 | -177 | 168.7 | 71.9 | 12.4 | 0 | 0 | 0 | 111.8 | T233 K239 K276 G277 Q278 | T233-D274 WeakPolarHBondContact O-CB 3.37Å; K239-D274 IonicContact NZ-OD2 2.68Å; D274-K276 PolarHBondContact O-N 3.42Å; D274-K276 VanDerWaalsContact O-N 3.15Å; D274-K276 VanDerWaalsContact OD1-CA 3.29Å; D274-K276 WeakPolarHBondContact OD1-CA 3.35Å; D274-K276 WeakPolarHBondContact OD1-CB 3.48Å; D274-K276 PolarHBondContact OD1-N 3.46Å; D274-G277 PolarHBondContact O-N 3.01Å; D274-G277 PolarHBondContact OD1-N 3.25Å; D274-Q278 PolarHBondContact N-O 3.49Å; D274-Q278 PolarHBondContact OD1-N 3.06Å | ||
| 275 | Y | 96.4 | Very high | 96.6 | Very high | 114 Ų | 114 | 43.9 Ų | 43.9 | 45% | 0.447 | 23% | 0.227 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -68.8 | -9.4 | 179 | -59.5 | -30 | 0 | 0 | 0 | 114.5 | S231 T233 G277 R308 | S231-Y275 WeakPolarHBondContact O-CE2 3.32Å; S231-Y275 PolarHBondContact O-OH 2.76Å; T233-Y275 WeakPolarHBondContact O-CD2 3.29Å; T233-Y275 PolarHBondContact O-N 3.43Å; Y275-G277 VanDerWaalsContact C-N 3.35Å; Y275-R308 VanDerWaalsContact O-CD 3.28Å; Y275-R308 WeakPolarHBondContact O-CD 3.45Å; Y275-R308 PolarHBondContact O-NE 3.39Å; Y275-R308 PolarHBondContact O-NH1 3.26Å; Y275-R308 PolarHBondContact O-NH2 2.95Å |
| 276 | K | 95.8 | Very high | 96.4 | Very high | 142 Ų | 142 | 43.5 Ų | 43.5 | 62% | 0.617 | 22% | 0.218 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -93.3 | 0.7 | 169.9 | -62.5 | -179.7 | -178.6 | 177.3 | 0 | 111.7 | D274 Q278 T307 R308 | D274-K276 PolarHBondContact O-N 3.42Å; D274-K276 VanDerWaalsContact O-N 3.15Å; D274-K276 VanDerWaalsContact OD1-CA 3.29Å; D274-K276 WeakPolarHBondContact OD1-CA 3.35Å; D274-K276 WeakPolarHBondContact OD1-CB 3.48Å; D274-K276 PolarHBondContact OD1-N 3.46Å; K276-Q278 HydrophobicContact CB-CG 4.12Å; K276-T307 WeakPolarHBondContact O-CB 3.4Å; K276-R308 PolarHBondContact O-N 3.21Å |
| 277 | G | 96.4 | Very high | 96.1 | Very high | 6 Ų | 6 | 39 Ų | 39 | 6% | 0.062 | 20% | 0.198 | C | C | . | . | S | Bend | trans | 75.8 | 11.2 | -173.4 | 0 | 0 | 0 | 0 | 0 | 113 | Q273 D274 Y275 | Q273-G277 PolarHBondContact NE2-O 3.03Å; D274-G277 PolarHBondContact O-N 3.01Å; D274-G277 PolarHBondContact OD1-N 3.25Å; Y275-G277 VanDerWaalsContact C-N 3.35Å |
| 278 | Q | 96.9 | Very high | 95.8 | Very high | 28 Ų | 28 | 37.4 Ų | 37.4 | 13% | 0.131 | 18% | 0.183 | C | C | . | . | trans | -87.3 | 135 | -178.9 | -62.6 | 177.6 | -28.6 | 0 | 0 | 110.4 | D274 K276 H282 E283 T307 | D274-Q278 PolarHBondContact N-O 3.49Å; D274-Q278 PolarHBondContact OD1-N 3.06Å; K276-Q278 HydrophobicContact CB-CG 4.12Å; Q278-H282 HydrophobicContact CB-CB 4.25Å; Q278-E283 PolarHBondContact OE1-OE1 3.02Å; Q278-T307 HydrophobicContact CB-CG2 4.41Å; Q278-T307 HydrophobicContact CG-CG2 3.5Å; Q278-T307 VanDerWaalsContact CG-CG2 3.5Å | ||
| 279 | T | 97.3 | Very high | 95.3 | Very high | 0 Ų | 0 | 38.5 Ų | 38.5 | 0% | 0 | 18% | 0.184 | C | C | . | . | trans | -98.6 | 177.5 | 172.7 | 62.2 | 0 | 0 | 0 | 0 | 111.7 | K239 N271 A272 Q273 I281 H282 I305 | K239-T279 PolarHBondContact NZ-O 3.3Å; N271-T279 WeakPolarHBondContact O-CG2 3.35Å; A272-T279 WeakPolarHBondContact O-CA 3.43Å; Q273-T279 HydrophobicContact CG-CG2 3.49Å; Q273-T279 VanDerWaalsContact CG-CG2 3.49Å; T279-I281 VanDerWaalsContact C-N 3.28Å; T279-I281 PolarHBondContact O-N 3.39Å; T279-I281 WeakPolarHBondContact OG1-CG2 3.36Å; T279-H282 PolarHBondContact N-ND1 3.46Å; T279-H282 VanDerWaalsContact N-ND1 3.15Å; T279-H282 WeakPolarHBondContact O-CB 3.39Å; T279-H282 PolarHBondContact O-N 3.48Å; T279-H282 PolarHBondContact OG1-ND1 3Å; T279-I305 HydrophobicContact CG2-CB 4.46Å; T279-I305 HydrophobicContact CG2-CD1 3.86Å; T279-I305 HydrophobicContact CG2-CG2 3.89Å | ||
| 280 | A | 97 | Very high | 95 | Very high | 2 Ų | 2 | 35.8 Ų | 35.8 | 2% | 0.017 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -57.1 | -39.8 | 174 | 0 | 0 | 0 | 0 | 0 | 112.6 | L238 V242 H282 E283 A284 L296 | L238-A280 HydrophobicContact CD2-CB 4.22Å; L238-A280 HydrophobicContact CG-CB 4.2Å; V242-A280 WeakPolarHBondContact CG1-O 3.49Å; V242-A280 HydrophobicContact CG2-CB 4.18Å; A280-H282 VanDerWaalsContact C-N 3.28Å; A280-H282 PolarHBondContact O-N 3Å; A280-E283 PolarHBondContact O-N 3.15Å; A280-A284 PolarHBondContact O-N 2.78Å; A280-A284 VanDerWaalsContact O-N 3.09Å; A280-L296 HydrophobicContact CB-CD1 4.19Å; A280-L296 HydrophobicContact CB-CD2 4.11Å |
| 281 | I | 96.5 | Very high | 94.8 | Very high | 0 Ų | 0 | 37.6 Ų | 37.6 | 0% | 0 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -66.5 | -28 | -179 | -168 | 157 | 0 | 0 | 0 | 113 | T279 E283 A284 C285 L296 L297 A301 V303 P313 | T279-I281 VanDerWaalsContact C-N 3.28Å; T279-I281 PolarHBondContact O-N 3.39Å; T279-I281 WeakPolarHBondContact OG1-CG2 3.36Å; I281-E283 PolarHBondContact O-N 3.15Å; I281-A284 PolarHBondContact O-N 2.77Å; I281-C285 VanDerWaalsContact O-CB 3.27Å; I281-C285 WeakPolarHBondContact O-CB 3.29Å; I281-C285 PolarHBondContact O-N 3.31Å; I281-C285 PolarHBondContact O-SG 2.8Å; I281-C285 VanDerWaalsContact O-SG 3.34Å; I281-L296 HydrophobicContact CB-CD1 4.23Å; I281-L297 HydrophobicContact CD1-CD2 3.84Å; I281-L297 HydrophobicContact CD1-CG 4.43Å; I281-A301 HydrophobicContact CB-CB 4.18Å; I281-A301 HydrophobicContact CD1-CB 3.66Å; I281-V303 HydrophobicContact CD1-CG1 3.58Å; I281-P313 HydrophobicContact CG1-CB 4.35Å; I281-P313 HydrophobicContact CG2-CB 4.34Å; I281-P313 HydrophobicContact CG2-CG 3.83Å |
| 282 | H | 96.6 | Very high | 94.7 | Very high | 0 Ų | 0 | 34.8 Ų | 34.8 | 0% | 0 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -62.1 | -43.8 | 173.9 | -70 | 82.9 | 0 | 0 | 0 | 111.7 | Q278 T279 A280 F286 I305 T307 E311 M316 | Q278-H282 HydrophobicContact CB-CB 4.25Å; T279-H282 PolarHBondContact N-ND1 3.46Å; T279-H282 VanDerWaalsContact N-ND1 3.15Å; T279-H282 WeakPolarHBondContact O-CB 3.39Å; T279-H282 PolarHBondContact O-N 3.48Å; T279-H282 PolarHBondContact OG1-ND1 3Å; A280-H282 VanDerWaalsContact C-N 3.28Å; A280-H282 PolarHBondContact O-N 3Å; H282-F286 WeakPolarHBondContact O-CB 3.35Å; H282-F286 PolarHBondContact O-N 2.89Å; H282-I305 PolarHBondContact CE1-O 3.11Å; H282-I305 PolarHBondContact NE2-O 3.09Å; H282-T307 VanDerWaalsContact CD2-CG2 3.5Å; H282-T307 WeakPolarHBondContact CD2-CG2 3.38Å; H282-E311 PolarHBondContact NE2-O 3.38Å; H282-M316 HydrophobicContact CB-CG 4.24Å |
| 283 | E | 95.2 | Very high | 94.5 | Very high | 30 Ų | 30 | 33.6 Ų | 33.6 | 14% | 0.14 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -69 | -41.6 | 176.6 | -61.5 | -52.6 | 143.7 | 0 | 0 | 112 | K239 V242 C243 Q278 A280 I281 C285 F286 G287 | K239-E283 HydrophobicContact CD-CG 3.78Å; K239-E283 VanDerWaalsContact CE-OE1 3.27Å; K239-E283 WeakPolarHBondContact CE-OE1 3.49Å; K239-E283 IonicContact NZ-OE1 3.81Å; K239-E283 PolarHBondContact NZ-OE1 3.06Å; V242-E283 HydrophobicContact CG1-CB 3.91Å; C243-E283 HydrophobicContact CB-CG 4.44Å; Q278-E283 PolarHBondContact OE1-OE1 3.02Å; A280-E283 PolarHBondContact O-N 3.15Å; I281-E283 PolarHBondContact O-N 3.15Å; E283-C285 VanDerWaalsContact C-N 3.3Å; E283-C285 PolarHBondContact O-N 3.37Å; E283-F286 PolarHBondContact O-N 3.02Å; E283-G287 PolarHBondContact O-N 3.43Å |
| 284 | A | 94.9 | Very high | 94.3 | Very high | 0 Ų | 0 | 30.1 Ų | 30.1 | 0% | 0 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -60.7 | -43.5 | 178.3 | 0 | 0 | 0 | 0 | 0 | 111 | V242 A280 I281 G287 G288 I292 I293 L296 | V242-A284 HydrophobicContact CG1-CB 3.9Å; A280-A284 PolarHBondContact O-N 2.78Å; A280-A284 VanDerWaalsContact O-N 3.09Å; I281-A284 PolarHBondContact O-N 2.77Å; A284-G287 PolarHBondContact O-N 3.34Å; A284-G288 PolarHBondContact O-N 3.06Å; A284-I292 HydrophobicContact CB-CB 4.43Å; A284-I292 HydrophobicContact CB-CG2 3.73Å; A284-I293 HydrophobicContact CB-CG1 3.79Å; A284-L296 HydrophobicContact CB-CD1 3.63Å |
| 285 | C | 95 | Very high | 94.2 | Very high | 0 Ų | 0 | 29.5 Ų | 29.5 | 0% | 0 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -64.3 | -46.8 | 174.1 | -77.5 | 0 | 0 | 0 | 0 | 111.9 | I281 E283 G287 G288 P313 M316 Y317 N323 | I281-C285 VanDerWaalsContact O-CB 3.27Å; I281-C285 WeakPolarHBondContact O-CB 3.29Å; I281-C285 PolarHBondContact O-N 3.31Å; I281-C285 PolarHBondContact O-SG 2.8Å; I281-C285 VanDerWaalsContact O-SG 3.34Å; E283-C285 VanDerWaalsContact C-N 3.3Å; E283-C285 PolarHBondContact O-N 3.37Å; C285-G287 VanDerWaalsContact C-N 3.27Å; C285-G287 PolarHBondContact O-N 3Å; C285-G288 PolarHBondContact O-N 3.25Å; C285-G288 VanDerWaalsContact O-N 3.09Å; C285-P313 HydrophobicContact CB-CB 4.44Å; C285-P313 WeakPolarHBondContact CB-O 3.45Å; C285-M316 HydrophobicContact CB-CB 4.44Å; C285-Y317 WeakPolarHBondContact O-CA 3.25Å; C285-Y317 WeakPolarHBondContact O-CD2 3.21Å; C285-N323 PolarHBondContact O-ND2 3.3Å; C285-N323 VanDerWaalsContact O-ND2 3.13Å |
| 286 | F | 94 | Very high | 94.1 | Very high | 75 Ų | 75 | 24 Ų | 24 | 33% | 0.329 | 13% | 0.126 | S | C | . | . | H | α-helix | trans | -58.4 | -40.6 | 176.1 | -175.4 | -101 | 0 | 0 | 0 | 112.1 | H282 E283 M316 Q319 R320 N323 | H282-F286 WeakPolarHBondContact O-CB 3.35Å; H282-F286 PolarHBondContact O-N 2.89Å; E283-F286 PolarHBondContact O-N 3.02Å; F286-M316 HydrophobicContact CB-CB 4.31Å; F286-M316 HydrophobicContact CB-CE 4.31Å; F286-M316 HydrophobicContact CD2-CE 4.04Å; F286-M316 HydrophobicContact CG-CE 4.4Å; F286-Q319 HydrophobicContact CD2-CB 4.31Å; F286-Q319 HydrophobicContact CE2-CB 4.29Å; F286-Q319 HydrophobicContact CE2-CG 4.09Å; F286-R320 HydrophobicContact CD2-CG 4.11Å; F286-R320 HydrophobicContact CE2-CG 3.88Å; F286-R320 HydrophobicContact CZ-CG 4.19Å; F286-N323 PolarHBondContact O-ND2 3.3Å |
| 287 | G | 90.9 | Very high | 93.9 | Very high | 6 Ų | 6 | 19 Ų | 19 | 6% | 0.062 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -73.4 | -25.2 | 175.1 | 0 | 0 | 0 | 0 | 0 | 114.9 | R251 E283 A284 C285 R289 | R251-G287 PolarHBondContact NH2-O 3Å; E283-G287 PolarHBondContact O-N 3.43Å; A284-G287 PolarHBondContact O-N 3.34Å; C285-G287 VanDerWaalsContact C-N 3.27Å; C285-G287 PolarHBondContact O-N 3Å; G287-R289 VanDerWaalsContact C-N 3.35Å; G287-R289 PolarHBondContact O-N 3Å |
| 288 | G | 90.3 | Very high | 93.6 | Very high | 14 Ų | 14 | 24.3 Ų | 24.3 | 14% | 0.144 | 13% | 0.132 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 64.9 | 31.9 | -178.5 | 0 | 0 | 0 | 0 | 0 | 114.3 | A284 C285 E290 N323 | A284-G288 PolarHBondContact O-N 3.06Å; C285-G288 PolarHBondContact O-N 3.25Å; C285-G288 VanDerWaalsContact O-N 3.09Å; G288-E290 PolarHBondContact O-N 3.24Å; G288-N323 WeakPolarHBondContact CA-OD1 3.4Å |
| 289 | R | 87.9 | Confident | 93.4 | Very high | 32 Ų | 32 | 26 Ų | 26 | 12% | 0.121 | 14% | 0.139 | C | C | . | . | trans | -89.2 | 101.3 | 175.8 | -60.8 | -137.3 | -40.9 | -171 | 14.8 | 110.4 | A245 G250 R251 G287 A291 I292 I293 | A245-R289 PolarHBondContact O-NE 3.37Å; A245-R289 PolarHBondContact O-NH1 3.17Å; G250-R289 PolarHBondContact O-NH1 2.87Å; R251-R289 VanDerWaalsContact CA-NH1 3.26Å; G287-R289 VanDerWaalsContact C-N 3.35Å; G287-R289 PolarHBondContact O-N 3Å; R289-A291 VanDerWaalsContact C-N 3.29Å; R289-A291 PolarHBondContact O-N 3.42Å; R289-I292 HydrophobicContact CB-CB 4.28Å; R289-I292 HydrophobicContact CB-CD1 4.11Å; R289-I292 HydrophobicContact CB-CG1 4.15Å; R289-I292 HydrophobicContact CG-CD1 4.43Å; R289-I292 PolarHBondContact O-N 3.31Å; R289-I293 PolarHBondContact O-N 2.82Å | ||
| 290 | E | 91.1 | Very high | 93 | Very high | 83 Ų | 83 | 33.2 Ų | 33.2 | 39% | 0.388 | 17% | 0.173 | S | C | . | . | H | α-helix | trans | -46.4 | -50 | 178.6 | 177.6 | 173.3 | -167.4 | 0 | 0 | 112.7 | G288 I292 I293 N294 L329 R332 | G288-E290 PolarHBondContact O-N 3.24Å; E290-I292 VanDerWaalsContact C-N 3.28Å; E290-I292 PolarHBondContact O-N 2.98Å; E290-I293 PolarHBondContact O-N 3.5Å; E290-N294 WeakPolarHBondContact CG-ND2 3.29Å; E290-N294 WeakPolarHBondContact O-CB 3.35Å; E290-N294 PolarHBondContact O-N 3.45Å; E290-N294 PolarHBondContact O-ND2 3.18Å; E290-N294 PolarHBondContact OE1-ND2 3.17Å; E290-L329 HydrophobicContact CB-CD1 4.19Å; E290-L329 HydrophobicContact CB-CD2 4.04Å; E290-L329 HydrophobicContact CG-CD1 4.11Å; E290-R332 IonicContact OE1-CZ 3.97Å; E290-R332 IonicContact OE1-NH1 2.74Å; E290-R332 PolarHBondContact OE1-NH1 3.38Å |
| 291 | A | 91.9 | Very high | 92.8 | Very high | 55 Ų | 55 | 33.5 Ų | 33.5 | 46% | 0.455 | 18% | 0.175 | S | C | . | . | H | α-helix | trans | -60 | -35.1 | -177.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | V257 R289 L295 | V257-A291 HydrophobicContact CG2-CB 4.06Å; R289-A291 VanDerWaalsContact C-N 3.29Å; R289-A291 PolarHBondContact O-N 3.42Å; A291-L295 VanDerWaalsContact O-CB 3.3Å; A291-L295 WeakPolarHBondContact O-CB 3.29Å; A291-L295 PolarHBondContact O-N 3.42Å |
