| 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 | 57.2 | Low | 60.4 | Low | 209 Ų | 209 | 116 Ų | 116 | 100% | 1.03 | 62% | 0.619 | S | S | * | * | 0 | -42.1 | 0 | -77.2 | -177 | -171.8 | 0 | 0 | 114.2 | R3 L4 V5 | M1-R3 PolarHBondContact O-N 2.77Å; M1-L4 PolarHBondContact O-N 2.85Å; M1-V5 PolarHBondContact O-N 2.96Å | |||
| 2 | Q | 56.9 | Low | 60.9 | Low | 178 Ų | 178 | 118.8 Ų | 118.8 | 83% | 0.832 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -57.5 | -39.4 | -177.6 | -72.3 | 179.2 | -14 | 0 | 0 | 115.2 | L4 V5 A6 | Q2-L4 VanDerWaalsContact C-N 3.28Å; Q2-L4 PolarHBondContact O-N 2.68Å; Q2-V5 PolarHBondContact O-N 3.24Å; Q2-A6 PolarHBondContact O-N 3.42Å |
| 3 | R | 56.8 | Low | 61.5 | Low | 227 Ų | 227 | 116.7 Ų | 116.7 | 86% | 0.857 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -63.3 | -33.7 | 175.9 | -72.2 | -173.3 | 179 | 177.2 | 0.1 | 113 | M1 A6 T7 | M1-R3 PolarHBondContact O-N 2.77Å; R3-A6 PolarHBondContact O-N 3.3Å; R3-T7 PolarHBondContact O-N 3.37Å; R3-T7 PolarHBondContact O-OG1 3.19Å |
| 4 | L | 54.2 | Low | 62.5 | Low | 116 Ų | 116 | 118.9 Ų | 118.9 | 61% | 0.607 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -74.6 | -39.2 | -177.6 | -143.8 | 140.4 | 0 | 0 | 0 | 110.8 | M1 Q2 A6 T7 I8 | M1-L4 PolarHBondContact O-N 2.85Å; Q2-L4 VanDerWaalsContact C-N 3.28Å; Q2-L4 PolarHBondContact O-N 2.68Å; L4-A6 VanDerWaalsContact C-N 3.34Å; L4-T7 WeakPolarHBondContact CA-OG1 3.31Å; L4-T7 PolarHBondContact O-N 3.32Å; L4-T7 PolarHBondContact O-OG1 3.03Å; L4-I8 HydrophobicContact CD2-CD1 3.73Å; L4-I8 HydrophobicContact CD2-CG1 4.46Å; L4-I8 WeakPolarHBondContact O-CG1 3.47Å; L4-I8 PolarHBondContact O-N 3.12Å |
| 5 | V | 61.1 | Low | 63.2 | Low | 100 Ų | 100 | 118.5 Ų | 118.5 | 61% | 0.606 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -61.8 | -41 | 170.7 | 179.4 | 0 | 0 | 0 | 0 | 111.2 | M1 Q2 I8 S9 | M1-V5 PolarHBondContact O-N 2.96Å; Q2-V5 PolarHBondContact O-N 3.24Å; V5-I8 PolarHBondContact O-N 3.45Å; V5-S9 VanDerWaalsContact O-CB 3.29Å; V5-S9 WeakPolarHBondContact O-CB 3.49Å; V5-S9 PolarHBondContact O-N 3.3Å |
| 6 | A | 58.7 | Low | 63.8 | Low | 47 Ų | 47 | 115.9 Ų | 115.9 | 39% | 0.388 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -65.7 | -39.7 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | Q2 R3 L4 N10 | Q2-A6 PolarHBondContact O-N 3.42Å; R3-A6 PolarHBondContact O-N 3.3Å; L4-A6 VanDerWaalsContact C-N 3.34Å; A6-N10 WeakPolarHBondContact O-CB 3.36Å; A6-N10 PolarHBondContact O-N 3.48Å; A6-N10 PolarHBondContact O-ND2 3.37Å |