| 292 | I | 94.1 | Very high | 92.5 | Very high | 0 Ų | 0 | 36.7 Ų | 36.7 | 0% | 0 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -76.5 | -44 | 176.8 | -62.6 | 178.8 | 0 | 0 | 0 | 110.3 | V242 A245 V257 I260 A284 R289 E290 N294 L295 L296 | V242-I292 HydrophobicContact CG1-CG2 4.01Å; V242-I292 HydrophobicContact CG2-CG2 4.12Å; A245-I292 HydrophobicContact CB-CD1 3.61Å; V257-I292 HydrophobicContact CG2-CG1 4.33Å; I260-I292 HydrophobicContact CD1-CB 4.48Å; I260-I292 HydrophobicContact CD1-CD1 3.71Å; I260-I292 HydrophobicContact CD1-CG1 3.81Å; I260-I292 HydrophobicContact CD1-CG2 3.92Å; A284-I292 HydrophobicContact CB-CB 4.43Å; A284-I292 HydrophobicContact CB-CG2 3.73Å; R289-I292 HydrophobicContact CB-CB 4.28Å; R289-I292 HydrophobicContact CB-CD1 4.11Å; R289-I292 HydrophobicContact CB-CG1 4.15Å; R289-I292 HydrophobicContact CG-CD1 4.43Å; R289-I292 PolarHBondContact O-N 3.31Å; E290-I292 VanDerWaalsContact C-N 3.28Å; E290-I292 PolarHBondContact O-N 2.98Å; I292-N294 VanDerWaalsContact C-N 3.33Å; I292-N294 PolarHBondContact O-N 3.03Å; I292-L295 PolarHBondContact O-N 3.13Å; I292-L296 HydrophobicContact CG2-CD1 3.91Å; I292-L296 HydrophobicContact CG2-CG 4.23Å; I292-L296 WeakPolarHBondContact O-CG 3.37Å; I292-L296 PolarHBondContact O-N 3.14Å |
| 293 | I | 94.1 | Very high | 92.2 | Very high | 1 Ų | 1 | 37 Ų | 37 | 1% | 0.005 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -58.2 | -49.8 | 179 | -68.4 | 165.1 | 0 | 0 | 0 | 109.5 | A284 R289 E290 L295 L296 L297 L329 L333 | A284-I293 HydrophobicContact CB-CG1 3.79Å; R289-I293 PolarHBondContact O-N 2.82Å; E290-I293 PolarHBondContact O-N 3.5Å; I293-L295 VanDerWaalsContact C-N 3.33Å; I293-L295 PolarHBondContact O-N 3.13Å; I293-L296 PolarHBondContact O-N 2.84Å; I293-L296 VanDerWaalsContact O-N 3.15Å; I293-L297 HydrophobicContact CG2-CD1 3.94Å; I293-L297 HydrophobicContact CG2-CG 4.37Å; I293-L297 VanDerWaalsContact O-CG 3.28Å; I293-L297 WeakPolarHBondContact O-CG 3.46Å; I293-L297 PolarHBondContact O-N 2.99Å; I293-L329 HydrophobicContact CD1-CD1 4.2Å; I293-L329 HydrophobicContact CD1-CD2 3.94Å; I293-L329 HydrophobicContact CD1-CG 4.42Å; I293-L329 HydrophobicContact CG2-CD1 4.39Å; I293-L333 HydrophobicContact CD1-CD1 4.48Å; I293-L333 HydrophobicContact CG2-CD2 3.77Å |
| 294 | N | 91.7 | Very high | 92 | Very high | 29 Ų | 29 | 37.8 Ų | 37.8 | 16% | 0.155 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -59.2 | -45.6 | 178.3 | -66.1 | -12.9 | 0 | 0 | 0 | 111.4 | E290 I292 L296 L297 D298 R332 | E290-N294 WeakPolarHBondContact CG-ND2 3.29Å; E290-N294 WeakPolarHBondContact O-CB 3.35Å; E290-N294 PolarHBondContact O-N 3.45Å; E290-N294 PolarHBondContact O-ND2 3.18Å; E290-N294 PolarHBondContact OE1-ND2 3.17Å; I292-N294 VanDerWaalsContact C-N 3.33Å; I292-N294 PolarHBondContact O-N 3.03Å; N294-L296 VanDerWaalsContact C-N 3.32Å; N294-L296 PolarHBondContact O-N 3.25Å; N294-L297 PolarHBondContact O-N 3.27Å; N294-D298 PolarHBondContact O-N 3.43Å; N294-R332 PolarHBondContact ND2-NH1 3.3Å; N294-R332 PolarHBondContact ND2-NH2 3.02Å; N294-R332 VanDerWaalsContact OD1-CZ 3.22Å; N294-R332 PolarHBondContact OD1-NH1 2.9Å; N294-R332 PolarHBondContact OD1-NH2 3.45Å |
| 295 | L | 94.4 | Very high | 91.8 | Very high | 2 Ų | 2 | 39 Ų | 39 | 1% | 0.01 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -59.7 | -42.1 | 176.4 | 177 | 60.5 | 0 | 0 | 0 | 112.3 | V257 I260 R261 L264 A291 I292 I293 D298 F299 | V257-L295 HydrophobicContact CG1-CD2 3.93Å; I260-L295 HydrophobicContact CB-CD2 3.93Å; I260-L295 HydrophobicContact CG2-CD2 3.62Å; I260-L295 HydrophobicContact CG2-CG 4.34Å; R261-L295 HydrophobicContact CB-CD1 4.28Å; R261-L295 HydrophobicContact CB-CD2 3.96Å; R261-L295 HydrophobicContact CG-CD1 4.38Å; R261-L295 VanDerWaalsContact CZ-CD1 3.5Å; L264-L295 HydrophobicContact CD1-CD1 4.29Å; L264-L295 HydrophobicContact CD1-CD2 4.35Å; L264-L295 HydrophobicContact CD1-CG 3.9Å; A291-L295 VanDerWaalsContact O-CB 3.3Å; A291-L295 WeakPolarHBondContact O-CB 3.29Å; A291-L295 PolarHBondContact O-N 3.42Å; I292-L295 PolarHBondContact O-N 3.13Å; I293-L295 VanDerWaalsContact C-N 3.33Å; I293-L295 PolarHBondContact O-N 3.13Å; L295-D298 PolarHBondContact O-N 2.69Å; L295-F299 HydrophobicContact CD1-CD2 3.96Å; L295-F299 HydrophobicContact CD1-CE2 3.75Å; L295-F299 WeakPolarHBondContact O-CD2 3.4Å; L295-F299 PolarHBondContact O-N 3.41Å |
| 296 | L | 95.1 | Very high | 91.8 | Very high | 0 Ų | 0 | 42.3 Ų | 42.3 | 0% | 0 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -67 | -39.4 | 177.3 | -69.8 | 172.9 | 0 | 0 | 0 | 111.4 | V242 I260 L264 V270 A280 I281 A284 I292 I293 N294 F299 E300 A301 | V242-L296 HydrophobicContact CG2-CD1 4.36Å; V242-L296 HydrophobicContact CG2-CD2 4.48Å; I260-L296 HydrophobicContact CG2-CD2 4.44Å; L264-L296 HydrophobicContact CD1-CD2 4.21Å; V270-L296 HydrophobicContact CG2-CD2 3.88Å; A280-L296 HydrophobicContact CB-CD1 4.19Å; A280-L296 HydrophobicContact CB-CD2 4.11Å; I281-L296 HydrophobicContact CB-CD1 4.23Å; A284-L296 HydrophobicContact CB-CD1 3.63Å; I292-L296 HydrophobicContact CG2-CD1 3.91Å; I292-L296 HydrophobicContact CG2-CG 4.23Å; I292-L296 WeakPolarHBondContact O-CG 3.37Å; I292-L296 PolarHBondContact O-N 3.14Å; I293-L296 PolarHBondContact O-N 2.84Å; I293-L296 VanDerWaalsContact O-N 3.15Å; N294-L296 VanDerWaalsContact C-N 3.32Å; N294-L296 PolarHBondContact O-N 3.25Å; L296-F299 CarbonylContact O-C 3.46Å; L296-F299 PolarHBondContact O-N 3.46Å; L296-E300 PolarHBondContact O-N 3.47Å; L296-A301 VanDerWaalsContact C-CB 3.5Å; L296-A301 HydrophobicContact CB-CB 3.8Å; L296-A301 WeakPolarHBondContact O-CB 3.16Å; L296-A301 PolarHBondContact O-N 3.43Å |
| 297 | L | 90.8 | Very high | 92 | Very high | 36 Ų | 36 | 39.2 Ų | 39.2 | 19% | 0.188 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -64.4 | -39.1 | 175.5 | -66.8 | 174.3 | 0 | 0 | 0 | 112.2 | I281 I293 N294 F299 E300 V303 | I281-L297 HydrophobicContact CD1-CD2 3.84Å; I281-L297 HydrophobicContact CD1-CG 4.43Å; I293-L297 HydrophobicContact CG2-CD1 3.94Å; I293-L297 HydrophobicContact CG2-CG 4.37Å; I293-L297 VanDerWaalsContact O-CG 3.28Å; I293-L297 WeakPolarHBondContact O-CG 3.46Å; I293-L297 PolarHBondContact O-N 2.99Å; N294-L297 PolarHBondContact O-N 3.27Å; L297-F299 PolarHBondContact O-N 2.85Å; L297-E300 PolarHBondContact O-N 2.91Å; L297-V303 HydrophobicContact CD2-CG1 3.43Å; L297-V303 VanDerWaalsContact CD2-CG1 3.43Å |
| 298 | D | 90.2 | Very high | 92.2 | Very high | 117 Ų | 117 | 47.3 Ų | 47.3 | 63% | 0.626 | 24% | 0.239 | S | C | * | . | H | α-helix | trans | -60.3 | -24.9 | 174.9 | -68.9 | -20 | 0 | 0 | 0 | 112.3 | N294 L295 | N294-D298 PolarHBondContact O-N 3.43Å; L295-D298 PolarHBondContact O-N 2.69Å |
| 299 | F | 92.2 | Very high | 92.5 | Very high | 65 Ų | 65 | 51.1 Ų | 51.1 | 29% | 0.285 | 26% | 0.256 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -103.7 | 27.2 | 175 | -77.5 | -95.8 | 0 | 0 | 0 | 112.4 | L264 T265 V270 L295 L296 L297 A301 | L264-F299 HydrophobicContact CB-CD1 3.66Å; L264-F299 HydrophobicContact CB-CD2 4.05Å; L264-F299 HydrophobicContact CB-CE1 3.64Å; L264-F299 HydrophobicContact CB-CE2 4.03Å; L264-F299 HydrophobicContact CB-CG 3.85Å; L264-F299 HydrophobicContact CB-CZ 3.82Å; L264-F299 HydrophobicContact CD1-CB 4.17Å; L264-F299 HydrophobicContact CD1-CD2 3.7Å; L264-F299 HydrophobicContact CD1-CE2 4.17Å; L264-F299 HydrophobicContact CD1-CG 3.91Å; L264-F299 HydrophobicContact CD2-CB 4.09Å; L264-F299 HydrophobicContact CD2-CD1 4.47Å; L264-F299 HydrophobicContact CD2-CG 4.25Å; L264-F299 HydrophobicContact CG-CD1 4.45Å; L264-F299 HydrophobicContact CG-CD2 4.4Å; L264-F299 HydrophobicContact CG-CG 4.22Å; T265-F299 HydrophobicContact CG2-CE1 4.41Å; T265-F299 HydrophobicContact CG2-CZ 3.87Å; V270-F299 WeakPolarHBondContact CG1-O 3.3Å; L295-F299 HydrophobicContact CD1-CD2 3.96Å; L295-F299 HydrophobicContact CD1-CE2 3.75Å; L295-F299 WeakPolarHBondContact O-CD2 3.4Å; L295-F299 PolarHBondContact O-N 3.41Å; L296-F299 CarbonylContact O-C 3.46Å; L296-F299 PolarHBondContact O-N 3.46Å; L297-F299 PolarHBondContact O-N 2.85Å; F299-A301 PolarHBondContact O-N 3.06Å |
| 300 | E | 89.8 | Confident | 92.8 | Very high | 150 Ų | 150 | 49.6 Ų | 49.6 | 70% | 0.701 | 25% | 0.25 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 63.1 | 35.2 | 171.6 | -54.5 | 177.5 | -174.9 | 0 | 0 | 114.4 | N271 L296 L297 N302 | N271-E300 PolarHBondContact ND2-O 2.94Å; N271-E300 VanDerWaalsContact ND2-O 3.16Å; L296-E300 PolarHBondContact O-N 3.47Å; L297-E300 PolarHBondContact O-N 2.91Å; E300-N302 PolarHBondContact O-N 3Å |
| 301 | A | 92.7 | Very high | 93 | Very high | 8 Ų | 8 | 47 Ų | 47 | 7% | 0.066 | 24% | 0.238 | C | C | . | . | trans | -60.2 | 126.5 | 168.6 | 0 | 0 | 0 | 0 | 0 | 111.1 | V270 I281 L296 F299 V303 | V270-A301 HydrophobicContact CG2-CB 3.68Å; I281-A301 HydrophobicContact CB-CB 4.18Å; I281-A301 HydrophobicContact CD1-CB 3.66Å; L296-A301 VanDerWaalsContact C-CB 3.5Å; L296-A301 HydrophobicContact CB-CB 3.8Å; L296-A301 WeakPolarHBondContact O-CB 3.16Å; L296-A301 PolarHBondContact O-N 3.43Å; F299-A301 PolarHBondContact O-N 3.06Å; A301-V303 PolarHBondContact O-N 3Å | ||
| 302 | N | 90.1 | Very high | 93.1 | Very high | 68 Ų | 68 | 44.6 Ų | 44.6 | 36% | 0.364 | 22% | 0.218 | S | C | . | . | trans | -82.6 | 109.3 | -179.8 | 177.9 | -0.9 | 0 | 0 | 0 | 110.5 | N271 E300 N304 I305 | N271-N302 PolarHBondContact OD1-N 2.87Å; E300-N302 PolarHBondContact O-N 3Å; N302-N304 PolarHBondContact O-N 2.99Å; N302-N304 WeakPolarHBondContact OD1-CA 3.38Å; N302-N304 WeakPolarHBondContact OD1-CB 3.12Å; N302-N304 PolarHBondContact OD1-N 3.41Å; N302-I305 HydrophobicContact CB-CD1 3.69Å; N302-I305 HydrophobicContact CB-CG1 3.68Å; N302-I305 WeakPolarHBondContact ND2-CG1 3.35Å; N302-I305 PolarHBondContact O-N 3.32Å | ||
| 303 | V | 90.5 | Very high | 93.2 | Very high | 7 Ų | 7 | 44.6 Ų | 44.6 | 4% | 0.042 | 22% | 0.218 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -72.1 | -3.8 | 179.2 | -67.2 | 0 | 0 | 0 | 0 | 114.8 | I281 L297 A301 P313 H336 | I281-V303 HydrophobicContact CD1-CG1 3.58Å; L297-V303 HydrophobicContact CD2-CG1 3.43Å; L297-V303 VanDerWaalsContact CD2-CG1 3.43Å; A301-V303 PolarHBondContact O-N 3Å; V303-P313 VanDerWaalsContact O-CD 3.25Å; V303-P313 WeakPolarHBondContact O-CD 3.3Å; V303-P313 WeakPolarHBondContact O-CG 3.45Å; V303-H336 HydrophobicContact CG1-CB 4.4Å; V303-H336 HydrophobicContact CG2-CB 3.95Å; V303-H336 VanDerWaalsContact CG2-O 3.31Å; V303-H336 WeakPolarHBondContact CG2-O 3.47Å |
| 304 | N | 90.2 | Very high | 93.2 | Very high | 46 Ų | 46 | 44.6 Ų | 44.6 | 25% | 0.246 | 22% | 0.218 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -112.1 | 3.5 | -179.3 | -55.1 | -57.9 | 0 | 0 | 0 | 113 | N302 L306 T337 Y338 | N302-N304 PolarHBondContact O-N 2.99Å; N302-N304 WeakPolarHBondContact OD1-CA 3.38Å; N302-N304 WeakPolarHBondContact OD1-CB 3.12Å; N302-N304 PolarHBondContact OD1-N 3.41Å; N304-L306 PolarHBondContact O-N 3.15Å; N304-T337 WeakPolarHBondContact OD1-CG2 3.42Å; N304-Y338 VanDerWaalsContact CG-O 3.25Å; N304-Y338 PolarHBondContact ND2-O 3.27Å; N304-Y338 VanDerWaalsContact ND2-O 3.1Å; N304-Y338 PolarHBondContact OD1-N 3.41Å; N304-Y338 PolarHBondContact OD1-O 2.82Å |
| 305 | I | 92.1 | Very high | 93.4 | Very high | 24 Ų | 24 | 43.7 Ų | 43.7 | 12% | 0.123 | 21% | 0.213 | C | C | . | . | trans | -62.1 | 138.3 | 173.9 | -66.7 | 176.6 | 0 | 0 | 0 | 108.9 | N271 Q273 T279 H282 N302 P313 | N271-I305 HydrophobicContact CB-CD1 3.73Å; Q273-I305 HydrophobicContact CG-CG2 4.21Å; Q273-I305 VanDerWaalsContact NE2-CG2 3.31Å; T279-I305 HydrophobicContact CG2-CB 4.46Å; T279-I305 HydrophobicContact CG2-CD1 3.86Å; T279-I305 HydrophobicContact CG2-CG2 3.89Å; H282-I305 PolarHBondContact CE1-O 3.11Å; H282-I305 PolarHBondContact NE2-O 3.09Å; N302-I305 HydrophobicContact CB-CD1 3.69Å; N302-I305 HydrophobicContact CB-CG1 3.68Å; N302-I305 WeakPolarHBondContact ND2-CG1 3.35Å; N302-I305 PolarHBondContact O-N 3.32Å; I305-P313 WeakPolarHBondContact O-CD 3.5Å | ||
| 306 | L | 94.7 | Very high | 93.4 | Very high | 71 Ų | 71 | 44.4 Ų | 44.4 | 37% | 0.372 | 22% | 0.216 | S | C | . | . | trans | -105.1 | 142.2 | 179.2 | -60.4 | 176.6 | 0 | 0 | 0 | 111.1 | Q273 N304 E311 | Q273-L306 PolarHBondContact NE2-O 3.42Å; Q273-L306 VanDerWaalsContact NE2-O 3.12Å; N304-L306 PolarHBondContact O-N 3.15Å; L306-E311 WeakPolarHBondContact CA-O 3.34Å | ||