| 7 | T | 61.6 | Low | 64.6 | Low | 94 Ų | 94 | 119.6 Ų | 119.6 | 58% | 0.577 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -66.3 | -39.3 | 173.8 | 21.8 | 0 | 0 | 0 | 0 | 112.9 | R3 L4 G11 | R3-T7 PolarHBondContact O-N 3.37Å; R3-T7 PolarHBondContact O-OG1 3.19Å; L4-T7 WeakPolarHBondContact CA-OG1 3.31Å; L4-T7 PolarHBondContact O-N 3.32Å; L4-T7 PolarHBondContact O-OG1 3.03Å; T7-G11 PolarHBondContact O-N 2.91Å |
| 8 | I | 61.9 | Low | 65.3 | Low | 97 Ų | 97 | 120.5 Ų | 120.5 | 50% | 0.497 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -68.9 | -40.3 | 177.5 | -66.5 | 169.7 | 0 | 0 | 0 | 110.5 | L4 V5 G11 K12 | L4-I8 HydrophobicContact CD2-CD1 3.73Å; L4-I8 HydrophobicContact CD2-CG1 4.46Å; L4-I8 WeakPolarHBondContact O-CG1 3.47Å; L4-I8 PolarHBondContact O-N 3.12Å; V5-I8 PolarHBondContact O-N 3.45Å; I8-G11 PolarHBondContact O-N 3.48Å; I8-K12 PolarHBondContact O-N 3.08Å |
| 9 | S | 64.1 | Low | 65.8 | Low | 60 Ų | 60 | 117.7 Ų | 117.7 | 42% | 0.42 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -62.8 | -48.6 | 176.1 | 177.5 | 0 | 0 | 0 | 0 | 112.1 | V5 G11 K12 L13 | V5-S9 VanDerWaalsContact O-CB 3.29Å; V5-S9 WeakPolarHBondContact O-CB 3.49Å; V5-S9 PolarHBondContact O-N 3.3Å; S9-G11 VanDerWaalsContact C-N 3.31Å; S9-G11 PolarHBondContact O-N 3.43Å; S9-K12 PolarHBondContact O-N 3.07Å; S9-L13 PolarHBondContact O-N 3.27Å |
| 10 | N | 67.1 | Low | 66.3 | Low | 107 Ų | 107 | 114.5 Ų | 114.5 | 57% | 0.572 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -65 | -34.9 | 175.9 | -82 | -43 | 0 | 0 | 0 | 112.5 | A6 K14 | A6-N10 WeakPolarHBondContact O-CB 3.36Å; A6-N10 PolarHBondContact O-N 3.48Å; A6-N10 PolarHBondContact O-ND2 3.37Å; N10-K14 WeakPolarHBondContact O-CB 3.31Å; N10-K14 PolarHBondContact O-N 3.35Å |
| 11 | G | 65 | Low | 66.9 | Low | 41 Ų | 41 | 114.3 Ų | 114.3 | 42% | 0.423 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -62.2 | -46.3 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | T7 I8 S9 K14 L15 | T7-G11 PolarHBondContact O-N 2.91Å; I8-G11 PolarHBondContact O-N 3.48Å; S9-G11 VanDerWaalsContact C-N 3.31Å; S9-G11 PolarHBondContact O-N 3.43Å; G11-K14 PolarHBondContact O-N 3.1Å; G11-L15 WeakPolarHBondContact O-CB 3.41Å; G11-L15 PolarHBondContact O-N 3.41Å |
| 12 | K | 66.7 | Low | 67.7 | Low | 149 Ų | 149 | 108 Ų | 108 | 65% | 0.648 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -63.1 | -44.4 | 176.4 | -79.2 | -170.5 | 171.5 | -171.6 | 0 | 112.4 | I8 S9 K14 L15 N16 | I8-K12 PolarHBondContact O-N 3.08Å; S9-K12 PolarHBondContact O-N 3.07Å; K12-K14 VanDerWaalsContact C-N 3.34Å; K12-K14 PolarHBondContact O-N 3.3Å; K12-L15 PolarHBondContact O-N 2.88Å; K12-N16 WeakPolarHBondContact O-CB 3.43Å; K12-N16 PolarHBondContact O-N 3.47Å |