| 307 | T | 96.8 | Very high | 93.4 | Very high | 9 Ų | 9 | 44.5 Ų | 44.5 | 6% | 0.055 | 22% | 0.216 | C | C | . | . | trans | -67.6 | 171.4 | 164.9 | 75.1 | 0 | 0 | 0 | 0 | 110.9 | K276 Q278 H282 N309 G310 E311 | K276-T307 WeakPolarHBondContact O-CB 3.4Å; Q278-T307 HydrophobicContact CB-CG2 4.41Å; Q278-T307 HydrophobicContact CG-CG2 3.5Å; Q278-T307 VanDerWaalsContact CG-CG2 3.5Å; H282-T307 VanDerWaalsContact CD2-CG2 3.5Å; H282-T307 WeakPolarHBondContact CD2-CG2 3.38Å; T307-N309 PolarHBondContact O-N 3.04Å; T307-N309 PolarHBondContact OG1-N 3.34Å; T307-G310 WeakPolarHBondContact O-CA 3.49Å; T307-G310 PolarHBondContact O-N 3.13Å; T307-G310 PolarHBondContact OG1-N 2.79Å; T307-E311 HydrophobicContact CG2-CB 3.97Å; T307-E311 WeakPolarHBondContact CG2-O 3.35Å; T307-E311 PolarHBondContact N-O 2.74Å; T307-E311 WeakPolarHBondContact OG1-CB 3.26Å; T307-E311 PolarHBondContact OG1-N 2.83Å; T307-E311 PolarHBondContact OG1-OE2 3.12Å | ||
| 308 | R | 96.3 | Very high | 93.6 | Very high | 176 Ų | 176 | 42.8 Ų | 42.8 | 66% | 0.664 | 21% | 0.208 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -60.2 | -26.8 | 172.4 | -71.6 | -173.7 | 178.5 | -178.7 | 4.5 | 113.1 | Y275 K276 G310 N345 | Y275-R308 VanDerWaalsContact O-CD 3.28Å; Y275-R308 WeakPolarHBondContact O-CD 3.45Å; Y275-R308 PolarHBondContact O-NE 3.39Å; Y275-R308 PolarHBondContact O-NH1 3.26Å; Y275-R308 PolarHBondContact O-NH2 2.95Å; K276-R308 PolarHBondContact O-N 3.21Å; R308-G310 PolarHBondContact O-N 3.16Å; R308-N345 PolarHBondContact O-ND2 2.85Å; R308-N345 VanDerWaalsContact O-ND2 3.14Å |
| 309 | N | 95.2 | Very high | 93.7 | Very high | 94 Ų | 94 | 40.3 Ų | 40.3 | 50% | 0.503 | 19% | 0.192 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -83.7 | 0.8 | 174.1 | -66.3 | -10.9 | 0 | 0 | 0 | 112.5 | T307 E311 N344 N345 | T307-N309 PolarHBondContact O-N 3.04Å; T307-N309 PolarHBondContact OG1-N 3.34Å; N309-E311 HydrophobicContact CB-CG 4.06Å; N309-N344 WeakPolarHBondContact O-CB 3.46Å; N309-N345 VanDerWaalsContact C-CG 3.47Å; N309-N345 VanDerWaalsContact C-ND2 3.29Å; N309-N345 WeakPolarHBondContact O-CB 3.39Å; N309-N345 VanDerWaalsContact O-CG 3.24Å; N309-N345 PolarHBondContact O-N 3.29Å; N309-N345 PolarHBondContact O-ND2 3.48Å |
| 310 | G | 94.6 | Very high | 93.7 | Very high | 1 Ų | 1 | 42.7 Ų | 42.7 | 1% | 0.01 | 20% | 0.199 | C | C | . | . | trans | 73.3 | 29.1 | -175.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | T307 R308 R341 N345 | T307-G310 WeakPolarHBondContact O-CA 3.49Å; T307-G310 PolarHBondContact O-N 3.13Å; T307-G310 PolarHBondContact OG1-N 2.79Å; R308-G310 PolarHBondContact O-N 3.16Å; G310-R341 VanDerWaalsContact C-NH1 3.3Å; G310-R341 VanDerWaalsContact CA-NH1 3.33Å; G310-R341 PolarHBondContact O-NH1 3.22Å; G310-N345 VanDerWaalsContact CA-OD1 3.26Å; G310-N345 WeakPolarHBondContact CA-OD1 3.43Å; G310-N345 PolarHBondContact N-ND2 3.31Å | ||
| 311 | E | 95.3 | Very high | 93.6 | Very high | 28 Ų | 28 | 37.4 Ų | 37.4 | 13% | 0.131 | 18% | 0.179 | C | C | . | . | trans | -90 | 131.5 | 177.4 | -58.6 | 162.5 | 152.4 | 0 | 0 | 108 | H282 L306 T307 N309 Y315 M316 N344 | H282-E311 PolarHBondContact NE2-O 3.38Å; L306-E311 WeakPolarHBondContact CA-O 3.34Å; T307-E311 HydrophobicContact CG2-CB 3.97Å; T307-E311 WeakPolarHBondContact CG2-O 3.35Å; T307-E311 PolarHBondContact N-O 2.74Å; T307-E311 WeakPolarHBondContact OG1-CB 3.26Å; T307-E311 PolarHBondContact OG1-N 2.83Å; T307-E311 PolarHBondContact OG1-OE2 3.12Å; N309-E311 HydrophobicContact CB-CG 4.06Å; E311-Y315 HydrophobicContact CB-CD1 3.56Å; E311-Y315 HydrophobicContact CB-CE1 4.03Å; E311-Y315 HydrophobicContact CB-CG 4.09Å; E311-Y315 HydrophobicContact CG-CD1 3.63Å; E311-Y315 HydrophobicContact CG-CE1 3.52Å; E311-Y315 HydrophobicContact CG-CG 4.32Å; E311-M316 HydrophobicContact CB-SD 4.25Å; E311-N344 HydrophobicContact CG-CB 3.88Å | ||
| 312 | S | 94.6 | Very high | 93.4 | Very high | 4 Ų | 4 | 40.9 Ų | 40.9 | 3% | 0.028 | 19% | 0.192 | C | C | . | . | trans | -88.2 | 163.6 | 173.6 | 58.4 | 0 | 0 | 0 | 0 | 110.8 | I314 Y315 M316 R341 | S312-I314 PolarHBondContact O-N 3.47Å; S312-I314 WeakPolarHBondContact OG-CG2 3.5Å; S312-Y315 WeakPolarHBondContact O-CA 3.38Å; S312-Y315 VanDerWaalsContact O-CB 3.25Å; S312-Y315 WeakPolarHBondContact O-CB 3.49Å; S312-Y315 PolarHBondContact O-N 3.4Å; S312-Y315 WeakPolarHBondContact OG-CB 3.26Å; S312-Y315 PolarHBondContact OG-N 3.02Å; S312-Y315 VanDerWaalsContact OG-N 3.13Å; S312-M316 PolarHBondContact O-N 3.25Å; S312-R341 PolarHBondContact OG-O 3.5Å | ||
| 313 | P | 95.2 | Very high | 93.4 | Very high | 1 Ų | 1 | 37.8 Ų | 37.8 | 1% | 0.006 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -53.9 | -40.3 | 170.8 | -31.6 | 36.3 | 0 | 0 | 0 | 112.8 | I281 C285 V303 I305 Y315 M316 Y317 | I281-P313 HydrophobicContact CG1-CB 4.35Å; I281-P313 HydrophobicContact CG2-CB 4.34Å; I281-P313 HydrophobicContact CG2-CG 3.83Å; C285-P313 HydrophobicContact CB-CB 4.44Å; C285-P313 WeakPolarHBondContact CB-O 3.45Å; V303-P313 VanDerWaalsContact O-CD 3.25Å; V303-P313 WeakPolarHBondContact O-CD 3.3Å; V303-P313 WeakPolarHBondContact O-CG 3.45Å; I305-P313 WeakPolarHBondContact O-CD 3.5Å; P313-Y315 VanDerWaalsContact C-N 3.35Å; P313-Y315 PolarHBondContact O-N 2.93Å; P313-M316 PolarHBondContact O-N 3.16Å; P313-Y317 PolarHBondContact O-N 3.5Å |
| 314 | I | 94.8 | Very high | 93.2 | Very high | 1 Ų | 1 | 37.6 Ų | 37.6 | 1% | 0.005 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -65.1 | -37.6 | 174.4 | -168.9 | 67.9 | 0 | 0 | 0 | 111.9 | S312 M316 Y317 L318 L330 L333 L334 T337 L340 | S312-I314 PolarHBondContact O-N 3.47Å; S312-I314 WeakPolarHBondContact OG-CG2 3.5Å; I314-M316 VanDerWaalsContact C-N 3.32Å; I314-M316 PolarHBondContact O-N 3.29Å; I314-Y317 WeakPolarHBondContact O-CB 3.47Å; I314-Y317 PolarHBondContact O-N 3.36Å; I314-L318 HydrophobicContact CG1-CD1 4.13Å; I314-L318 HydrophobicContact CG1-CG 4.36Å; I314-L318 WeakPolarHBondContact O-CB 3.19Å; I314-L318 VanDerWaalsContact O-CG 3.26Å; I314-L318 WeakPolarHBondContact O-CG 3.35Å; I314-L318 PolarHBondContact O-N 3.08Å; I314-L330 HydrophobicContact CD1-CD1 3.83Å; I314-L333 HydrophobicContact CD1-CB 3.83Å; I314-L333 HydrophobicContact CD1-CD1 4.43Å; I314-L334 HydrophobicContact CD1-CD2 4.09Å; I314-L334 HydrophobicContact CD1-CG 4.34Å; I314-L334 HydrophobicContact CG1-CD2 4.11Å; I314-T337 HydrophobicContact CB-CG2 4.46Å; I314-T337 HydrophobicContact CG2-CG2 3.92Å; I314-L340 HydrophobicContact CG1-CD1 4.44Å; I314-L340 HydrophobicContact CG2-CD1 4.13Å |
| 315 | Y | 95.1 | Very high | 93.1 | Very high | 10 Ų | 10 | 43 Ų | 43 | 4% | 0.039 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -58.6 | -45.7 | 173.3 | 178.9 | -79.2 | 0 | 0 | 0 | 110.7 | E311 S312 P313 Y317 L318 Q319 N344 I348 P350 | E311-Y315 HydrophobicContact CB-CD1 3.56Å; E311-Y315 HydrophobicContact CB-CE1 4.03Å; E311-Y315 HydrophobicContact CB-CG 4.09Å; E311-Y315 HydrophobicContact CG-CD1 3.63Å; E311-Y315 HydrophobicContact CG-CE1 3.52Å; E311-Y315 HydrophobicContact CG-CG 4.32Å; S312-Y315 WeakPolarHBondContact O-CA 3.38Å; S312-Y315 VanDerWaalsContact O-CB 3.25Å; S312-Y315 WeakPolarHBondContact O-CB 3.49Å; S312-Y315 PolarHBondContact O-N 3.4Å; S312-Y315 WeakPolarHBondContact OG-CB 3.26Å; S312-Y315 PolarHBondContact OG-N 3.02Å; S312-Y315 VanDerWaalsContact OG-N 3.13Å; P313-Y315 VanDerWaalsContact C-N 3.35Å; P313-Y315 PolarHBondContact O-N 2.93Å; Y315-Y317 VanDerWaalsContact C-N 3.35Å; Y315-Y317 PolarHBondContact O-N 3.33Å; Y315-L318 PolarHBondContact O-N 3.42Å; Y315-Q319 PolarHBondContact O-N 3.45Å; Y315-Q319 VanDerWaalsContact O-N 3.13Å; Y315-N344 HydrophobicContact CE2-CB 4.08Å; Y315-I348 WeakPolarHBondContact CE2-O 3.44Å; Y315-P350 HydrophobicContact CD2-CB 4.45Å; Y315-P350 HydrophobicContact CD2-CG 3.51Å; Y315-P350 HydrophobicContact CE2-CB 4.39Å; Y315-P350 HydrophobicContact CE2-CG 3.76Å; Y315-P350 HydrophobicContact CG-CG 3.96Å |
| 316 | M | 95.1 | Very high | 92.9 | Very high | 17 Ų | 17 | 44.5 Ų | 44.5 | 8% | 0.084 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -63.3 | -39 | 177 | -62.4 | -59.3 | -73.6 | 0 | 0 | 112.4 | H282 C285 F286 E311 S312 P313 I314 Q319 | H282-M316 HydrophobicContact CB-CG 4.24Å; C285-M316 HydrophobicContact CB-CB 4.44Å; F286-M316 HydrophobicContact CB-CB 4.31Å; F286-M316 HydrophobicContact CB-CE 4.31Å; F286-M316 HydrophobicContact CD2-CE 4.04Å; F286-M316 HydrophobicContact CG-CE 4.4Å; E311-M316 HydrophobicContact CB-SD 4.25Å; S312-M316 PolarHBondContact O-N 3.25Å; P313-M316 PolarHBondContact O-N 3.16Å; I314-M316 VanDerWaalsContact C-N 3.32Å; I314-M316 PolarHBondContact O-N 3.29Å; M316-Q319 VanDerWaalsContact O-CB 3.28Å; M316-Q319 WeakPolarHBondContact O-CB 3.46Å; M316-Q319 PolarHBondContact O-N 2.97Å |
| 317 | Y | 94.9 | Very high | 92.6 | Very high | 1 Ų | 1 | 46.2 Ų | 46.2 | 0% | 0.004 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -60 | -47.9 | 175.2 | -174.2 | -93.4 | 0 | 0 | 0 | 111.9 | C285 P313 I314 Y315 Q319 R320 N323 D326 L329 L330 L333 | C285-Y317 WeakPolarHBondContact O-CA 3.25Å; C285-Y317 WeakPolarHBondContact O-CD2 3.21Å; P313-Y317 PolarHBondContact O-N 3.5Å; I314-Y317 WeakPolarHBondContact O-CB 3.47Å; I314-Y317 PolarHBondContact O-N 3.36Å; Y315-Y317 VanDerWaalsContact C-N 3.35Å; Y315-Y317 PolarHBondContact O-N 3.33Å; Y317-Q319 PolarHBondContact O-N 3.48Å; Y317-R320 PolarHBondContact O-N 2.85Å; Y317-N323 HydrophobicContact CD1-CB 4.1Å; Y317-N323 HydrophobicContact CD2-CB 4.1Å; Y317-N323 HydrophobicContact CE1-CB 3.82Å; Y317-N323 WeakPolarHBondContact CE1-O 3.17Å; Y317-N323 HydrophobicContact CE2-CB 3.85Å; Y317-N323 HydrophobicContact CG-CB 4.24Å; Y317-N323 VanDerWaalsContact CZ-O 3.3Å; Y317-N323 WeakPolarHBondContact O-CB 3.36Å; Y317-N323 PolarHBondContact O-ND2 3.33Å; Y317-N323 VanDerWaalsContact O-ND2 3.12Å; Y317-N323 PolarHBondContact OH-O 3.28Å; Y317-D326 PolarHBondContact OH-O 3.05Å; Y317-L329 HydrophobicContact CE2-CD2 3.62Å; Y317-L329 HydrophobicContact CE2-CG 3.86Å; Y317-L330 HydrophobicContact CD1-CD1 4Å; Y317-L330 HydrophobicContact CE1-CB 3.94Å; Y317-L330 HydrophobicContact CE1-CD1 3.89Å; Y317-L330 HydrophobicContact CE1-CG 4.44Å; Y317-L333 HydrophobicContact CD1-CD1 4.2Å; Y317-L333 HydrophobicContact CD2-CD1 3.37Å; Y317-L333 HydrophobicContact CE1-CD1 4.48Å; Y317-L333 HydrophobicContact CE2-CD1 3.69Å; Y317-L333 HydrophobicContact CG-CD1 3.64Å |
| 318 | L | 94.8 | Very high | 92.2 | Very high | 1 Ų | 1 | 48.7 Ų | 48.7 | 1% | 0.005 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -72.3 | -10.3 | -178.7 | -66.2 | 177.6 | 0 | 0 | 0 | 113.6 | I314 Y315 R320 V324 L330 M342 P350 G352 I353 L365 | I314-L318 HydrophobicContact CG1-CD1 4.13Å; I314-L318 HydrophobicContact CG1-CG 4.36Å; I314-L318 WeakPolarHBondContact O-CB 3.19Å; I314-L318 VanDerWaalsContact O-CG 3.26Å; I314-L318 WeakPolarHBondContact O-CG 3.35Å; I314-L318 PolarHBondContact O-N 3.08Å; Y315-L318 PolarHBondContact O-N 3.42Å; L318-R320 PolarHBondContact O-N 3Å; L318-V324 HydrophobicContact CD2-CG2 4.02Å; L318-L330 HydrophobicContact CD2-CD1 3.79Å; L318-M342 HydrophobicContact CD1-CE 3.56Å; L318-M342 HydrophobicContact CD1-SD 4.14Å; L318-P350 HydrophobicContact CB-CB 3.68Å; L318-P350 HydrophobicContact CB-CG 3.71Å; L318-P350 HydrophobicContact CD1-CG 4.34Å; L318-G352 WeakPolarHBondContact O-CA 3.48Å; L318-G352 PolarHBondContact O-N 3.31Å; L318-I353 HydrophobicContact CB-CG2 4.01Å; L318-I353 HydrophobicContact CD1-CG2 4.43Å; L318-I353 HydrophobicContact CD2-CG2 3.8Å; L318-I353 HydrophobicContact CG-CG2 4.29Å; L318-L365 HydrophobicContact CD1-CD1 4.05Å; L318-L365 HydrophobicContact CD2-CD1 4.39Å |
| 319 | Q | 93.5 | Very high | 91.8 | Very high | 64 Ų | 64 | 40.3 Ų | 40.3 | 30% | 0.299 | 20% | 0.204 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -65.9 | -24.2 | 176.5 | -164.3 | 67.2 | 0.1 | 0 | 0 | 112.4 | F286 Y315 M316 Y317 P350 G352 | F286-Q319 HydrophobicContact CD2-CB 4.31Å; F286-Q319 HydrophobicContact CE2-CB 4.29Å; F286-Q319 HydrophobicContact CE2-CG 4.09Å; Y315-Q319 PolarHBondContact O-N 3.45Å; Y315-Q319 VanDerWaalsContact O-N 3.13Å; M316-Q319 VanDerWaalsContact O-CB 3.28Å; M316-Q319 WeakPolarHBondContact O-CB 3.46Å; M316-Q319 PolarHBondContact O-N 2.97Å; Y317-Q319 PolarHBondContact O-N 3.48Å; Q319-P350 VanDerWaalsContact OE1-CA 3.22Å; Q319-G352 PolarHBondContact O-N 3.37Å |
| 320 | R | 91.4 | Very high | 91.7 | Very high | 116 Ų | 116 | 36.2 Ų | 36.2 | 44% | 0.438 | 18% | 0.182 | S | C | . | . | S | Bend | trans | -113.8 | 117.8 | -176.6 | -58.1 | -71.2 | -79.4 | 150.9 | 3.7 | 110.4 | F286 Y317 L318 F322 N323 | F286-R320 HydrophobicContact CD2-CG 4.11Å; F286-R320 HydrophobicContact CE2-CG 3.88Å; F286-R320 HydrophobicContact CZ-CG 4.19Å; Y317-R320 PolarHBondContact O-N 2.85Å; L318-R320 PolarHBondContact O-N 3Å; R320-F322 VanDerWaalsContact C-N 3.28Å; R320-F322 HydrophobicContact CB-CD1 4.06Å; R320-F322 HydrophobicContact CB-CE1 3.66Å; R320-F322 HydrophobicContact CB-CZ 4.14Å; R320-F322 HydrophobicContact CG-CE1 4.14Å; R320-F322 HydrophobicContact CG-CZ 4.5Å; R320-F322 PolarHBondContact O-N 3.09Å; R320-N323 HydrophobicContact CB-CB 4.49Å; R320-N323 WeakPolarHBondContact O-CB 3.23Å; R320-N323 PolarHBondContact O-N 3Å |