| 13 | L | 68.3 | Low | 68.3 | Low | 92 Ų | 92 | 101.6 Ų | 101.6 | 48% | 0.482 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -61.5 | -40.9 | 176.2 | -96.8 | 148.8 | 0 | 0 | 0 | 112.5 | S9 R17 | S9-L13 PolarHBondContact O-N 3.27Å; L13-R17 PolarHBondContact O-N 3.41Å |
| 14 | K | 75.5 | Confident | 69.1 | Low | 147 Ų | 147 | 98.1 Ų | 98.1 | 64% | 0.639 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -70.1 | -36.5 | 178 | -161.9 | 174.5 | -170.5 | 175.2 | 0 | 112.2 | N10 G11 K12 K18 | N10-K14 WeakPolarHBondContact O-CB 3.31Å; N10-K14 PolarHBondContact O-N 3.35Å; G11-K14 PolarHBondContact O-N 3.1Å; K12-K14 VanDerWaalsContact C-N 3.34Å; K12-K14 PolarHBondContact O-N 3.3Å; K14-K18 PolarHBondContact O-N 3.25Å; K14-K18 VanDerWaalsContact O-N 3.09Å |
| 15 | L | 73.3 | Confident | 69.8 | Low | 114 Ų | 114 | 101.2 Ų | 101.2 | 60% | 0.597 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -67 | -47.2 | 175 | -160 | 88.6 | 0 | 0 | 0 | 110.8 | G11 K12 R17 K18 L19 | G11-L15 WeakPolarHBondContact O-CB 3.41Å; G11-L15 PolarHBondContact O-N 3.41Å; K12-L15 PolarHBondContact O-N 2.88Å; L15-R17 PolarHBondContact O-N 3.43Å; L15-K18 PolarHBondContact O-N 3.12Å; L15-L19 WeakPolarHBondContact O-CB 3.3Å; L15-L19 PolarHBondContact O-N 2.8Å |
| 16 | N | 72.6 | Confident | 69.6 | Low | 77 Ų | 77 | 104.8 Ų | 104.8 | 41% | 0.412 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -60.3 | -42.6 | 177.3 | -87.5 | -13.1 | 0 | 0 | 0 | 112.2 | K12 L19 A20 | K12-N16 WeakPolarHBondContact O-CB 3.43Å; K12-N16 PolarHBondContact O-N 3.47Å; N16-L19 PolarHBondContact O-N 3.38Å; N16-A20 WeakPolarHBondContact O-CB 3.34Å; N16-A20 PolarHBondContact O-N 3.48Å |
| 17 | R | 77.2 | Confident | 69.3 | Low | 178 Ų | 178 | 106 Ų | 106 | 67% | 0.672 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -62.5 | -45.6 | 174.1 | -80.2 | -172.7 | -174.4 | 163.4 | 2.9 | 112.6 | L13 L15 L19 A20 D21 | L13-R17 PolarHBondContact O-N 3.41Å; L15-R17 PolarHBondContact O-N 3.43Å; R17-L19 VanDerWaalsContact C-N 3.29Å; R17-L19 PolarHBondContact O-N 3.11Å; R17-A20 PolarHBondContact O-N 3.17Å; R17-D21 WeakPolarHBondContact O-CB 3.42Å; R17-D21 PolarHBondContact O-N 3.26Å |
| 18 | K | 78 | Confident | 68.7 | Low | 136 Ų | 136 | 109.6 Ų | 109.6 | 59% | 0.591 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -61.7 | -38.5 | 177.1 | -81.6 | -170.3 | 172.4 | -169.3 | 0 | 112.3 | K14 L15 T22 | K14-K18 PolarHBondContact O-N 3.25Å; K14-K18 VanDerWaalsContact O-N 3.09Å; L15-K18 PolarHBondContact O-N 3.12Å; K18-T22 WeakPolarHBondContact O-CB 3.39Å; K18-T22 PolarHBondContact O-N 3.23Å; K18-T22 PolarHBondContact O-OG1 3.46Å |