| 321 | S | 88.8 | Confident | 91.3 | Very high | 39 Ų | 39 | 38.9 Ų | 38.9 | 27% | 0.273 | 20% | 0.204 | S | C | . | . | H | α-helix | trans | -57.1 | -34.3 | -176.6 | 53.9 | 0 | 0 | 0 | 0 | 114.6 | N323 V324 L355 | S321-N323 VanDerWaalsContact C-N 3.33Å; S321-N323 PolarHBondContact O-N 3.24Å; S321-V324 WeakPolarHBondContact O-CB 3.43Å; S321-V324 PolarHBondContact O-N 3.42Å; S321-L355 VanDerWaalsContact CB-CD1 3.47Å |
| 322 | F | 87.8 | Confident | 90.9 | Very high | 80 Ų | 80 | 42.1 Ų | 42.1 | 35% | 0.351 | 21% | 0.214 | S | C | . | . | H | α-helix | trans | -70 | -27.5 | 178.4 | 71.4 | -92.8 | 0 | 0 | 0 | 113.3 | R320 V324 R325 | R320-F322 VanDerWaalsContact C-N 3.28Å; R320-F322 HydrophobicContact CB-CD1 4.06Å; R320-F322 HydrophobicContact CB-CE1 3.66Å; R320-F322 HydrophobicContact CB-CZ 4.14Å; R320-F322 HydrophobicContact CG-CE1 4.14Å; R320-F322 HydrophobicContact CG-CZ 4.5Å; R320-F322 PolarHBondContact O-N 3.09Å; F322-V324 VanDerWaalsContact C-N 3.33Å; F322-R325 PolarHBondContact O-N 2.79Å |
| 323 | N | 89.3 | Confident | 90.6 | Very high | 4 Ų | 4 | 42 Ų | 42 | 2% | 0.021 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -67.2 | -39.6 | 173.5 | -68.5 | -13.6 | 0 | 0 | 0 | 110.3 | C285 F286 G288 Y317 R320 S321 R325 D326 | C285-N323 PolarHBondContact O-ND2 3.3Å; C285-N323 VanDerWaalsContact O-ND2 3.13Å; F286-N323 PolarHBondContact O-ND2 3.3Å; G288-N323 WeakPolarHBondContact CA-OD1 3.4Å; Y317-N323 HydrophobicContact CD1-CB 4.1Å; Y317-N323 HydrophobicContact CD2-CB 4.1Å; Y317-N323 HydrophobicContact CE1-CB 3.82Å; Y317-N323 WeakPolarHBondContact CE1-O 3.17Å; Y317-N323 HydrophobicContact CE2-CB 3.85Å; Y317-N323 HydrophobicContact CG-CB 4.24Å; Y317-N323 VanDerWaalsContact CZ-O 3.3Å; Y317-N323 WeakPolarHBondContact O-CB 3.36Å; Y317-N323 PolarHBondContact O-ND2 3.33Å; Y317-N323 VanDerWaalsContact O-ND2 3.12Å; Y317-N323 PolarHBondContact OH-O 3.28Å; R320-N323 HydrophobicContact CB-CB 4.49Å; R320-N323 WeakPolarHBondContact O-CB 3.23Å; R320-N323 PolarHBondContact O-N 3Å; S321-N323 VanDerWaalsContact C-N 3.33Å; S321-N323 PolarHBondContact O-N 3.24Å; N323-R325 PolarHBondContact O-N 3.05Å; N323-R325 VanDerWaalsContact O-N 3.15Å; N323-D326 PolarHBondContact O-N 3.24Å |
| 324 | V | 87.8 | Confident | 90.3 | Very high | 3 Ų | 3 | 43.3 Ų | 43.3 | 2% | 0.018 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -61.4 | -25.6 | -178.6 | -172.9 | 0 | 0 | 0 | 0 | 112.1 | L318 S321 F322 D326 L330 I353 F358 L361 | L318-V324 HydrophobicContact CD2-CG2 4.02Å; S321-V324 WeakPolarHBondContact O-CB 3.43Å; S321-V324 PolarHBondContact O-N 3.42Å; F322-V324 VanDerWaalsContact C-N 3.33Å; V324-D326 VanDerWaalsContact C-N 3.31Å; V324-L330 HydrophobicContact CG1-CD2 4.49Å; V324-I353 HydrophobicContact CG1-CG2 4.46Å; V324-I353 HydrophobicContact CG2-CG2 4.13Å; V324-F358 HydrophobicContact CB-CD1 4.39Å; V324-F358 HydrophobicContact CB-CE1 3.98Å; V324-F358 HydrophobicContact CB-CE2 4.22Å; V324-F358 HydrophobicContact CB-CZ 3.89Å; V324-F358 HydrophobicContact CG1-CD1 3.56Å; V324-F358 HydrophobicContact CG1-CD2 4.33Å; V324-F358 HydrophobicContact CG1-CE1 3.56Å; V324-F358 HydrophobicContact CG1-CE2 4.33Å; V324-F358 HydrophobicContact CG1-CG 3.97Å; V324-F358 HydrophobicContact CG1-CZ 3.96Å; V324-L361 HydrophobicContact CG1-CD2 3.24Å |
| 325 | R | 86.6 | Confident | 89.8 | Confident | 158 Ų | 158 | 46.5 Ų | 46.5 | 60% | 0.596 | 23% | 0.233 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -72.5 | -22.9 | 177.4 | -62.1 | -180 | -178.9 | -166.8 | -4.4 | 113.2 | F322 N323 T327 E357 F358 | F322-R325 PolarHBondContact O-N 2.79Å; N323-R325 PolarHBondContact O-N 3.05Å; N323-R325 VanDerWaalsContact O-N 3.15Å; R325-T327 PolarHBondContact O-N 2.94Å; R325-T327 VanDerWaalsContact O-N 3.12Å; R325-E357 IonicContact CZ-OE1 3.34Å; R325-E357 IonicContact NE-OE1 2.62Å; R325-E357 IonicContact NH2-OE1 3.14Å; R325-E357 PolarHBondContact NH2-OE1 3.42Å; R325-E357 IonicContact NH2-OE2 3.75Å; R325-E357 PolarHBondContact NH2-OE2 3.37Å; R325-F358 HydrophobicContact CG-CE1 4.38Å; R325-F358 HydrophobicContact CG-CZ 3.99Å |
| 326 | D | 88.8 | Confident | 89.2 | Confident | 57 Ų | 57 | 48.2 Ų | 48.2 | 31% | 0.305 | 24% | 0.241 | S | C | . | . | trans | -81.3 | 88 | 171.3 | -173.2 | -17.4 | 0 | 0 | 0 | 109.3 | Y317 N323 V324 A328 L329 L330 | Y317-D326 PolarHBondContact OH-O 3.05Å; N323-D326 PolarHBondContact O-N 3.24Å; V324-D326 VanDerWaalsContact C-N 3.31Å; D326-A328 VanDerWaalsContact C-N 3.3Å; D326-A328 PolarHBondContact O-N 3.19Å; D326-A328 PolarHBondContact OD1-N 3.47Å; D326-L329 HydrophobicContact CB-CB 4.27Å; D326-L329 VanDerWaalsContact CG-CB 3.44Å; D326-L329 WeakPolarHBondContact OD1-CB 3.46Å; D326-L329 PolarHBondContact OD1-N 3.27Å; D326-L329 WeakPolarHBondContact OD2-CB 3.48Å; D326-L330 VanDerWaalsContact O-CB 3.28Å; D326-L330 WeakPolarHBondContact O-CB 3.45Å; D326-L330 PolarHBondContact O-N 3.22Å | ||
| 327 | T | 87.3 | Confident | 88.7 | Confident | 106 Ų | 106 | 47.5 Ų | 47.5 | 65% | 0.65 | 24% | 0.238 | S | C | * | . | H | α-helix | trans | -67.5 | -31.5 | -176.7 | 54.7 | 0 | 0 | 0 | 0 | 112.3 | R325 A331 | R325-T327 PolarHBondContact O-N 2.94Å; R325-T327 VanDerWaalsContact O-N 3.12Å; T327-A331 VanDerWaalsContact O-CB 3.23Å; T327-A331 WeakPolarHBondContact O-CB 3.43Å; T327-A331 PolarHBondContact O-N 3.38Å |
| 328 | A | 88.8 | Confident | 88.2 | Confident | 61 Ų | 61 | 49.4 Ų | 49.4 | 50% | 0.504 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -68.8 | -49.6 | 179.7 | 0 | 0 | 0 | 0 | 0 | 110.8 | D326 A331 R332 | D326-A328 VanDerWaalsContact C-N 3.3Å; D326-A328 PolarHBondContact O-N 3.19Å; D326-A328 PolarHBondContact OD1-N 3.47Å; A328-A331 PolarHBondContact O-N 2.9Å; A328-R332 VanDerWaalsContact O-CG 3.31Å; A328-R332 WeakPolarHBondContact O-CG 3.33Å; A328-R332 PolarHBondContact O-N 3.34Å; A328-R332 VanDerWaalsContact O-N 3.08Å |
| 329 | L | 89.3 | Confident | 87.8 | Confident | 1 Ų | 1 | 53.6 Ų | 53.6 | 1% | 0.005 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -66.2 | -39.5 | 177.4 | -177.7 | 59 | 0 | 0 | 0 | 111.8 | E290 I293 Y317 D326 R332 L333 | E290-L329 HydrophobicContact CB-CD1 4.19Å; E290-L329 HydrophobicContact CB-CD2 4.04Å; E290-L329 HydrophobicContact CG-CD1 4.11Å; I293-L329 HydrophobicContact CD1-CD1 4.2Å; I293-L329 HydrophobicContact CD1-CD2 3.94Å; I293-L329 HydrophobicContact CD1-CG 4.42Å; I293-L329 HydrophobicContact CG2-CD1 4.39Å; Y317-L329 HydrophobicContact CE2-CD2 3.62Å; Y317-L329 HydrophobicContact CE2-CG 3.86Å; D326-L329 HydrophobicContact CB-CB 4.27Å; D326-L329 VanDerWaalsContact CG-CB 3.44Å; D326-L329 WeakPolarHBondContact OD1-CB 3.46Å; D326-L329 PolarHBondContact OD1-N 3.27Å; D326-L329 WeakPolarHBondContact OD2-CB 3.48Å; L329-R332 PolarHBondContact O-N 2.89Å; L329-L333 HydrophobicContact CG-CD1 4.47Å; L329-L333 PolarHBondContact O-N 2.98Å |
| 330 | L | 91.2 | Very high | 87.5 | Confident | 8 Ų | 8 | 51.7 Ų | 51.7 | 4% | 0.042 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -60 | -49.1 | 174.4 | 178.2 | 58 | 0 | 0 | 0 | 111.6 | I314 Y317 L318 V324 D326 R332 L333 L334 L361 | I314-L330 HydrophobicContact CD1-CD1 3.83Å; Y317-L330 HydrophobicContact CD1-CD1 4Å; Y317-L330 HydrophobicContact CE1-CB 3.94Å; Y317-L330 HydrophobicContact CE1-CD1 3.89Å; Y317-L330 HydrophobicContact CE1-CG 4.44Å; L318-L330 HydrophobicContact CD2-CD1 3.79Å; V324-L330 HydrophobicContact CG1-CD2 4.49Å; D326-L330 VanDerWaalsContact O-CB 3.28Å; D326-L330 WeakPolarHBondContact O-CB 3.45Å; D326-L330 PolarHBondContact O-N 3.22Å; L330-R332 VanDerWaalsContact C-N 3.28Å; L330-R332 PolarHBondContact O-N 3.27Å; L330-L333 PolarHBondContact O-N 3.4Å; L330-L334 HydrophobicContact CD1-CD1 4.01Å; L330-L334 HydrophobicContact CD1-CG 4Å; L330-L334 HydrophobicContact CG-CD1 3.9Å; L330-L334 HydrophobicContact CG-CG 4.35Å; L330-L334 WeakPolarHBondContact O-CB 3.41Å; L330-L334 VanDerWaalsContact O-CG 3.27Å; L330-L334 WeakPolarHBondContact O-CG 3.33Å; L330-L334 PolarHBondContact O-N 3.24Å; L330-L361 HydrophobicContact CD2-CD1 4.26Å; L330-L361 HydrophobicContact CD2-CD2 3.91Å |
| 331 | A | 87.7 | Confident | 87.3 | Confident | 57 Ų | 57 | 49.4 Ų | 49.4 | 47% | 0.471 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -59 | -40.4 | 178.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | T327 A328 Y335 | T327-A331 VanDerWaalsContact O-CB 3.23Å; T327-A331 WeakPolarHBondContact O-CB 3.43Å; T327-A331 PolarHBondContact O-N 3.38Å; A328-A331 PolarHBondContact O-N 2.9Å; A331-Y335 VanDerWaalsContact O-CB 3.26Å; A331-Y335 WeakPolarHBondContact O-CB 3.1Å; A331-Y335 PolarHBondContact O-N 3.19Å |
| 332 | R | 86.3 | Confident | 87.4 | Confident | 95 Ų | 95 | 47.9 Ų | 47.9 | 36% | 0.358 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -65.3 | -46.1 | 175.9 | -71.7 | 174.7 | 63.3 | -179.4 | 3 | 112.8 | E290 N294 A328 L329 L330 Y335 H336 | E290-R332 IonicContact OE1-CZ 3.97Å; E290-R332 IonicContact OE1-NH1 2.74Å; E290-R332 PolarHBondContact OE1-NH1 3.38Å; N294-R332 PolarHBondContact ND2-NH1 3.3Å; N294-R332 PolarHBondContact ND2-NH2 3.02Å; N294-R332 VanDerWaalsContact OD1-CZ 3.22Å; N294-R332 PolarHBondContact OD1-NH1 2.9Å; N294-R332 PolarHBondContact OD1-NH2 3.45Å; A328-R332 VanDerWaalsContact O-CG 3.31Å; A328-R332 WeakPolarHBondContact O-CG 3.33Å; A328-R332 PolarHBondContact O-N 3.34Å; A328-R332 VanDerWaalsContact O-N 3.08Å; L329-R332 PolarHBondContact O-N 2.89Å; L330-R332 VanDerWaalsContact C-N 3.28Å; L330-R332 PolarHBondContact O-N 3.27Å; R332-Y335 WeakPolarHBondContact O-CB 3.44Å; R332-Y335 PolarHBondContact O-N 3.28Å; R332-H336 PolarHBondContact O-CD2 3.44Å; R332-H336 PolarHBondContact O-N 3.28Å |
| 333 | L | 89 | Confident | 87.5 | Confident | 2 Ų | 2 | 46.4 Ų | 46.4 | 1% | 0.01 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -62.9 | -44.8 | 176.4 | -76.2 | 174.3 | 0 | 0 | 0 | 111.3 | I293 I314 Y317 L329 L330 Y335 H336 T337 | I293-L333 HydrophobicContact CD1-CD1 4.48Å; I293-L333 HydrophobicContact CG2-CD2 3.77Å; I314-L333 HydrophobicContact CD1-CB 3.83Å; I314-L333 HydrophobicContact CD1-CD1 4.43Å; Y317-L333 HydrophobicContact CD1-CD1 4.2Å; Y317-L333 HydrophobicContact CD2-CD1 3.37Å; Y317-L333 HydrophobicContact CE1-CD1 4.48Å; Y317-L333 HydrophobicContact CE2-CD1 3.69Å; Y317-L333 HydrophobicContact CG-CD1 3.64Å; L329-L333 HydrophobicContact CG-CD1 4.47Å; L329-L333 PolarHBondContact O-N 2.98Å; L330-L333 PolarHBondContact O-N 3.4Å; L333-Y335 PolarHBondContact O-N 3.4Å; L333-H336 PolarHBondContact O-N 3.13Å; L333-T337 WeakPolarHBondContact O-CB 3.35Å; L333-T337 PolarHBondContact O-N 3.4Å; L333-T337 PolarHBondContact O-OG1 3.32Å |
| 334 | L | 88.2 | Confident | 87.7 | Confident | 29 Ų | 29 | 46.8 Ų | 46.8 | 15% | 0.152 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -57.7 | -42 | 174.2 | -71.9 | 171.5 | 0 | 0 | 0 | 110.4 | I314 L330 H336 T337 L340 L365 R381 | I314-L334 HydrophobicContact CD1-CD2 4.09Å; I314-L334 HydrophobicContact CD1-CG 4.34Å; I314-L334 HydrophobicContact CG1-CD2 4.11Å; L330-L334 HydrophobicContact CD1-CD1 4.01Å; L330-L334 HydrophobicContact CD1-CG 4Å; L330-L334 HydrophobicContact CG-CD1 3.9Å; L330-L334 HydrophobicContact CG-CG 4.35Å; L330-L334 WeakPolarHBondContact O-CB 3.41Å; L330-L334 VanDerWaalsContact O-CG 3.27Å; L330-L334 WeakPolarHBondContact O-CG 3.33Å; L330-L334 PolarHBondContact O-N 3.24Å; L334-H336 PolarHBondContact O-N 2.72Å; L334-T337 PolarHBondContact O-N 3.1Å; L334-L340 HydrophobicContact CD2-CD1 3.68Å; L334-L340 HydrophobicContact CD2-CD2 4.21Å; L334-L365 HydrophobicContact CD1-CD2 3.65Å; L334-L365 HydrophobicContact CD2-CD2 3.7Å; L334-L365 HydrophobicContact CG-CD2 4.34Å; L334-R381 PolarHBondContact O-NH2 3.39Å |
| 335 | Y | 83.7 | Confident | 88 | Confident | 67 Ų | 67 | 51.5 Ų | 51.5 | 26% | 0.263 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -60.7 | -39.8 | 177.6 | -178.6 | -94.3 | 0 | 0 | 0 | 113.2 | A331 R332 L333 R381 R384 L413 | A331-Y335 VanDerWaalsContact O-CB 3.26Å; A331-Y335 WeakPolarHBondContact O-CB 3.1Å; A331-Y335 PolarHBondContact O-N 3.19Å; R332-Y335 WeakPolarHBondContact O-CB 3.44Å; R332-Y335 PolarHBondContact O-N 3.28Å; L333-Y335 PolarHBondContact O-N 3.4Å; Y335-R381 VanDerWaalsContact C-NH2 3.25Å; Y335-R381 VanDerWaalsContact CA-NH2 3.31Å; Y335-R381 PolarHBondContact O-NE 3.13Å; Y335-R381 PolarHBondContact O-NH2 3.06Å; Y335-R384 WeakPolarHBondContact OH-CD 3.45Å; Y335-R384 PolarHBondContact OH-NH1 2.84Å; Y335-L413 HydrophobicContact CD2-CD1 4.06Å; Y335-L413 HydrophobicContact CE2-CD1 4.17Å |