| 19 | L | 73.9 | Confident | 67.9 | Low | 67 Ų | 67 | 109.9 Ų | 109.9 | 35% | 0.351 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -68.4 | -43.8 | 177.9 | -123.4 | 136.9 | 0 | 0 | 0 | 111 | L15 N16 R17 T22 L23 I206 | L15-L19 WeakPolarHBondContact O-CB 3.3Å; L15-L19 PolarHBondContact O-N 2.8Å; N16-L19 PolarHBondContact O-N 3.38Å; R17-L19 VanDerWaalsContact C-N 3.29Å; R17-L19 PolarHBondContact O-N 3.11Å; L19-T22 PolarHBondContact O-N 3.36Å; L19-L23 HydrophobicContact CD2-CD1 4.06Å; L19-L23 WeakPolarHBondContact O-CB 3.5Å; L19-L23 WeakPolarHBondContact O-CG 3.4Å; L19-L23 PolarHBondContact O-N 3.02Å; L19-I206 HydrophobicContact CD2-CD1 4.31Å; L19-I206 HydrophobicContact CD2-CG2 4.4Å |
| 20 | A | 76.6 | Confident | 66.8 | Low | 54 Ų | 54 | 118.8 Ų | 118.8 | 45% | 0.446 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -61.3 | -45.3 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | N16 R17 T22 L23 K24 | N16-A20 WeakPolarHBondContact O-CB 3.34Å; N16-A20 PolarHBondContact O-N 3.48Å; R17-A20 PolarHBondContact O-N 3.17Å; A20-T22 VanDerWaalsContact C-N 3.32Å; A20-T22 PolarHBondContact O-N 3.44Å; A20-L23 PolarHBondContact O-N 2.83Å; A20-K24 WeakPolarHBondContact O-CB 3.26Å; A20-K24 PolarHBondContact O-N 3.35Å |
| 21 | D | 78.3 | Confident | 65.5 | Low | 111 Ų | 111 | 122.4 Ų | 122.4 | 59% | 0.594 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -64.4 | -37.8 | 177.2 | -73.7 | -23.5 | 0 | 0 | 0 | 111.9 | R17 K25 | R17-D21 WeakPolarHBondContact O-CB 3.42Å; R17-D21 PolarHBondContact O-N 3.26Å; D21-K25 PolarHBondContact O-N 2.98Å; D21-K25 VanDerWaalsContact O-N 3.15Å |
| 22 | T | 74 | Confident | 64.4 | Low | 77 Ų | 77 | 125.5 Ų | 125.5 | 47% | 0.472 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -68.8 | -45.2 | 176.7 | -52.5 | 0 | 0 | 0 | 0 | 110.4 | K18 L19 A20 K24 K25 Y26 | K18-T22 WeakPolarHBondContact O-CB 3.39Å; K18-T22 PolarHBondContact O-N 3.23Å; K18-T22 PolarHBondContact O-OG1 3.46Å; L19-T22 PolarHBondContact O-N 3.36Å; A20-T22 VanDerWaalsContact C-N 3.32Å; A20-T22 PolarHBondContact O-N 3.44Å; T22-K24 VanDerWaalsContact C-N 3.34Å; T22-K24 PolarHBondContact O-N 3.38Å; T22-K25 PolarHBondContact O-N 3.31Å; T22-K25 VanDerWaalsContact O-N 3.17Å; T22-Y26 HydrophobicContact CG2-CD2 4.08Å; T22-Y26 HydrophobicContact CG2-CE2 4.11Å; T22-Y26 VanDerWaalsContact O-CD2 3.32Å; T22-Y26 WeakPolarHBondContact O-CD2 3.32Å; T22-Y26 PolarHBondContact O-N 3.02Å |
| 23 | L | 69.3 | Low | 62.9 | Low | 42 Ų | 42 | 125.5 Ų | 125.5 | 22% | 0.22 | 61% | 0.605 | C | S | . | * | H | α-helix | trans | -61.1 | -41.6 | 176.3 | -76.5 | 166.8 | 0 | 0 | 0 | 111.7 | L19 A20 K25 Y26 S27 A210 Y213 | L19-L23 HydrophobicContact CD2-CD1 4.06Å; L19-L23 WeakPolarHBondContact O-CB 3.5Å; L19-L23 WeakPolarHBondContact O-CG 3.4Å; L19-L23 PolarHBondContact O-N 3.02Å; A20-L23 PolarHBondContact O-N 2.83Å; L23-K25 VanDerWaalsContact C-N 3.27Å; L23-K25 PolarHBondContact O-N 3.26Å; L23-Y26 CarbonylContact O-C 3.53Å; L23-Y26 PolarHBondContact O-N 3.43Å; L23-S27 WeakPolarHBondContact O-CB 3.29Å; L23-S27 PolarHBondContact O-N 3.1Å; L23-S27 PolarHBondContact O-OG 3.38Å; L23-A210 HydrophobicContact CD1-CB 4Å; L23-Y213 HydrophobicContact CD2-CD1 4.15Å |
| 24 | K | 73.6 | Confident | 61.3 | Low | 154 Ų | 154 | 128.3 Ų | 128.3 | 67% | 0.67 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -62.2 | -32.8 | 176 | -166.9 | 173.2 | -174.1 | 174.5 | 0 | 113.2 | A20 T22 Y26 S27 | A20-K24 WeakPolarHBondContact O-CB 3.26Å; A20-K24 PolarHBondContact O-N 3.35Å; T22-K24 VanDerWaalsContact C-N 3.34Å; T22-K24 PolarHBondContact O-N 3.38Å; K24-Y26 VanDerWaalsContact C-N 3.31Å; K24-S27 PolarHBondContact O-OG 3.31Å |
| 25 | K | 69.9 | Low | 59.5 | Low | 181 Ų | 181 | 126.8 Ų | 126.8 | 79% | 0.787 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -73.3 | -24.8 | 175.5 | -161.3 | 175.3 | -177.2 | -178.9 | 0 | 112.7 | D21 T22 L23 | D21-K25 PolarHBondContact O-N 2.98Å; D21-K25 VanDerWaalsContact O-N 3.15Å; T22-K25 PolarHBondContact O-N 3.31Å; T22-K25 VanDerWaalsContact O-N 3.17Å; L23-K25 VanDerWaalsContact C-N 3.27Å; L23-K25 PolarHBondContact O-N 3.26Å |
| 26 | Y | 55.5 | Low | 57.7 | Low | 175 Ų | 175 | 129.2 Ų | 129.2 | 69% | 0.686 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -98.2 | -15.3 | 178.7 | -82 | -82.6 | 0 | 0 | 0 | 113.9 | T22 L23 K24 Q28 | T22-Y26 HydrophobicContact CG2-CD2 4.08Å; T22-Y26 HydrophobicContact CG2-CE2 4.11Å; T22-Y26 VanDerWaalsContact O-CD2 3.32Å; T22-Y26 WeakPolarHBondContact O-CD2 3.32Å; T22-Y26 PolarHBondContact O-N 3.02Å; L23-Y26 CarbonylContact O-C 3.53Å; L23-Y26 PolarHBondContact O-N 3.43Å; K24-Y26 VanDerWaalsContact C-N 3.31Å; Y26-Q28 VanDerWaalsContact C-N 3.35Å; Y26-Q28 PolarHBondContact O-N 3.5Å |
| 27 | S | 53.8 | Low | 55.9 | Low | 72 Ų | 72 | 134.2 Ų | 134.2 | 50% | 0.503 | 66% | 0.655 | S | S | . | * | trans | -85.7 | 5.7 | -177.7 | 70.8 | 0 | 0 | 0 | 0 | 115.1 | L23 K24 P29 | L23-S27 WeakPolarHBondContact O-CB 3.29Å; L23-S27 PolarHBondContact O-N 3.1Å; L23-S27 PolarHBondContact O-OG 3.38Å; K24-S27 PolarHBondContact O-OG 3.31Å; S27-P29 WeakPolarHBondContact O-CD 3.15Å; S27-P29 VanDerWaalsContact O-N 3.12Å | ||
| 28 | Q | 48 | Very low | 54.1 | Low | 171 Ų | 171 | 134.9 Ų | 134.9 | 80% | 0.799 | 67% | 0.666 | S | S | * | * | trans | -62.7 | 116 | 170.5 | -95.1 | -164.3 | -6.1 | 0 | 0 | 109.9 | Y26 R30 | Y26-Q28 VanDerWaalsContact C-N 3.35Å; Y26-Q28 PolarHBondContact O-N 3.5Å; Q28-R30 PolarHBondContact O-N 2.87Å | ||