| 336 | H | 82.3 | Confident | 88.3 | Confident | 47 Ų | 47 | 51 Ų | 51 | 22% | 0.218 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -79.6 | -23 | 176.3 | -70.5 | -66.8 | 0 | 0 | 0 | 113.6 | V303 R332 L333 L334 N385 | V303-H336 HydrophobicContact CG1-CB 4.4Å; V303-H336 HydrophobicContact CG2-CB 3.95Å; V303-H336 VanDerWaalsContact CG2-O 3.31Å; V303-H336 WeakPolarHBondContact CG2-O 3.47Å; R332-H336 PolarHBondContact O-CD2 3.44Å; R332-H336 PolarHBondContact O-N 3.28Å; L333-H336 PolarHBondContact O-N 3.13Å; L334-H336 PolarHBondContact O-N 2.72Å; H336-N385 PolarHBondContact ND1-OD1 3.36Å; H336-N385 PolarHBondContact O-ND2 3.05Å; H336-N385 VanDerWaalsContact O-ND2 3.11Å |
| 337 | T | 85.8 | Confident | 88.4 | Confident | 1 Ų | 1 | 50.7 Ų | 50.7 | 1% | 0.006 | 28% | 0.283 | C | S | . | . | trans | -83.3 | 122.8 | -174.3 | -55 | 0 | 0 | 0 | 0 | 111.9 | N304 I314 L333 L334 L340 R381 | N304-T337 WeakPolarHBondContact OD1-CG2 3.42Å; I314-T337 HydrophobicContact CB-CG2 4.46Å; I314-T337 HydrophobicContact CG2-CG2 3.92Å; L333-T337 WeakPolarHBondContact O-CB 3.35Å; L333-T337 PolarHBondContact O-N 3.4Å; L333-T337 PolarHBondContact O-OG1 3.32Å; L334-T337 PolarHBondContact O-N 3.1Å; T337-L340 HydrophobicContact CG2-CD1 4.2Å; T337-R381 PolarHBondContact O-NH1 3.26Å; T337-R381 PolarHBondContact O-NH2 3.2Å | ||
| 338 | Y | 84 | Confident | 88.7 | Confident | 42 Ų | 42 | 49.7 Ų | 49.7 | 17% | 0.165 | 27% | 0.273 | C | S | . | . | S | Bend | trans | -161.6 | 133.1 | 168.3 | -173.2 | -95.2 | 0 | 0 | 0 | 111.1 | N304 L373 I378 | N304-Y338 VanDerWaalsContact CG-O 3.25Å; N304-Y338 PolarHBondContact ND2-O 3.27Å; N304-Y338 VanDerWaalsContact ND2-O 3.1Å; N304-Y338 PolarHBondContact OD1-N 3.41Å; N304-Y338 PolarHBondContact OD1-O 2.82Å; Y338-L373 HydrophobicContact CD2-CD1 3.48Å; Y338-L373 VanDerWaalsContact CD2-CD1 3.48Å; Y338-L373 HydrophobicContact CD2-CG 4.07Å; Y338-L373 HydrophobicContact CE2-CB 3.76Å; Y338-L373 HydrophobicContact CE2-CD1 3.48Å; Y338-L373 VanDerWaalsContact CE2-CD1 3.48Å; Y338-L373 HydrophobicContact CE2-CG 3.56Å; Y338-L373 HydrophobicContact CG-CD1 4.12Å; Y338-L373 PolarHBondContact OH-N 2.94Å; Y338-L373 VanDerWaalsContact OH-N 3.08Å; Y338-I378 HydrophobicContact CD1-CG1 4.21Å; Y338-I378 HydrophobicContact CD1-CG2 4.18Å; Y338-I378 HydrophobicContact CE1-CB 4.26Å; Y338-I378 HydrophobicContact CE1-CD1 3.59Å; Y338-I378 HydrophobicContact CE1-CG1 3.41Å; Y338-I378 VanDerWaalsContact CE1-CG1 3.41Å; Y338-I378 HydrophobicContact CE1-CG2 3.98Å; Y338-I378 WeakPolarHBondContact OH-CD1 3.45Å |
| 339 | P | 85.8 | Confident | 89 | Confident | 89 Ų | 89 | 48.6 Ų | 48.6 | 58% | 0.578 | 26% | 0.258 | S | S | * | . | S | Bend | cis | -67.1 | 144.6 | -3.3 | 28.3 | -34.8 | 0 | 0 | 0 | 112.2 | R341 | P339-R341 PolarHBondContact O-N 3.28Å; P339-R341 VanDerWaalsContact O-N 3.1Å |
| 340 | L | 87.4 | Confident | 89.2 | Confident | 23 Ų | 23 | 48.5 Ų | 48.5 | 12% | 0.12 | 26% | 0.258 | C | S | . | . | trans | -73.3 | 105.9 | 177.5 | 179.4 | 63.1 | 0 | 0 | 0 | 109 | I314 L334 T337 M342 L365 Q368 S369 | I314-L340 HydrophobicContact CG1-CD1 4.44Å; I314-L340 HydrophobicContact CG2-CD1 4.13Å; L334-L340 HydrophobicContact CD2-CD1 3.68Å; L334-L340 HydrophobicContact CD2-CD2 4.21Å; T337-L340 HydrophobicContact CG2-CD1 4.2Å; L340-M342 HydrophobicContact CD1-SD 3.91Å; L340-M342 HydrophobicContact CD2-CG 4.4Å; L340-M342 HydrophobicContact CD2-SD 4.11Å; L340-M342 HydrophobicContact CG-CG 4.15Å; L340-M342 HydrophobicContact CG-SD 3.94Å; L340-L365 HydrophobicContact CD2-CD2 4.4Å; L340-Q368 HydrophobicContact CD2-CB 4.05Å; L340-S369 VanDerWaalsContact O-CB 3.26Å; L340-S369 WeakPolarHBondContact O-CB 3.36Å | ||
| 341 | R | 87.3 | Confident | 89.3 | Confident | 69 Ų | 69 | 50.8 Ų | 50.8 | 26% | 0.26 | 28% | 0.278 | S | S | . | . | trans | -104.7 | 110.8 | 178.1 | -169 | 156.2 | 173.5 | -104 | -6.8 | 110.5 | G310 S312 P339 N345 | G310-R341 VanDerWaalsContact C-NH1 3.3Å; G310-R341 VanDerWaalsContact CA-NH1 3.33Å; G310-R341 PolarHBondContact O-NH1 3.22Å; S312-R341 PolarHBondContact OG-O 3.5Å; P339-R341 PolarHBondContact O-N 3.28Å; P339-R341 VanDerWaalsContact O-N 3.1Å; R341-N345 PolarHBondContact NH2-OD1 3.34Å | ||
| 342 | M | 90.1 | Very high | 89.4 | Confident | 7 Ų | 7 | 48.3 Ų | 48.3 | 3% | 0.034 | 26% | 0.258 | C | S | . | . | trans | -92.4 | -13.7 | -174.3 | -67.5 | -58.9 | -60.4 | 0 | 0 | 113.9 | L318 L340 L349 P350 I353 L365 | L318-M342 HydrophobicContact CD1-CE 3.56Å; L318-M342 HydrophobicContact CD1-SD 4.14Å; L340-M342 HydrophobicContact CD1-SD 3.91Å; L340-M342 HydrophobicContact CD2-CG 4.4Å; L340-M342 HydrophobicContact CD2-SD 4.11Å; L340-M342 HydrophobicContact CG-CG 4.15Å; L340-M342 HydrophobicContact CG-SD 3.94Å; M342-L349 HydrophobicContact CB-CD2 4.1Å; M342-P350 WeakPolarHBondContact O-CD 3.41Å; M342-I353 HydrophobicContact CE-CD1 3.73Å; M342-L365 HydrophobicContact CE-CB 3.56Å; M342-L365 HydrophobicContact CE-CD1 3.76Å; M342-L365 HydrophobicContact CE-CG 4.28Å; M342-L365 HydrophobicContact SD-CB 3.91Å; M342-L365 HydrophobicContact SD-CD1 4.44Å | ||
| 343 | T | 91.9 | Very high | 89.7 | Confident | 49 Ų | 49 | 43.8 Ų | 43.8 | 30% | 0.301 | 24% | 0.241 | S | C | . | . | S | Bend | trans | -123.9 | 152.6 | -176.8 | 55.8 | 0 | 0 | 0 | 0 | 111.9 | G347 I348 L349 | T343-G347 WeakPolarHBondContact CG2-O 3.2Å; T343-I348 VanDerWaalsContact CA-O 3.27Å; T343-I348 WeakPolarHBondContact CA-O 3.24Å; T343-L349 HydrophobicContact CG2-CD2 3.83Å; T343-L349 HydrophobicContact CG2-CG 4.21Å |
| 344 | N | 92.9 | Very high | 89.9 | Confident | 11 Ų | 11 | 48.4 Ų | 48.4 | 6% | 0.059 | 26% | 0.264 | C | S | . | . | trans | -77.1 | -175.4 | 170.1 | 73.5 | 1.9 | 0 | 0 | 0 | 111.1 | N309 E311 Y315 Q346 G347 I348 | N309-N344 WeakPolarHBondContact O-CB 3.46Å; E311-N344 HydrophobicContact CG-CB 3.88Å; Y315-N344 HydrophobicContact CE2-CB 4.08Å; N344-Q346 PolarHBondContact O-N 3.1Å; N344-Q346 VanDerWaalsContact O-N 3.15Å; N344-Q346 WeakPolarHBondContact OD1-CA 3.04Å; N344-Q346 WeakPolarHBondContact OD1-CB 3.47Å; N344-Q346 PolarHBondContact OD1-N 2.94Å; N344-G347 PolarHBondContact O-N 2.85Å; N344-G347 PolarHBondContact OD1-N 3.34Å; N344-I348 PolarHBondContact N-O 3.36Å; N344-I348 PolarHBondContact OD1-N 3.04Å | ||
| 345 | N | 92.9 | Very high | 90 | Very high | 103 Ų | 103 | 50.4 Ų | 50.4 | 55% | 0.551 | 27% | 0.274 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.6 | -19.1 | 178.5 | -71 | -11.9 | 0 | 0 | 0 | 113.7 | R308 N309 G310 R341 | R308-N345 PolarHBondContact O-ND2 2.85Å; R308-N345 VanDerWaalsContact O-ND2 3.14Å; N309-N345 VanDerWaalsContact C-CG 3.47Å; N309-N345 VanDerWaalsContact C-ND2 3.29Å; N309-N345 WeakPolarHBondContact O-CB 3.39Å; N309-N345 VanDerWaalsContact O-CG 3.24Å; N309-N345 PolarHBondContact O-N 3.29Å; N309-N345 PolarHBondContact O-ND2 3.48Å; G310-N345 VanDerWaalsContact CA-OD1 3.26Å; G310-N345 WeakPolarHBondContact CA-OD1 3.43Å; G310-N345 PolarHBondContact N-ND2 3.31Å; R341-N345 PolarHBondContact NH2-OD1 3.34Å |
| 346 | Q | 93.2 | Very high | 90.3 | Very high | 148 Ų | 148 | 52.9 Ų | 52.9 | 69% | 0.692 | 30% | 0.298 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91.6 | 0.7 | 176.9 | -61.3 | 172.7 | -10.2 | 0 | 0 | 112.5 | N344 I348 | N344-Q346 PolarHBondContact O-N 3.1Å; N344-Q346 VanDerWaalsContact O-N 3.15Å; N344-Q346 WeakPolarHBondContact OD1-CA 3.04Å; N344-Q346 WeakPolarHBondContact OD1-CB 3.47Å; N344-Q346 PolarHBondContact OD1-N 2.94Å; Q346-I348 VanDerWaalsContact C-N 3.26Å; Q346-I348 HydrophobicContact CB-CD1 3.96Å; Q346-I348 HydrophobicContact CB-CG1 3.97Å; Q346-I348 PolarHBondContact O-N 2.9Å; Q346-I348 VanDerWaalsContact OE1-CD1 3.23Å |
| 347 | G | 92 | Very high | 90.8 | Very high | 49 Ų | 49 | 55.8 Ų | 55.8 | 51% | 0.505 | 31% | 0.312 | S | S | . | . | trans | 76.9 | 9.7 | -176.7 | 0 | 0 | 0 | 0 | 0 | 114.3 | T343 N344 | T343-G347 WeakPolarHBondContact CG2-O 3.2Å; N344-G347 PolarHBondContact O-N 2.85Å; N344-G347 PolarHBondContact OD1-N 3.34Å | ||
| 348 | I | 93.8 | Very high | 91 | Very high | 85 Ų | 85 | 56.9 Ų | 56.9 | 44% | 0.436 | 32% | 0.317 | S | S | . | . | P | Polyproline II helix | trans | -82.3 | 139.2 | -177.5 | -57.4 | 175 | 0 | 0 | 0 | 109.7 | Y315 T343 N344 Q346 | Y315-I348 WeakPolarHBondContact CE2-O 3.44Å; T343-I348 VanDerWaalsContact CA-O 3.27Å; T343-I348 WeakPolarHBondContact CA-O 3.24Å; N344-I348 PolarHBondContact N-O 3.36Å; N344-I348 PolarHBondContact OD1-N 3.04Å; Q346-I348 VanDerWaalsContact C-N 3.26Å; Q346-I348 HydrophobicContact CB-CD1 3.96Å; Q346-I348 HydrophobicContact CB-CG1 3.97Å; Q346-I348 PolarHBondContact O-N 2.9Å; Q346-I348 VanDerWaalsContact OE1-CD1 3.23Å |
| 349 | L | 94.1 | Very high | 91.4 | Very high | 38 Ų | 38 | 62.7 Ų | 62.7 | 20% | 0.199 | 34% | 0.338 | C | S | . | . | P | Polyproline II helix | trans | -85.1 | 153.1 | 174.4 | -71.3 | 166.9 | 0 | 0 | 0 | 111.6 | M342 T343 I353 M354 R362 I366 | M342-L349 HydrophobicContact CB-CD2 4.1Å; T343-L349 HydrophobicContact CG2-CD2 3.83Å; T343-L349 HydrophobicContact CG2-CG 4.21Å; L349-I353 HydrophobicContact CD2-CD1 4.41Å; L349-M354 HydrophobicContact CB-SD 4.06Å; L349-M354 HydrophobicContact CD1-SD 4.06Å; L349-R362 HydrophobicContact CD1-CG 4.45Å; L349-I366 HydrophobicContact CD1-CD1 3.97Å; L349-I366 HydrophobicContact CD2-CD1 4.43Å; L349-I366 HydrophobicContact CD2-CG1 4.36Å |
| 350 | P | 94.4 | Very high | 91.7 | Very high | 0 Ų | 0 | 66.6 Ų | 66.6 | 0% | 0 | 35% | 0.346 | C | S | . | . | P | Polyproline II helix | trans | -57.3 | 138.6 | 176.1 | -18.8 | 23.1 | 0 | 0 | 0 | 112.8 | Y315 L318 Q319 M342 G352 I353 M354 | Y315-P350 HydrophobicContact CD2-CB 4.45Å; Y315-P350 HydrophobicContact CD2-CG 3.51Å; Y315-P350 HydrophobicContact CE2-CB 4.39Å; Y315-P350 HydrophobicContact CE2-CG 3.76Å; Y315-P350 HydrophobicContact CG-CG 3.96Å; L318-P350 HydrophobicContact CB-CB 3.68Å; L318-P350 HydrophobicContact CB-CG 3.71Å; L318-P350 HydrophobicContact CD1-CG 4.34Å; Q319-P350 VanDerWaalsContact OE1-CA 3.22Å; M342-P350 WeakPolarHBondContact O-CD 3.41Å; P350-G352 VanDerWaalsContact C-N 3.3Å; P350-G352 PolarHBondContact O-N 3.22Å; P350-I353 HydrophobicContact CB-CG1 4.23Å; P350-I353 HydrophobicContact CG-CD1 4.2Å; P350-I353 HydrophobicContact CG-CG1 4.43Å; P350-I353 WeakPolarHBondContact O-CG1 3.4Å; P350-I353 PolarHBondContact O-N 3.01Å; P350-M354 WeakPolarHBondContact O-CG 3.31Å |
| 351 | A | 93.3 | Very high | 91.9 | Very high | 56 Ų | 56 | 67.7 Ų | 67.7 | 46% | 0.463 | 35% | 0.352 | S | S | . | . | G | 310 helix | trans | -62.9 | -34.4 | -174.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | I353 M354 | A351-I353 VanDerWaalsContact C-N 3.3Å; A351-I353 PolarHBondContact O-N 3.41Å; A351-M354 WeakPolarHBondContact O-CB 3.33Å; A351-M354 PolarHBondContact O-N 3.16Å; A351-M354 VanDerWaalsContact O-N 3.14Å |
| 352 | G | 89.9 | Confident | 92.1 | Very high | 4 Ų | 4 | 66.7 Ų | 66.7 | 4% | 0.041 | 35% | 0.348 | C | S | . | . | G | 310 helix | trans | -65.2 | -30.8 | -175.7 | 0 | 0 | 0 | 0 | 0 | 113.7 | L318 Q319 P350 F358 | L318-G352 WeakPolarHBondContact O-CA 3.48Å; L318-G352 PolarHBondContact O-N 3.31Å; Q319-G352 PolarHBondContact O-N 3.37Å; P350-G352 VanDerWaalsContact C-N 3.3Å; P350-G352 PolarHBondContact O-N 3.22Å; G352-F358 WeakPolarHBondContact O-CD2 3.33Å |
| 353 | I | 92 | Very high | 92.2 | Very high | 0 Ų | 0 | 70 Ų | 70 | 0% | 0 | 37% | 0.366 | C | S | . | . | G | 310 helix | trans | -88.7 | -4.2 | 177.2 | 63.1 | 170.4 | 0 | 0 | 0 | 113.6 | L318 V324 M342 L349 P350 A351 L355 R362 | L318-I353 HydrophobicContact CB-CG2 4.01Å; L318-I353 HydrophobicContact CD1-CG2 4.43Å; L318-I353 HydrophobicContact CD2-CG2 3.8Å; L318-I353 HydrophobicContact CG-CG2 4.29Å; V324-I353 HydrophobicContact CG1-CG2 4.46Å; V324-I353 HydrophobicContact CG2-CG2 4.13Å; M342-I353 HydrophobicContact CE-CD1 3.73Å; L349-I353 HydrophobicContact CD2-CD1 4.41Å; P350-I353 HydrophobicContact CB-CG1 4.23Å; P350-I353 HydrophobicContact CG-CD1 4.2Å; P350-I353 HydrophobicContact CG-CG1 4.43Å; P350-I353 WeakPolarHBondContact O-CG1 3.4Å; P350-I353 PolarHBondContact O-N 3.01Å; A351-I353 VanDerWaalsContact C-N 3.3Å; A351-I353 PolarHBondContact O-N 3.41Å; I353-L355 VanDerWaalsContact C-N 3.27Å; I353-R362 HydrophobicContact CB-CB 4.43Å; I353-R362 HydrophobicContact CD1-CB 4.47Å; I353-R362 HydrophobicContact CD1-CG 4.08Å; I353-R362 HydrophobicContact CG1-CG 4.5Å |