| 29 | P | 45 | Very low | 52.1 | Low | 102 Ų | 102 | 136.2 Ų | 136.2 | 66% | 0.662 | 67% | 0.674 | S | S | * | * | trans | -69.7 | 120.1 | -179.1 | -12.6 | 27.9 | 0 | 0 | 0 | 109.4 | S27 F31 | S27-P29 WeakPolarHBondContact O-CD 3.15Å; S27-P29 VanDerWaalsContact O-N 3.12Å; P29-F31 HydrophobicContact CB-CD2 3.74Å; P29-F31 HydrophobicContact CB-CE2 4.42Å; P29-F31 PolarHBondContact O-N 3.26Å | ||
| 30 | R | 42.1 | Very low | 50.3 | Low | 248 Ų | 248 | 140 Ų | 140 | 94% | 0.936 | 69% | 0.69 | S | S | * | * | trans | -73.1 | 73.3 | 157.1 | -80 | -172.6 | -175.7 | 162.7 | 0.7 | 108.3 | Q28 | Q28-R30 PolarHBondContact O-N 2.87Š| ||
| 31 | F | 39.4 | Very low | 48.3 | Very low | 182 Ų | 182 | 145.6 Ų | 145.6 | 80% | 0.798 | 71% | 0.707 | S | S | * | * | trans | -96.5 | 122.7 | 159.1 | -88.3 | -79.7 | 0 | 0 | 0 | 108 | P29 E33 | P29-F31 HydrophobicContact CB-CD2 3.74Å; P29-F31 HydrophobicContact CB-CE2 4.42Å; P29-F31 PolarHBondContact O-N 3.26Å; F31-E33 PolarHBondContact O-N 3Å | ||
| 32 | P | 40.6 | Very low | 46.4 | Very low | 107 Ų | 107 | 145 Ų | 145 | 70% | 0.695 | 71% | 0.709 | S | S | * | * | trans | -66.8 | 119.3 | 171.3 | 26.3 | -29.5 | 0 | 0 | 0 | 109 | N34 | P32-N34 VanDerWaalsContact C-N 3.25Å; P32-N34 PolarHBondContact O-N 2.89Å | ||
| 33 | E | 36 | Very low | 44.7 | Very low | 148 Ų | 148 | 150.5 Ų | 150.5 | 69% | 0.692 | 73% | 0.729 | S | S | * | * | trans | -65.8 | 81.4 | 170.6 | -168.3 | -179 | 151.8 | 0 | 0 | 109.1 | F31 K36 | F31-E33 PolarHBondContact O-N 3Å; E33-K36 IonicContact OE1-NZ 3.28Å; E33-K36 PolarHBondContact OE1-NZ 3.28Å | ||
| 34 | N | 34.7 | Very low | 43.1 | Very low | 152 Ų | 152 | 154.1 Ų | 154.1 | 81% | 0.813 | 76% | 0.756 | S | S | * | * | trans | -122.7 | 71.7 | 172.8 | -89.5 | -9.7 | 0 | 0 | 0 | 109.5 | P32 | P32-N34 VanDerWaalsContact C-N 3.25Å; P32-N34 PolarHBondContact O-N 2.89Å | ||
| 35 | S | 37.1 | Very low | 41.5 | Very low | 114 Ų | 114 | 151 Ų | 151 | 80% | 0.797 | 76% | 0.759 | S | S | * | * | trans | -160.4 | 60.9 | 165.5 | 45.1 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 36 | K | 35.9 | Very low | 39.8 | Very low | 166 Ų | 166 | 151 Ų | 151 | 72% | 0.722 | 76% | 0.761 | S | S | * | * | trans | -129.7 | 76 | 162.5 | -79.6 | 178.2 | 179.2 | 147.2 | 0 | 108.6 | E33 | E33-K36 IonicContact OE1-NZ 3.28Å; E33-K36 PolarHBondContact OE1-NZ 3.28Å | ||
| 37 | Q | 35.3 | Very low | 38.8 | Very low | 182 Ų | 182 | 153.4 Ų | 153.4 | 85% | 0.85 | 77% | 0.769 | S | S | * | * | trans | -178.7 | 96.8 | 158.4 | -109.5 | 167.2 | -9.4 | 0 | 0 | 110.1 | ||||
| 38 | E | 38.3 | Very low | 37.8 | Very low | 192 Ų | 192 | 157.9 Ų | 157.9 | 90% | 0.897 | 78% | 0.782 | S | S | * | * | trans | 172.3 | 81.2 | 140 | -100.2 | 179.3 | 100.5 | 0 | 0 | 106.4 | ||||