| 354 | M | 92.3 | Very high | 92.2 | Very high | 100 Ų | 100 | 69.9 Ų | 69.9 | 49% | 0.493 | 37% | 0.365 | S | S | . | . | G | 310 helix | trans | -80 | -11.9 | 177.1 | -67.6 | -65 | -81.3 | 0 | 0 | 112.7 | L349 P350 A351 | L349-M354 HydrophobicContact CB-SD 4.06Å; L349-M354 HydrophobicContact CD1-SD 4.06Å; P350-M354 WeakPolarHBondContact O-CG 3.31Å; A351-M354 WeakPolarHBondContact O-CB 3.33Å; A351-M354 PolarHBondContact O-N 3.16Å; A351-M354 VanDerWaalsContact O-N 3.14Å |
| 355 | L | 90.9 | Very high | 92.1 | Very high | 70 Ų | 70 | 69.4 Ų | 69.4 | 37% | 0.366 | 36% | 0.363 | S | S | . | . | S | Bend | trans | -63.6 | 143.8 | 174.8 | -62.9 | 174.1 | 0 | 0 | 0 | 111.1 | S321 I353 E357 F358 | S321-L355 VanDerWaalsContact CB-CD1 3.47Å; I353-L355 VanDerWaalsContact C-N 3.27Å; L355-E357 HydrophobicContact CB-CG 3.98Å; L355-E357 PolarHBondContact O-N 3.15Å; L355-E357 VanDerWaalsContact O-N 3.11Å; L355-F358 HydrophobicContact CB-CD2 4.14Å; L355-F358 HydrophobicContact CD1-CD2 4.46Å; L355-F358 HydrophobicContact CD1-CE2 4.21Å; L355-F358 PolarHBondContact O-N 2.94Å |
| 356 | P | 90.1 | Very high | 91.9 | Very high | 119 Ų | 119 | 66.7 Ų | 66.7 | 77% | 0.773 | 35% | 0.348 | S | S | * | . | G | 310 helix | trans | -55.1 | -33.5 | -179 | -26.3 | 34.3 | 0 | 0 | 0 | 113.8 | F358 R359 | P356-F358 PolarHBondContact O-N 3.28Å; P356-R359 WeakPolarHBondContact O-CB 3.37Å; P356-R359 PolarHBondContact O-N 3.25Å |
| 357 | E | 92.3 | Very high | 91.7 | Very high | 109 Ų | 109 | 65.9 Ų | 65.9 | 51% | 0.509 | 34% | 0.342 | S | S | . | . | G | 310 helix | trans | -61.4 | -25.6 | 179.9 | 64 | -176.5 | -154.1 | 0 | 0 | 113.7 | R325 L355 | R325-E357 IonicContact CZ-OE1 3.34Å; R325-E357 IonicContact NE-OE1 2.62Å; R325-E357 IonicContact NH2-OE1 3.14Å; R325-E357 PolarHBondContact NH2-OE1 3.42Å; R325-E357 IonicContact NH2-OE2 3.75Å; R325-E357 PolarHBondContact NH2-OE2 3.37Å; L355-E357 HydrophobicContact CB-CG 3.98Å; L355-E357 PolarHBondContact O-N 3.15Å; L355-E357 VanDerWaalsContact O-N 3.11Å |
| 358 | F | 91.4 | Very high | 91.4 | Very high | 24 Ų | 24 | 68.3 Ų | 68.3 | 11% | 0.105 | 34% | 0.34 | C | S | . | . | G | 310 helix | trans | -105.4 | 14.4 | -178.5 | -58.6 | -60.7 | 0 | 0 | 0 | 113.9 | V324 R325 G352 L355 P356 F360 L361 R362 | V324-F358 HydrophobicContact CB-CD1 4.39Å; V324-F358 HydrophobicContact CB-CE1 3.98Å; V324-F358 HydrophobicContact CB-CE2 4.22Å; V324-F358 HydrophobicContact CB-CZ 3.89Å; V324-F358 HydrophobicContact CG1-CD1 3.56Å; V324-F358 HydrophobicContact CG1-CD2 4.33Å; V324-F358 HydrophobicContact CG1-CE1 3.56Å; V324-F358 HydrophobicContact CG1-CE2 4.33Å; V324-F358 HydrophobicContact CG1-CG 3.97Å; V324-F358 HydrophobicContact CG1-CZ 3.96Å; R325-F358 HydrophobicContact CG-CE1 4.38Å; R325-F358 HydrophobicContact CG-CZ 3.99Å; G352-F358 WeakPolarHBondContact O-CD2 3.33Å; L355-F358 HydrophobicContact CB-CD2 4.14Å; L355-F358 HydrophobicContact CD1-CD2 4.46Å; L355-F358 HydrophobicContact CD1-CE2 4.21Å; L355-F358 PolarHBondContact O-N 2.94Å; P356-F358 PolarHBondContact O-N 3.28Å; F358-F360 VanDerWaalsContact C-N 3.34Å; F358-F360 PolarHBondContact O-N 3.36Å; F358-L361 HydrophobicContact CD1-CD2 4.36Å; F358-L361 PolarHBondContact O-N 2.85Å; F358-R362 WeakPolarHBondContact O-CB 3.34Å; F358-R362 PolarHBondContact O-N 3.12Å |
| 359 | R | 92.4 | Very high | 91.1 | Very high | 163 Ų | 163 | 66.3 Ų | 66.3 | 62% | 0.615 | 33% | 0.334 | S | S | * | . | H | α-helix | trans | -51.7 | -49.9 | -178.1 | 177.6 | 174.6 | -179.4 | 174.6 | 0.9 | 112.8 | P356 L361 R362 D363 | P356-R359 WeakPolarHBondContact O-CB 3.37Å; P356-R359 PolarHBondContact O-N 3.25Å; R359-L361 PolarHBondContact O-N 3.28Å; R359-R362 PolarHBondContact O-N 3.36Å; R359-D363 PolarHBondContact O-N 2.93Å |
| 360 | F | 91.3 | Very high | 90.6 | Very high | 171 Ų | 171 | 71.3 Ų | 71.3 | 75% | 0.75 | 36% | 0.356 | S | S | * | . | H | α-helix | trans | -63.4 | -43.3 | -179 | -178.4 | -95.7 | 0 | 0 | 0 | 112.4 | F358 D363 T364 | F358-F360 VanDerWaalsContact C-N 3.34Å; F358-F360 PolarHBondContact O-N 3.36Å; F360-D363 PolarHBondContact O-N 3.02Å; F360-T364 WeakPolarHBondContact O-CB 3.46Å; F360-T364 PolarHBondContact O-N 2.86Å; F360-T364 PolarHBondContact O-OG1 3.1Å |
| 361 | L | 91.1 | Very high | 90 | Very high | 46 Ų | 46 | 77.7 Ų | 77.7 | 24% | 0.241 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -62.3 | -47.2 | 176.8 | 177.1 | 66.8 | 0 | 0 | 0 | 110.9 | V324 L330 F358 R359 D363 T364 L365 | V324-L361 HydrophobicContact CG1-CD2 3.24Å; L330-L361 HydrophobicContact CD2-CD1 4.26Å; L330-L361 HydrophobicContact CD2-CD2 3.91Å; F358-L361 HydrophobicContact CD1-CD2 4.36Å; F358-L361 PolarHBondContact O-N 2.85Å; R359-L361 PolarHBondContact O-N 3.28Å; L361-D363 PolarHBondContact O-N 3.34Å; L361-T364 WeakPolarHBondContact O-CB 3.43Å; L361-T364 PolarHBondContact O-N 3.01Å; L361-L365 HydrophobicContact CD1-CD1 4.1Å; L361-L365 HydrophobicContact CD1-CG 4.12Å; L361-L365 HydrophobicContact CG-CD1 3.95Å; L361-L365 HydrophobicContact CG-CG 4.32Å; L361-L365 VanDerWaalsContact O-CG 3.3Å; L361-L365 WeakPolarHBondContact O-CG 3.16Å; L361-L365 PolarHBondContact O-N 2.87Å |
| 362 | R | 92.7 | Very high | 89.1 | Confident | 49 Ų | 49 | 80.4 Ų | 80.4 | 19% | 0.185 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -55.6 | -50.8 | 177.6 | 178.2 | -174.3 | 67.2 | -160.4 | -0.2 | 111.2 | L349 I353 F358 R359 T364 L365 I366 | L349-R362 HydrophobicContact CD1-CG 4.45Å; I353-R362 HydrophobicContact CB-CB 4.43Å; I353-R362 HydrophobicContact CD1-CB 4.47Å; I353-R362 HydrophobicContact CD1-CG 4.08Å; I353-R362 HydrophobicContact CG1-CG 4.5Å; F358-R362 WeakPolarHBondContact O-CB 3.34Å; F358-R362 PolarHBondContact O-N 3.12Å; R359-R362 PolarHBondContact O-N 3.36Å; R362-T364 VanDerWaalsContact C-N 3.27Å; R362-T364 PolarHBondContact O-N 2.69Å; R362-L365 PolarHBondContact O-N 2.95Å; R362-I366 HydrophobicContact CG-CD1 3.81Å; R362-I366 VanDerWaalsContact O-CG1 3.28Å; R362-I366 WeakPolarHBondContact O-CG1 3.37Å; R362-I366 PolarHBondContact O-N 3.36Å |
| 363 | D | 91.9 | Very high | 88.4 | Confident | 75 Ų | 75 | 83.5 Ų | 83.5 | 40% | 0.401 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -64.2 | -36.7 | -177.6 | -61.1 | -11.2 | 0 | 0 | 0 | 110.7 | R359 F360 L361 K367 | R359-D363 PolarHBondContact O-N 2.93Å; F360-D363 PolarHBondContact O-N 3.02Å; L361-D363 PolarHBondContact O-N 3.34Å; D363-K367 WeakPolarHBondContact O-CB 3.24Å; D363-K367 PolarHBondContact O-N 3.45Å |
| 364 | T | 91.1 | Very high | 88 | Confident | 47 Ų | 47 | 87 Ų | 87 | 29% | 0.288 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -64.2 | -47.4 | 174.1 | -57.5 | 0 | 0 | 0 | 0 | 112.2 | F360 L361 R362 K367 Q368 | F360-T364 WeakPolarHBondContact O-CB 3.46Å; F360-T364 PolarHBondContact O-N 2.86Å; F360-T364 PolarHBondContact O-OG1 3.1Å; L361-T364 WeakPolarHBondContact O-CB 3.43Å; L361-T364 PolarHBondContact O-N 3.01Å; R362-T364 VanDerWaalsContact C-N 3.27Å; R362-T364 PolarHBondContact O-N 2.69Å; T364-K367 PolarHBondContact O-N 3.38Å; T364-Q368 WeakPolarHBondContact O-CG 3.49Å; T364-Q368 PolarHBondContact O-N 2.69Å |
| 365 | L | 90.4 | Very high | 87.3 | Confident | 2 Ų | 2 | 88.7 Ų | 88.7 | 1% | 0.01 | 45% | 0.447 | C | S | . | . | H | α-helix | trans | -65.6 | -38.8 | 179.6 | -68.7 | 176.9 | 0 | 0 | 0 | 112.2 | L318 L334 L340 M342 L361 R362 Q368 S369 | L318-L365 HydrophobicContact CD1-CD1 4.05Å; L318-L365 HydrophobicContact CD2-CD1 4.39Å; L334-L365 HydrophobicContact CD1-CD2 3.65Å; L334-L365 HydrophobicContact CD2-CD2 3.7Å; L334-L365 HydrophobicContact CG-CD2 4.34Å; L340-L365 HydrophobicContact CD2-CD2 4.4Å; M342-L365 HydrophobicContact CE-CB 3.56Å; M342-L365 HydrophobicContact CE-CD1 3.76Å; M342-L365 HydrophobicContact CE-CG 4.28Å; M342-L365 HydrophobicContact SD-CB 3.91Å; M342-L365 HydrophobicContact SD-CD1 4.44Å; L361-L365 HydrophobicContact CD1-CD1 4.1Å; L361-L365 HydrophobicContact CD1-CG 4.12Å; L361-L365 HydrophobicContact CG-CD1 3.95Å; L361-L365 HydrophobicContact CG-CG 4.32Å; L361-L365 VanDerWaalsContact O-CG 3.3Å; L361-L365 WeakPolarHBondContact O-CG 3.16Å; L361-L365 PolarHBondContact O-N 2.87Å; R362-L365 PolarHBondContact O-N 2.95Å; L365-Q368 PolarHBondContact O-N 3.19Å; L365-S369 WeakPolarHBondContact O-CB 3.42Å; L365-S369 PolarHBondContact O-N 2.84Å |
| 366 | I | 89.4 | Confident | 86.7 | Confident | 46 Ų | 46 | 91.1 Ų | 91.1 | 24% | 0.236 | 46% | 0.457 | C | S | . | . | H | α-helix | trans | -61 | -48.8 | 173.7 | -69 | 167.6 | 0 | 0 | 0 | 109.8 | L349 R362 Q368 S369 Q370 | L349-I366 HydrophobicContact CD1-CD1 3.97Å; L349-I366 HydrophobicContact CD2-CD1 4.43Å; L349-I366 HydrophobicContact CD2-CG1 4.36Å; R362-I366 HydrophobicContact CG-CD1 3.81Å; R362-I366 VanDerWaalsContact O-CG1 3.28Å; R362-I366 WeakPolarHBondContact O-CG1 3.37Å; R362-I366 PolarHBondContact O-N 3.36Å; I366-Q368 VanDerWaalsContact C-N 3.29Å; I366-Q368 PolarHBondContact O-N 3.29Å; I366-S369 PolarHBondContact O-N 3.1Å; I366-S369 VanDerWaalsContact O-N 3.14Å; I366-S369 PolarHBondContact O-OG 3.12Å; I366-Q370 WeakPolarHBondContact O-CG 3.35Å; I366-Q370 PolarHBondContact O-N 3.04Å |
| 367 | K | 89.4 | Confident | 86.1 | Confident | 131 Ų | 131 | 86.4 Ų | 86.4 | 57% | 0.57 | 43% | 0.429 | S | S | * | . | H | α-helix | trans | -60.5 | -38.2 | 177.5 | -171.5 | 177.9 | -176 | 178 | 0 | 112.4 | D363 T364 K371 | D363-K367 WeakPolarHBondContact O-CB 3.24Å; D363-K367 PolarHBondContact O-N 3.45Å; T364-K367 PolarHBondContact O-N 3.38Å; K367-K371 WeakPolarHBondContact O-CG 3.2Å |
| 368 | Q | 85.6 | Confident | 85.4 | Confident | 99 Ų | 99 | 83 Ų | 83 | 46% | 0.463 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -67.7 | -38.7 | 175.2 | -74.8 | 179.8 | -6.3 | 0 | 0 | 112.3 | L340 T364 L365 I366 Q370 K371 | L340-Q368 HydrophobicContact CD2-CB 4.05Å; T364-Q368 WeakPolarHBondContact O-CG 3.49Å; T364-Q368 PolarHBondContact O-N 2.69Å; L365-Q368 PolarHBondContact O-N 3.19Å; I366-Q368 VanDerWaalsContact C-N 3.29Å; I366-Q368 PolarHBondContact O-N 3.29Å; Q368-Q370 VanDerWaalsContact C-N 3.25Å; Q368-Q370 PolarHBondContact O-N 3.32Å; Q368-K371 PolarHBondContact O-N 3.33Å |
| 369 | S | 86.2 | Confident | 84.7 | Confident | 44 Ų | 44 | 84.7 Ų | 84.7 | 31% | 0.308 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -64.7 | -29.1 | 178.4 | 73.1 | 0 | 0 | 0 | 0 | 113.4 | L340 L365 I366 | L340-S369 VanDerWaalsContact O-CB 3.26Å; L340-S369 WeakPolarHBondContact O-CB 3.36Å; L365-S369 WeakPolarHBondContact O-CB 3.42Å; L365-S369 PolarHBondContact O-N 2.84Å; I366-S369 PolarHBondContact O-N 3.1Å; I366-S369 VanDerWaalsContact O-N 3.14Å; I366-S369 PolarHBondContact O-OG 3.12Å |
| 370 | Q | 85.3 | Confident | 84.1 | Confident | 142 Ų | 142 | 79.3 Ų | 79.3 | 66% | 0.664 | 41% | 0.409 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83.5 | -12.3 | 179.6 | -68.3 | 174.1 | -8.7 | 0 | 0 | 113.7 | I366 Q368 P372 | I366-Q370 WeakPolarHBondContact O-CG 3.35Å; I366-Q370 PolarHBondContact O-N 3.04Å; Q368-Q370 VanDerWaalsContact C-N 3.25Å; Q368-Q370 PolarHBondContact O-N 3.32Å; Q370-P372 WeakPolarHBondContact O-CD 3.42Å |
| 371 | K | 81.3 | Confident | 83.4 | Confident | 135 Ų | 135 | 73.5 Ų | 73.5 | 59% | 0.587 | 38% | 0.382 | S | S | * | . | S | Bend | trans | -97.9 | 100.6 | -179.5 | -74.9 | -177.3 | 176.3 | -167.2 | 0 | 110.1 | K367 Q368 L373 | K367-K371 WeakPolarHBondContact O-CG 3.2Å; Q368-K371 PolarHBondContact O-N 3.33Å; K371-L373 PolarHBondContact O-N 2.72Å |
| 372 | P | 74.1 | Confident | 82.6 | Confident | 112 Ų | 112 | 74.8 Ų | 74.8 | 73% | 0.727 | 39% | 0.389 | S | S | * | . | P | Polyproline II helix | trans | -63 | 137 | 175 | 26.5 | -33.1 | 0 | 0 | 0 | 110 | Q370 | Q370-P372 WeakPolarHBondContact O-CD 3.42Š|
| 373 | L | 76.3 | Confident | 81.8 | Confident | 69 Ų | 69 | 74.6 Ų | 74.6 | 36% | 0.361 | 39% | 0.392 | S | S | . | . | P | Polyproline II helix | trans | -69.3 | 149.1 | 171.1 | -73.5 | 173 | 0 | 0 | 0 | 109.3 | Y338 K371 I378 | Y338-L373 HydrophobicContact CD2-CD1 3.48Å; Y338-L373 VanDerWaalsContact CD2-CD1 3.48Å; Y338-L373 HydrophobicContact CD2-CG 4.07Å; Y338-L373 HydrophobicContact CE2-CB 3.76Å; Y338-L373 HydrophobicContact CE2-CD1 3.48Å; Y338-L373 VanDerWaalsContact CE2-CD1 3.48Å; Y338-L373 HydrophobicContact CE2-CG 3.56Å; Y338-L373 HydrophobicContact CG-CD1 4.12Å; Y338-L373 PolarHBondContact OH-N 2.94Å; Y338-L373 VanDerWaalsContact OH-N 3.08Å; K371-L373 PolarHBondContact O-N 2.72Å; L373-I378 HydrophobicContact CB-CG1 3.83Å |
| 374 | S | 82.3 | Confident | 81 | Confident | 74 Ų | 74 | 73.3 Ų | 73.3 | 52% | 0.517 | 38% | 0.381 | S | S | . | . | P | Polyproline II helix | trans | -58.8 | 150.6 | 167.7 | 67.7 | 0 | 0 | 0 | 0 | 109.9 | Q376 G377 I378 | S374-Q376 PolarHBondContact O-N 3.31Å; S374-Q376 VanDerWaalsContact O-N 3.1Å; S374-G377 WeakPolarHBondContact O-CA 3.25Å; S374-G377 PolarHBondContact O-N 3.43Å; S374-G377 PolarHBondContact OG-N 2.96Å; S374-I378 WeakPolarHBondContact O-CG1 3.38Å; S374-I378 PolarHBondContact O-N 3.14Å |