| 39 | Q | 35.9 | Very low | 37.4 | Very low | 164 Ų | 164 | 159 Ų | 159 | 77% | 0.766 | 79% | 0.787 | S | S | * | * | 62.8 | 111.4 | 93.7 | -99.9 | 178 | -42.2 | 0 | 0 | 115.5 | |||||
| 40 | Q | 36.1 | Very low | 36.7 | Very low | 147 Ų | 147 | 159.2 Ų | 159.2 | 69% | 0.687 | 79% | 0.787 | S | S | * | * | trans | 84.6 | 95.5 | 138.9 | -113.6 | 134.3 | -30.3 | 0 | 0 | 118.7 | ||||
| 41 | Q | 35.7 | Very low | 36.3 | Very low | 171 Ų | 171 | 157.7 Ų | 157.7 | 80% | 0.799 | 78% | 0.782 | S | S | * | * | 94.2 | 159.7 | 82.6 | -119.6 | -166.2 | -31.2 | 0 | 0 | 113.8 | |||||
| 42 | P | 37.7 | Very low | 36.2 | Very low | 98 Ų | 98 | 157.6 Ų | 157.6 | 64% | 0.636 | 78% | 0.781 | S | S | * | * | -130.7 | 169.3 | -99.6 | 42.6 | -26.6 | 0 | 0 | 0 | 114.6 | |||||
| 43 | Q | 39 | Very low | 35.8 | Very low | 192 Ų | 192 | 160.7 Ų | 160.7 | 90% | 0.897 | 79% | 0.787 | S | S | * | * | trans | -174.9 | 154.2 | 131.2 | -105.8 | -174.7 | 2.1 | 0 | 0 | 113.6 | ||||
| 44 | P | 36.1 | Very low | 36 | Very low | 119 Ų | 119 | 162.8 Ų | 162.8 | 77% | 0.773 | 80% | 0.796 | S | S | * | * | trans | -108.8 | 158.5 | -162.2 | 40.8 | -31.5 | 0 | 0 | 0 | 114 | ||||
| 45 | A | 38.7 | Very low | 35.9 | Very low | 89 Ų | 89 | 162.3 Ų | 162.3 | 74% | 0.736 | 79% | 0.794 | S | S | * | * | trans | -158.1 | 118.4 | 153.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 46 | E | 35.6 | Very low | 35.9 | Very low | 180 Ų | 180 | 160.7 Ų | 160.7 | 84% | 0.841 | 80% | 0.795 | S | S | * | * | trans | 34.5 | 122.1 | 143.7 | -67.3 | 176.4 | 97.7 | 0 | 0 | 120.8 | ||||
| 47 | R | 34.8 | Very low | 35.6 | Very low | 226 Ų | 226 | 159 Ų | 159 | 85% | 0.853 | 80% | 0.799 | S | S | * | * | 177.4 | 120.1 | 86.3 | -175.7 | 175.5 | -76.7 | -142.2 | -1.1 | 110.4 | |||||
| 48 | H | 31.7 | Very low | 35.9 | Very low | 166 Ų | 166 | 158.7 Ų | 158.7 | 77% | 0.769 | 80% | 0.798 | S | S | * | * | trans | -60.6 | 140.9 | 166.6 | -100 | -100.3 | 0 | 0 | 0 | 111.4 | ||||
| 49 | E | 40.6 | Very low | 35.8 | Very low | 195 Ų | 195 | 158.4 Ų | 158.4 | 91% | 0.911 | 80% | 0.796 | S | S | * | * | trans | -159.8 | 115.9 | 131.5 | -107.8 | 166.5 | -163.9 | 0 | 0 | 110.3 | ||||
| 50 | T | 29 | Very low | 35.6 | Very low | 106 Ų | 106 | 154.1 Ų | 154.1 | 65% | 0.65 | 80% | 0.796 | S | S | * | * | trans | -112.4 | 132.4 | 177 | -52.7 | 0 | 0 | 0 | 0 | 105.5 | ||||
| 51 | Y | 34.9 | Very low | 35.5 | Very low | 216 Ų | 216 | 156.7 Ų | 156.7 | 85% | 0.847 | 81% | 0.805 | S | S | * | * | trans | 174.5 | 143.7 | 152.1 | -95 | -80.6 | 0 | 0 | 0 | 106.4 | ||||