| 375 | L | 77.1 | Confident | 80.1 | Confident | 135 Ų | 135 | 73.4 Ų | 73.4 | 71% | 0.707 | 38% | 0.38 | S | S | * | . | H | α-helix | trans | -50.7 | -40.2 | 177.2 | -176.6 | 66.3 | 0 | 0 | 0 | 111.5 | G377 I378 C379 | L375-G377 PolarHBondContact O-N 3.46Å; L375-I378 WeakPolarHBondContact O-CB 3.22Å; L375-I378 PolarHBondContact O-N 3.32Å; L375-C379 PolarHBondContact O-N 2.98Å; L375-C379 PolarHBondContact O-SG 2.68Å |
| 376 | Q | 79.1 | Confident | 79 | Confident | 122 Ų | 122 | 78.6 Ų | 78.6 | 57% | 0.57 | 41% | 0.407 | S | S | * | . | H | α-helix | trans | -59.5 | -44.9 | 174.3 | -165.9 | -170.9 | 19.5 | 0 | 0 | 112.4 | S374 C379 K380 | S374-Q376 PolarHBondContact O-N 3.31Å; S374-Q376 VanDerWaalsContact O-N 3.1Å; Q376-C379 PolarHBondContact O-N 3Å; Q376-K380 VanDerWaalsContact O-CG 3.26Å; Q376-K380 WeakPolarHBondContact O-CG 3.26Å; Q376-K380 PolarHBondContact O-N 3.47Å |
| 377 | G | 78.6 | Confident | 78.1 | Confident | 19 Ų | 19 | 81.4 Ų | 81.4 | 20% | 0.196 | 42% | 0.415 | C | S | . | . | H | α-helix | trans | -62.8 | -40.5 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | S374 L375 K380 R381 | S374-G377 WeakPolarHBondContact O-CA 3.25Å; S374-G377 PolarHBondContact O-N 3.43Å; S374-G377 PolarHBondContact OG-N 2.96Å; L375-G377 PolarHBondContact O-N 3.46Å; G377-K380 PolarHBondContact O-N 2.7Å; G377-R381 WeakPolarHBondContact O-CB 3.27Å; G377-R381 PolarHBondContact O-N 2.83Å |
| 378 | I | 76.9 | Confident | 77.1 | Confident | 39 Ų | 39 | 76.6 Ų | 76.6 | 20% | 0.2 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -61.7 | -49.4 | 174.8 | -56.8 | 174.6 | 0 | 0 | 0 | 110.2 | Y338 L373 S374 L375 K380 R381 N382 | Y338-I378 HydrophobicContact CD1-CG1 4.21Å; Y338-I378 HydrophobicContact CD1-CG2 4.18Å; Y338-I378 HydrophobicContact CE1-CB 4.26Å; Y338-I378 HydrophobicContact CE1-CD1 3.59Å; Y338-I378 HydrophobicContact CE1-CG1 3.41Å; Y338-I378 VanDerWaalsContact CE1-CG1 3.41Å; Y338-I378 HydrophobicContact CE1-CG2 3.98Å; Y338-I378 WeakPolarHBondContact OH-CD1 3.45Å; L373-I378 HydrophobicContact CB-CG1 3.83Å; S374-I378 WeakPolarHBondContact O-CG1 3.38Å; S374-I378 PolarHBondContact O-N 3.14Å; L375-I378 WeakPolarHBondContact O-CB 3.22Å; L375-I378 PolarHBondContact O-N 3.32Å; I378-K380 PolarHBondContact O-N 2.9Å; I378-R381 PolarHBondContact O-N 3.47Å; I378-N382 WeakPolarHBondContact O-CB 3.47Å; I378-N382 PolarHBondContact O-N 3.34Å |
| 379 | C | 76.3 | Confident | 76.2 | Confident | 59 Ų | 59 | 77.3 Ų | 77.3 | 40% | 0.399 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -60.7 | -46.4 | 178.9 | -68.6 | 0 | 0 | 0 | 0 | 111.9 | L375 Q376 R381 N382 I383 | L375-C379 PolarHBondContact O-N 2.98Å; L375-C379 PolarHBondContact O-SG 2.68Å; Q376-C379 PolarHBondContact O-N 3Å; C379-R381 VanDerWaalsContact C-N 3.28Å; C379-R381 PolarHBondContact O-N 3.44Å; C379-N382 PolarHBondContact O-N 3.47Å; C379-I383 VanDerWaalsContact O-CG1 3.23Å; C379-I383 WeakPolarHBondContact O-CG1 3.37Å; C379-I383 PolarHBondContact O-N 2.89Å |
| 380 | K | 78.7 | Confident | 75.3 | Confident | 50 Ų | 50 | 83.7 Ų | 83.7 | 22% | 0.217 | 43% | 0.428 | C | S | . | . | H | α-helix | trans | -55.8 | -45.4 | 175.9 | -73.3 | 174.9 | -175.5 | -149.2 | 0 | 111.6 | Q376 G377 I378 I383 R384 S406 V407 | Q376-K380 VanDerWaalsContact O-CG 3.26Å; Q376-K380 WeakPolarHBondContact O-CG 3.26Å; Q376-K380 PolarHBondContact O-N 3.47Å; G377-K380 PolarHBondContact O-N 2.7Å; I378-K380 PolarHBondContact O-N 2.9Å; K380-I383 PolarHBondContact O-N 3.15Å; K380-R384 WeakPolarHBondContact O-CB 3.38Å; K380-R384 PolarHBondContact O-N 2.99Å; K380-S406 VanDerWaalsContact CD-O 3.28Å; K380-S406 WeakPolarHBondContact CD-O 3.45Å; K380-S406 WeakPolarHBondContact CE-O 3.5Å; K380-S406 WeakPolarHBondContact CE-OG 3.44Å; K380-S406 PolarHBondContact NZ-O 2.94Å; K380-S406 PolarHBondContact NZ-OG 3.43Å; K380-V407 HydrophobicContact CG-CG2 4.2Å |
| 381 | R | 76.8 | Confident | 74.6 | Confident | 48 Ų | 48 | 82.5 Ų | 82.5 | 18% | 0.181 | 42% | 0.418 | C | S | . | . | H | α-helix | trans | -66.5 | -44.3 | -178.9 | -159.1 | 177.2 | -161.8 | 163.1 | 7 | 111.8 | L334 Y335 T337 G377 I378 C379 R384 N385 | L334-R381 PolarHBondContact O-NH2 3.39Å; Y335-R381 VanDerWaalsContact C-NH2 3.25Å; Y335-R381 VanDerWaalsContact CA-NH2 3.31Å; Y335-R381 PolarHBondContact O-NE 3.13Å; Y335-R381 PolarHBondContact O-NH2 3.06Å; T337-R381 PolarHBondContact O-NH1 3.26Å; T337-R381 PolarHBondContact O-NH2 3.2Å; G377-R381 WeakPolarHBondContact O-CB 3.27Å; G377-R381 PolarHBondContact O-N 2.83Å; I378-R381 PolarHBondContact O-N 3.47Å; C379-R381 VanDerWaalsContact C-N 3.28Å; C379-R381 PolarHBondContact O-N 3.44Å; R381-R384 PolarHBondContact O-N 3.09Å; R381-N385 WeakPolarHBondContact O-CB 3.27Å; R381-N385 PolarHBondContact O-N 3.17Å |
| 382 | N | 75.5 | Confident | 74.4 | Confident | 73 Ų | 73 | 78.4 Ų | 78.4 | 39% | 0.39 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -62.4 | -44.9 | 176 | -76.3 | -11.8 | 0 | 0 | 0 | 111.9 | I378 C379 R384 N385 I386 | I378-N382 WeakPolarHBondContact O-CB 3.47Å; I378-N382 PolarHBondContact O-N 3.34Å; C379-N382 PolarHBondContact O-N 3.47Å; N382-R384 PolarHBondContact O-N 3.01Å; N382-N385 PolarHBondContact O-N 3.3Å; N382-I386 VanDerWaalsContact O-CG1 3.32Å; N382-I386 WeakPolarHBondContact O-CG1 3.25Å; N382-I386 PolarHBondContact O-N 3.34Å |
| 383 | I | 76.1 | Confident | 74.6 | Confident | 46 Ų | 46 | 79.1 Ų | 79.1 | 24% | 0.236 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -60.3 | -47.5 | 176.4 | -66.1 | 164.7 | 0 | 0 | 0 | 109.9 | C379 K380 N385 I386 Y387 L395 V407 | C379-I383 VanDerWaalsContact O-CG1 3.23Å; C379-I383 WeakPolarHBondContact O-CG1 3.37Å; C379-I383 PolarHBondContact O-N 2.89Å; K380-I383 PolarHBondContact O-N 3.15Å; I383-N385 VanDerWaalsContact C-N 3.32Å; I383-N385 PolarHBondContact O-N 3.36Å; I383-I386 PolarHBondContact O-N 3.11Å; I383-Y387 HydrophobicContact CG2-CD2 3.94Å; I383-Y387 HydrophobicContact CG2-CE2 4.49Å; I383-Y387 WeakPolarHBondContact O-CD2 3.03Å; I383-Y387 PolarHBondContact O-N 3.35Å; I383-L395 HydrophobicContact CG2-CD1 4.31Å; I383-V407 HydrophobicContact CB-CG1 4.23Å; I383-V407 HydrophobicContact CD1-CG2 4.09Å; I383-V407 HydrophobicContact CG2-CG1 3.81Å; I383-V407 HydrophobicContact CG2-CG2 4.48Å |
| 384 | R | 74 | Confident | 74.7 | Confident | 47 Ų | 47 | 81 Ų | 81 | 18% | 0.177 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -63.9 | -34.8 | 176.5 | -78.1 | -168.9 | 170 | 165.4 | -3.2 | 113.2 | Y335 K380 R381 N382 G388 V407 Y408 | Y335-R384 WeakPolarHBondContact OH-CD 3.45Å; Y335-R384 PolarHBondContact OH-NH1 2.84Å; K380-R384 WeakPolarHBondContact O-CB 3.38Å; K380-R384 PolarHBondContact O-N 2.99Å; R381-R384 PolarHBondContact O-N 3.09Å; N382-R384 PolarHBondContact O-N 3.01Å; R384-G388 WeakPolarHBondContact O-CA 3.36Å; R384-G388 PolarHBondContact O-N 3.11Å; R384-V407 HydrophobicContact CG-CG1 3.76Å; R384-V407 PolarHBondContact NE-O 2.91Å; R384-V407 PolarHBondContact NH2-O 3.26Å; R384-Y408 HydrophobicContact CG-CE1 4.12Å |
| 385 | N | 72 | Confident | 74.4 | Confident | 49 Ų | 49 | 78.1 Ų | 78.1 | 26% | 0.262 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -70.1 | -39 | 177.8 | -78.3 | -12.1 | 0 | 0 | 0 | 112.3 | H336 R381 N382 I383 | H336-N385 PolarHBondContact ND1-OD1 3.36Å; H336-N385 PolarHBondContact O-ND2 3.05Å; H336-N385 VanDerWaalsContact O-ND2 3.11Å; R381-N385 WeakPolarHBondContact O-CB 3.27Å; R381-N385 PolarHBondContact O-N 3.17Å; N382-N385 PolarHBondContact O-N 3.3Å; I383-N385 VanDerWaalsContact C-N 3.32Å; I383-N385 PolarHBondContact O-N 3.36Å |
| 386 | I | 69.1 | Low | 74.6 | Confident | 111 Ų | 111 | 77 Ų | 77 | 57% | 0.569 | 37% | 0.369 | S | S | * | . | H | α-helix | trans | -75.9 | -47.7 | -179.2 | -66.6 | 167.3 | 0 | 0 | 0 | 111 | N382 I383 | N382-I386 VanDerWaalsContact O-CG1 3.32Å; N382-I386 WeakPolarHBondContact O-CG1 3.25Å; N382-I386 PolarHBondContact O-N 3.34Å; I383-I386 PolarHBondContact O-N 3.11Å |
| 387 | Y | 69.5 | Low | 74.8 | Confident | 106 Ų | 106 | 78.8 Ų | 78.8 | 42% | 0.416 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -98.3 | -10.6 | -171.3 | -62.6 | -77.2 | 0 | 0 | 0 | 113.5 | I383 Y391 L395 | I383-Y387 HydrophobicContact CG2-CD2 3.94Å; I383-Y387 HydrophobicContact CG2-CE2 4.49Å; I383-Y387 WeakPolarHBondContact O-CD2 3.03Å; I383-Y387 PolarHBondContact O-N 3.35Å; Y387-Y391 WeakPolarHBondContact O-CB 3.37Å; Y387-Y391 WeakPolarHBondContact O-CD2 3.41Å; Y387-Y391 PolarHBondContact O-N 3.4Å; Y387-L395 HydrophobicContact CD1-CD1 4.23Å; Y387-L395 HydrophobicContact CD1-CD2 4.41Å; Y387-L395 HydrophobicContact CD1-CG 4.49Å; Y387-L395 HydrophobicContact CD2-CD1 3.88Å; Y387-L395 HydrophobicContact CD2-CD2 4.49Å; Y387-L395 HydrophobicContact CG-CD1 3.59Å; Y387-L395 HydrophobicContact CG-CD2 4.39Å; Y387-L395 HydrophobicContact CG-CG 4.31Å |
| 388 | G | 67.7 | Low | 75 | Confident | 29 Ų | 29 | 83.4 Ų | 83.4 | 30% | 0.299 | 40% | 0.397 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 54.2 | -162.6 | 178.9 | 0 | 0 | 0 | 0 | 0 | 113.9 | R384 Y408 | R384-G388 WeakPolarHBondContact O-CA 3.36Å; R384-G388 PolarHBondContact O-N 3.11Å; G388-Y408 WeakPolarHBondContact O-CE1 3.3Å; G388-Y408 PolarHBondContact O-OH 2.94Å |
| 389 | E | 67.1 | Low | 75.1 | Confident | 115 Ų | 115 | 83.6 Ų | 83.6 | 54% | 0.537 | 40% | 0.398 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -81.5 | -22.5 | 166.9 | -73.5 | -66.9 | 132.9 | 0 | 0 | 111.9 | Y391 K392 | E389-Y391 VanDerWaalsContact C-N 3.34Å; E389-Y391 PolarHBondContact O-N 2.92Å; E389-K392 WeakPolarHBondContact O-CB 3.31Å; E389-K392 PolarHBondContact O-N 2.99Å; E389-K392 IonicContact OE1-NZ 3.86Å; E389-K392 WeakPolarHBondContact OE2-CD 3.27Å; E389-K392 IonicContact OE2-NZ 2.87Å; E389-K392 PolarHBondContact OE2-NZ 2.84Å |
| 390 | K | 67 | Low | 75.5 | Confident | 177 Ų | 177 | 84.3 Ų | 84.3 | 77% | 0.77 | 40% | 0.402 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.9 | -38.9 | -176.8 | -171.6 | -179.3 | 178.6 | -173.5 | 0 | 112.7 | ||
| 391 | Y | 71.7 | Confident | 75.5 | Confident | 117 Ų | 117 | 86.9 Ų | 86.9 | 46% | 0.459 | 42% | 0.421 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -97.8 | 9.8 | 179.7 | -57.7 | -72.9 | 0 | 0 | 0 | 113.3 | Y387 E389 Q393 H394 L395 | Y387-Y391 WeakPolarHBondContact O-CB 3.37Å; Y387-Y391 WeakPolarHBondContact O-CD2 3.41Å; Y387-Y391 PolarHBondContact O-N 3.4Å; E389-Y391 VanDerWaalsContact C-N 3.34Å; E389-Y391 PolarHBondContact O-N 2.92Å; Y391-Q393 VanDerWaalsContact C-N 3.35Å; Y391-Q393 PolarHBondContact O-N 2.82Å; Y391-H394 WeakPolarHBondContact O-CB 3.17Å; Y391-H394 PolarHBondContact O-N 2.78Å; Y391-H394 VanDerWaalsContact O-N 3.12Å; Y391-L395 PolarHBondContact O-N 2.61Å |
| 392 | K | 76.7 | Confident | 75.6 | Confident | 49 Ų | 49 | 89.8 Ų | 89.8 | 21% | 0.213 | 45% | 0.445 | C | S | . | . | H | α-helix | trans | -56.6 | -42.9 | -177.7 | 175.4 | 172.6 | 179.3 | 174.7 | 0 | 113.8 | E389 K396 W404 Y408 | E389-K392 WeakPolarHBondContact O-CB 3.31Å; E389-K392 PolarHBondContact O-N 2.99Å; E389-K392 IonicContact OE1-NZ 3.86Å; E389-K392 WeakPolarHBondContact OE2-CD 3.27Å; E389-K392 IonicContact OE2-NZ 2.87Å; E389-K392 PolarHBondContact OE2-NZ 2.84Å; K392-K396 PolarHBondContact O-N 2.83Å; K392-W404 HydrophobicContact CD-CZ2 4.47Å; K392-W404 HydrophobicContact CG-CZ2 3.8Å; K392-W404 PolarHBondContact O-NE1 3.12Å; K392-Y408 HydrophobicContact CB-CD1 4.32Å; K392-Y408 HydrophobicContact CB-CE1 4.08Å; K392-Y408 HydrophobicContact CD-CD1 3.76Å; K392-Y408 HydrophobicContact CD-CE1 4.26Å; K392-Y408 HydrophobicContact CD-CG 4.23Å; K392-Y408 HydrophobicContact CG-CD1 3.85Å; K392-Y408 HydrophobicContact CG-CD2 4.46Å; K392-Y408 HydrophobicContact CG-CE1 4.11Å; K392-Y408 HydrophobicContact CG-CG 4.03Å |
| 393 | Q | 77.3 | Confident | 75.6 | Confident | 128 Ų | 128 | 90 Ų | 90 | 60% | 0.598 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -70.2 | -36.7 | 178.6 | -67.3 | -64.7 | -13.6 | 0 | 0 | 111.7 | Y391 K396 | Y391-Q393 VanDerWaalsContact C-N 3.35Å; Y391-Q393 PolarHBondContact O-N 2.82Å; Q393-K396 WeakPolarHBondContact O-CB 3.4Å; Q393-K396 PolarHBondContact O-N 3.27Å |
| 394 | H | 78.3 | Confident | 75.7 | Confident | 109 Ų | 109 | 88.8 Ų | 88.8 | 51% | 0.505 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -67.3 | -44 | 176 | -164.8 | 66.9 | 0 | 0 | 0 | 111.1 | Y391 K396 Q397 L398 | Y391-H394 WeakPolarHBondContact O-CB 3.17Å; Y391-H394 PolarHBondContact O-N 2.78Å; Y391-H394 VanDerWaalsContact O-N 3.12Å; H394-K396 VanDerWaalsContact C-N 3.25Å; H394-K396 PolarHBondContact O-N 3.1Å; H394-Q397 WeakPolarHBondContact O-CB 3.47Å; H394-Q397 PolarHBondContact O-N 3.3Å; H394-Q397 VanDerWaalsContact O-N 3.11Å; H394-L398 PolarHBondContact O-N 3.38Å |
| 395 | L | 77.9 | Confident | 75.8 | Confident | 12 Ų | 12 | 89.9 Ų | 89.9 | 6% | 0.063 | 45% | 0.447 | C | S | . | . | H | α-helix | trans | -64.8 | -26.5 | 173.7 | -77.4 | 176.8 | 0 | 0 | 0 | 113.4 | I383 Y387 Y391 Q397 L398 L399 Y408 | I383-L395 HydrophobicContact CG2-CD1 4.31Å; Y387-L395 HydrophobicContact CD1-CD1 4.23Å; Y387-L395 HydrophobicContact CD1-CD2 4.41Å; Y387-L395 HydrophobicContact CD1-CG 4.49Å; Y387-L395 HydrophobicContact CD2-CD1 3.88Å; Y387-L395 HydrophobicContact CD2-CD2 4.49Å; Y387-L395 HydrophobicContact CG-CD1 3.59Å; Y387-L395 HydrophobicContact CG-CD2 4.39Å; Y387-L395 HydrophobicContact CG-CG 4.31Å; Y391-L395 PolarHBondContact O-N 2.61Å; L395-Q397 PolarHBondContact O-N 3.21Å; L395-L398 PolarHBondContact O-N 3.25Å; L395-L399 HydrophobicContact CB-CD1 4.11Å; L395-L399 HydrophobicContact CD2-CD1 3.99Å; L395-L399 HydrophobicContact CD2-CG 4.2Å; L395-L399 HydrophobicContact CG-CD1 4.46Å; L395-L399 VanDerWaalsContact O-CB 3.3Å; L395-L399 WeakPolarHBondContact O-CB 3.21Å; L395-L399 PolarHBondContact O-N 3.16Å; L395-Y408 HydrophobicContact CB-CE2 4.42Å; L395-Y408 HydrophobicContact CD1-CE2 3.8Å; L395-Y408 VanDerWaalsContact CD1-OH 3.28Å; L395-Y408 WeakPolarHBondContact CD1-OH 3.18Å |
| 396 | K | 80.7 | Confident | 76 | Confident | 111 Ų | 111 | 89 Ų | 89 | 48% | 0.483 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -63.6 | -30.3 | 173.9 | -164.6 | 178.2 | 179.9 | -176.2 | 0 | 112.2 | K392 Q393 H394 W404 | K392-K396 PolarHBondContact O-N 2.83Å; Q393-K396 WeakPolarHBondContact O-CB 3.4Å; Q393-K396 PolarHBondContact O-N 3.27Å; H394-K396 VanDerWaalsContact C-N 3.25Å; H394-K396 PolarHBondContact O-N 3.1Å; K396-W404 HydrophobicContact CB-CD2 4.18Å; K396-W404 HydrophobicContact CB-CG 4.32Å; K396-W404 HydrophobicContact CB-CZ2 4.05Å; K396-W404 HydrophobicContact CD-CD2 4.46Å; K396-W404 HydrophobicContact CD-CH2 3.93Å; K396-W404 HydrophobicContact CD-CZ2 3.76Å; K396-W404 HydrophobicContact CD-CZ3 4.32Å; K396-W404 HydrophobicContact CG-CD2 3.85Å; K396-W404 HydrophobicContact CG-CE3 4.27Å; K396-W404 HydrophobicContact CG-CG 4.27Å; K396-W404 HydrophobicContact CG-CH2 4.36Å; K396-W404 HydrophobicContact CG-CZ2 3.92Å |
| 397 | Q | 82.6 | Confident | 76.2 | Confident | 161 Ų | 161 | 84 Ų | 84 | 75% | 0.752 | 42% | 0.419 | S | S | * | . | H | α-helix | trans | -83.3 | -27.3 | 178.6 | -63.3 | 175.1 | -8.3 | 0 | 0 | 112.2 | H394 L395 | H394-Q397 WeakPolarHBondContact O-CB 3.47Å; H394-Q397 PolarHBondContact O-N 3.3Å; H394-Q397 VanDerWaalsContact O-N 3.11Å; L395-Q397 PolarHBondContact O-N 3.21Å |
| 398 | L | 82.3 | Confident | 76.2 | Confident | 115 Ų | 115 | 79.3 Ų | 79.3 | 60% | 0.602 | 40% | 0.401 | S | S | * | . | H | α-helix | trans | -95.6 | -32.6 | -175.3 | -67.1 | 171 | 0 | 0 | 0 | 114 | H394 L395 | H394-L398 PolarHBondContact O-N 3.38Å; L395-L398 PolarHBondContact O-N 3.25Å |
| 399 | L | 79.8 | Confident | 76 | Confident | 44 Ų | 44 | 81 Ų | 81 | 23% | 0.23 | 41% | 0.407 | C | S | . | . | S | Bend | trans | -94.5 | 144.5 | -176.1 | -66.9 | 174.1 | 0 | 0 | 0 | 111.5 | L395 V401 I403 W404 | L395-L399 HydrophobicContact CB-CD1 4.11Å; L395-L399 HydrophobicContact CD2-CD1 3.99Å; L395-L399 HydrophobicContact CD2-CG 4.2Å; L395-L399 HydrophobicContact CG-CD1 4.46Å; L395-L399 VanDerWaalsContact O-CB 3.3Å; L395-L399 WeakPolarHBondContact O-CB 3.21Å; L395-L399 PolarHBondContact O-N 3.16Å; L399-V401 PolarHBondContact O-N 2.96Å; L399-I403 HydrophobicContact CD1-CG2 4.41Å; L399-I403 HydrophobicContact CD2-CG2 4.43Å; L399-W404 HydrophobicContact CB-CB 4.23Å |
| 400 | P | 84.9 | Confident | 75.2 | Confident | 74 Ų | 74 | 79.2 Ų | 79.2 | 48% | 0.481 | 41% | 0.406 | S | S | . | . | trans | -51.8 | 138.8 | 166.4 | -25.2 | 33.5 | 0 | 0 | 0 | 111.3 | T402 I403 W404 | P400-T402 PolarHBondContact O-N 3.43Å; P400-T402 VanDerWaalsContact O-N 3.08Å; P400-I403 HydrophobicContact CB-CD1 4.44Å; P400-I403 HydrophobicContact CB-CG1 4.4Å; P400-I403 HydrophobicContact CG-CD1 4.09Å; P400-I403 PolarHBondContact O-N 3.07Å; P400-W404 PolarHBondContact O-N 3.38Å | ||
| 401 | V | 79.1 | Confident | 74.1 | Confident | 103 Ų | 103 | 80.6 Ų | 80.6 | 62% | 0.624 | 41% | 0.408 | S | S | * | . | H | α-helix | trans | -53 | -36.5 | -175.8 | 177.3 | 0 | 0 | 0 | 0 | 112.3 | L399 N405 | L399-V401 PolarHBondContact O-N 2.96Å; V401-N405 WeakPolarHBondContact CG1-ND2 3.38Å; V401-N405 VanDerWaalsContact O-CB 3.23Å; V401-N405 WeakPolarHBondContact O-CB 3.4Å; V401-N405 PolarHBondContact O-N 3.46Å; V401-N405 PolarHBondContact O-ND2 3.28Å |
| 402 | T | 78.7 | Confident | 72.3 | Confident | 109 Ų | 109 | 81 Ų | 81 | 67% | 0.669 | 42% | 0.418 | S | S | * | . | H | α-helix | trans | -63.4 | -44.4 | 176.7 | 49.6 | 0 | 0 | 0 | 0 | 112.6 | P400 S406 | P400-T402 PolarHBondContact O-N 3.43Å; P400-T402 VanDerWaalsContact O-N 3.08Å; T402-S406 WeakPolarHBondContact O-CB 3.3Å; T402-S406 PolarHBondContact O-N 3.18Å |
| 403 | I | 74.8 | Confident | 70.3 | Confident | 77 Ų | 77 | 86 Ų | 86 | 40% | 0.395 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -71.1 | -44.5 | 177.7 | -61.1 | 179.9 | 0 | 0 | 0 | 109.7 | L399 P400 N405 S406 V407 | L399-I403 HydrophobicContact CD1-CG2 4.41Å; L399-I403 HydrophobicContact CD2-CG2 4.43Å; P400-I403 HydrophobicContact CB-CD1 4.44Å; P400-I403 HydrophobicContact CB-CG1 4.4Å; P400-I403 HydrophobicContact CG-CD1 4.09Å; P400-I403 PolarHBondContact O-N 3.07Å; I403-N405 PolarHBondContact O-N 3.48Å; I403-S406 WeakPolarHBondContact O-CB 3.43Å; I403-S406 PolarHBondContact O-N 3.11Å; I403-V407 HydrophobicContact CG2-CG2 4.23Å; I403-V407 WeakPolarHBondContact O-CB 3.32Å; I403-V407 VanDerWaalsContact O-CG2 3.26Å; I403-V407 WeakPolarHBondContact O-CG2 3.4Å; I403-V407 PolarHBondContact O-N 2.9Å |
| 404 | W | 78.9 | Confident | 68 | Low | 22 Ų | 22 | 85.6 Ų | 85.6 | 8% | 0.083 | 45% | 0.453 | C | S | . | . | H | α-helix | trans | -60.8 | -45.6 | 178.1 | -173.3 | 87.5 | 0 | 0 | 0 | 112 | K392 K396 L399 P400 S406 V407 Y408 C409 | K392-W404 HydrophobicContact CD-CZ2 4.47Å; K392-W404 HydrophobicContact CG-CZ2 3.8Å; K392-W404 PolarHBondContact O-NE1 3.12Å; K396-W404 HydrophobicContact CB-CD2 4.18Å; K396-W404 HydrophobicContact CB-CG 4.32Å; K396-W404 HydrophobicContact CB-CZ2 4.05Å; K396-W404 HydrophobicContact CD-CD2 4.46Å; K396-W404 HydrophobicContact CD-CH2 3.93Å; K396-W404 HydrophobicContact CD-CZ2 3.76Å; K396-W404 HydrophobicContact CD-CZ3 4.32Å; K396-W404 HydrophobicContact CG-CD2 3.85Å; K396-W404 HydrophobicContact CG-CE3 4.27Å; K396-W404 HydrophobicContact CG-CG 4.27Å; K396-W404 HydrophobicContact CG-CH2 4.36Å; K396-W404 HydrophobicContact CG-CZ2 3.92Å; L399-W404 HydrophobicContact CB-CB 4.23Å; P400-W404 PolarHBondContact O-N 3.38Å; W404-S406 VanDerWaalsContact C-N 3.33Å; W404-S406 PolarHBondContact O-N 3.05Å; W404-V407 PolarHBondContact O-N 2.77Å; W404-Y408 AromaticContact CD1-CD2 3.79Å; W404-Y408 HydrophobicContact CG-CD2 4.37Å; W404-Y408 AromaticContact NE1-CD2 3.67Å; W404-Y408 PolarHBondContact O-N 2.93Å; W404-C409 WeakPolarHBondContact CZ3-SG 3.42Å |
| 405 | N | 76.9 | Confident | 65.7 | Low | 69 Ų | 69 | 89.1 Ų | 89.1 | 37% | 0.369 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -62.4 | -41.4 | 174.5 | -75.5 | -20.2 | 0 | 0 | 0 | 111.6 | V401 I403 V407 C409 | V401-N405 WeakPolarHBondContact CG1-ND2 3.38Å; V401-N405 VanDerWaalsContact O-CB 3.23Å; V401-N405 WeakPolarHBondContact O-CB 3.4Å; V401-N405 PolarHBondContact O-N 3.46Å; V401-N405 PolarHBondContact O-ND2 3.28Å; I403-N405 PolarHBondContact O-N 3.48Å; N405-V407 VanDerWaalsContact C-N 3.28Å; N405-V407 PolarHBondContact O-N 2.99Å; N405-C409 HydrophobicContact CB-CB 4.18Å; N405-C409 WeakPolarHBondContact O-CA 3.34Å; N405-C409 VanDerWaalsContact O-CB 3.25Å; N405-C409 WeakPolarHBondContact O-CB 3.45Å; N405-C409 PolarHBondContact O-N 2.85Å; N405-C409 PolarHBondContact OD1-SG 3.05Å |
| 406 | S | 75.6 | Confident | 65.1 | Low | 32 Ų | 32 | 93 Ų | 93 | 22% | 0.224 | 51% | 0.511 | C | S | . | . | H | α-helix | trans | -64 | -33.9 | 177.8 | -166.4 | 0 | 0 | 0 | 0 | 112.5 | K380 T402 I403 W404 | K380-S406 VanDerWaalsContact CD-O 3.28Å; K380-S406 WeakPolarHBondContact CD-O 3.45Å; K380-S406 WeakPolarHBondContact CE-O 3.5Å; K380-S406 WeakPolarHBondContact CE-OG 3.44Å; K380-S406 PolarHBondContact NZ-O 2.94Å; K380-S406 PolarHBondContact NZ-OG 3.43Å; T402-S406 WeakPolarHBondContact O-CB 3.3Å; T402-S406 PolarHBondContact O-N 3.18Å; I403-S406 WeakPolarHBondContact O-CB 3.43Å; I403-S406 PolarHBondContact O-N 3.11Å; W404-S406 VanDerWaalsContact C-N 3.33Å; W404-S406 PolarHBondContact O-N 3.05Å |
| 407 | V | 72.2 | Confident | 64.2 | Low | 4 Ų | 4 | 92 Ų | 92 | 2% | 0.024 | 51% | 0.513 | C | S | . | . | H | α-helix | trans | -83.3 | -42.9 | 177.6 | 177.7 | 0 | 0 | 0 | 0 | 111.4 | K380 I383 R384 I403 W404 N405 | K380-V407 HydrophobicContact CG-CG2 4.2Å; I383-V407 HydrophobicContact CB-CG1 4.23Å; I383-V407 HydrophobicContact CD1-CG2 4.09Å; I383-V407 HydrophobicContact CG2-CG1 3.81Å; I383-V407 HydrophobicContact CG2-CG2 4.48Å; R384-V407 HydrophobicContact CG-CG1 3.76Å; R384-V407 PolarHBondContact NE-O 2.91Å; R384-V407 PolarHBondContact NH2-O 3.26Å; I403-V407 HydrophobicContact CG2-CG2 4.23Å; I403-V407 WeakPolarHBondContact O-CB 3.32Å; I403-V407 VanDerWaalsContact O-CG2 3.26Å; I403-V407 WeakPolarHBondContact O-CG2 3.4Å; I403-V407 PolarHBondContact O-N 2.9Å; W404-V407 PolarHBondContact O-N 2.77Å; N405-V407 VanDerWaalsContact C-N 3.28Å; N405-V407 PolarHBondContact O-N 2.99Å |
| 408 | Y | 70.7 | Confident | 63.2 | Low | 9 Ų | 9 | 88.2 Ų | 88.2 | 4% | 0.035 | 50% | 0.499 | C | S | . | . | H | α-helix | trans | -115 | -15.2 | -167.1 | -74.4 | -76.4 | 0 | 0 | 0 | 116.3 | R384 G388 K392 L395 W404 | R384-Y408 HydrophobicContact CG-CE1 4.12Å; G388-Y408 WeakPolarHBondContact O-CE1 3.3Å; G388-Y408 PolarHBondContact O-OH 2.94Å; K392-Y408 HydrophobicContact CB-CD1 4.32Å; K392-Y408 HydrophobicContact CB-CE1 4.08Å; K392-Y408 HydrophobicContact CD-CD1 3.76Å; K392-Y408 HydrophobicContact CD-CE1 4.26Å; K392-Y408 HydrophobicContact CD-CG 4.23Å; K392-Y408 HydrophobicContact CG-CD1 3.85Å; K392-Y408 HydrophobicContact CG-CD2 4.46Å; K392-Y408 HydrophobicContact CG-CE1 4.11Å; K392-Y408 HydrophobicContact CG-CG 4.03Å; L395-Y408 HydrophobicContact CB-CE2 4.42Å; L395-Y408 HydrophobicContact CD1-CE2 3.8Å; L395-Y408 VanDerWaalsContact CD1-OH 3.28Å; L395-Y408 WeakPolarHBondContact CD1-OH 3.18Å; W404-Y408 AromaticContact CD1-CD2 3.79Å; W404-Y408 HydrophobicContact CG-CD2 4.37Å; W404-Y408 AromaticContact NE1-CD2 3.67Å; W404-Y408 PolarHBondContact O-N 2.93Å |
| 409 | C | 64 | Low | 62.1 | Low | 63 Ų | 63 | 86.6 Ų | 86.6 | 43% | 0.426 | 49% | 0.493 | S | S | . | . | trans | -99.2 | 2 | -175.7 | -67.6 | 0 | 0 | 0 | 0 | 114.9 | W404 N405 Y411 | W404-C409 WeakPolarHBondContact CZ3-SG 3.42Å; N405-C409 HydrophobicContact CB-CB 4.18Å; N405-C409 WeakPolarHBondContact O-CA 3.34Å; N405-C409 VanDerWaalsContact O-CB 3.25Å; N405-C409 WeakPolarHBondContact O-CB 3.45Å; N405-C409 PolarHBondContact O-N 2.85Å; N405-C409 PolarHBondContact OD1-SG 3.05Å; C409-Y411 PolarHBondContact O-N 3.33Å | ||
| 410 | C | 48.8 | Very low | 61 | Low | 78 Ų | 78 | 89.3 Ų | 89.3 | 53% | 0.527 | 51% | 0.51 | S | S | . | . | trans | -75.4 | 95.7 | 167.4 | -70.2 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 411 | Y | 44.2 | Very low | 59.4 | Low | 207 Ų | 207 | 90.3 Ų | 90.3 | 81% | 0.812 | 51% | 0.512 | S | S | * | . | trans | -66.8 | 157.3 | 143.8 | -76.8 | -90.5 | 0 | 0 | 0 | 108.9 | C409 | C409-Y411 PolarHBondContact O-N 3.33Š| ||
| 412 | D | 35.1 | Very low | 58 | Low | 124 Ų | 124 | 89.4 Ų | 89.4 | 66% | 0.663 | 50% | 0.503 | S | S | * | . | trans | 94.3 | 76.1 | 175.8 | -52.4 | -19.7 | 0 | 0 | 0 | 117 | ||||
| 413 | L | 32.9 | Very low | 56.4 | Low | 154 Ų | 154 | 87.8 Ų | 87.8 | 81% | 0.806 | 49% | 0.491 | S | S | * | . | trans | -110.9 | 21.8 | 143.8 | -88.4 | 166.3 | 0 | 0 | 0 | 111.4 | Y335 | Y335-L413 HydrophobicContact CD2-CD1 4.06Å; Y335-L413 HydrophobicContact CE2-CD1 4.17Å | ||
| 414 | T | 29.1 | Very low | 54.9 | Low | 120 Ų | 120 | 88.8 Ų | 88.8 | 74% | 0.736 | 50% | 0.499 | S | S | * | . | trans | -112.2 | 79.1 | 168.9 | 48.7 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 415 | S | 30 | Very low | 52.7 | Low | 183 Ų | 183 | 94.8 Ų | 94.8 | 100% | 1.28 | 54% | 0.537 | S | S | * | . | trans | -153.4 | 0 | 161.8 | -54 | 0 | 0 | 0 | 0 | 108.7 |
Retrieved 415 of 415 residues in 80.1 ms
(Link to these results)