| 52 | K | 35.8 | Very low | 35.2 | Very low | 179 Ų | 179 | 156.1 Ų | 156.1 | 78% | 0.778 | 81% | 0.808 | S | S | * | * | cis | -174.8 | 143.3 | -23.1 | -165.9 | 177.4 | -175.3 | -174.9 | 0 | 104.1 | ||||
| 53 | E | 32.6 | Very low | 35.2 | Very low | 173 Ų | 173 | 155.8 Ų | 155.8 | 81% | 0.808 | 81% | 0.813 | S | S | * | * | trans | -59.5 | 132.5 | 171.9 | -169 | 178.5 | 145.7 | 0 | 0 | 111.1 | ||||
| 54 | E | 40.1 | Very low | 35 | Very low | 191 Ų | 191 | 152.7 Ų | 152.7 | 89% | 0.893 | 81% | 0.808 | S | S | * | * | trans | -133.3 | 106 | 165.7 | -159.6 | 174.2 | 175.7 | 0 | 0 | 109.8 | ||||
| 55 | N | 33.1 | Very low | 34.8 | Very low | 142 Ų | 142 | 153.1 Ų | 153.1 | 76% | 0.759 | 81% | 0.808 | S | S | * | * | trans | -69.4 | 133.4 | 162.3 | -100.5 | -32.3 | 0 | 0 | 0 | 109.2 | ||||
| 56 | G | 36.5 | Very low | 34.7 | Very low | 80 Ų | 80 | 153.6 Ų | 153.6 | 83% | 0.825 | 81% | 0.812 | S | S | * | * | trans | -140.1 | 97.9 | 170.9 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 57 | T | 30.9 | Very low | 34.7 | Very low | 132 Ų | 132 | 153 Ų | 153 | 81% | 0.81 | 81% | 0.809 | S | S | * | * | trans | -86.2 | 135.2 | 166.9 | -52.1 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 58 | E | 39.9 | Very low | 34.9 | Very low | 175 Ų | 175 | 149.1 Ų | 149.1 | 82% | 0.818 | 81% | 0.81 | S | S | * | * | trans | 168.9 | 109 | 145.9 | -96.6 | 174.5 | -176 | 0 | 0 | 108.7 | ||||
| 59 | E | 36.7 | Very low | 35.2 | Very low | 186 Ų | 186 | 148 Ų | 148 | 87% | 0.869 | 81% | 0.809 | S | S | * | * | 76.8 | 122.2 | 100.8 | -79.2 | -153.6 | 147.2 | 0 | 0 | 115.4 | |||||
| 60 | G | 32.7 | Very low | 35.1 | Very low | 74 Ų | 74 | 147.2 Ų | 147.2 | 76% | 0.763 | 81% | 0.806 | S | S | * | * | trans | 122.7 | 110.3 | 134.8 | 0 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 61 | K | 34.5 | Very low | 35.7 | Very low | 201 Ų | 201 | 148 Ų | 148 | 87% | 0.874 | 81% | 0.813 | S | S | * | * | trans | 83.4 | 104.6 | 141.7 | -83.1 | 174.1 | 170.4 | 169.2 | 0 | 121.4 | ||||
| 62 | D | 29.3 | Very low | 35.8 | Very low | 159 Ų | 159 | 147.4 Ų | 147.4 | 85% | 0.85 | 82% | 0.815 | S | S | * | * | 32.9 | 113 | 119.3 | -74.6 | -28.8 | 0 | 0 | 0 | 119.3 | |||||
| 63 | A | 37.2 | Very low | 35.7 | Very low | 91 Ų | 91 | 146.5 Ų | 146.5 | 75% | 0.752 | 82% | 0.818 | S | S | * | * | trans | -169.5 | 104.1 | 130.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 64 | T | 34.1 | Very low | 36.1 | Very low | 127 Ų | 127 | 143.1 Ų | 143.1 | 78% | 0.779 | 82% | 0.819 | S | S | * | * | 37.4 | 114 | 129.1 | 20.9 | 0 | 0 | 0 | 0 | 121.6 | |||||
| 65 | V | 32.6 | Very low | 35.7 | Very low | 128 Ų | 128 | 139.4 Ų | 139.4 | 78% | 0.776 | 81% | 0.81 | S | S | * | * | 63.5 | 113.9 | 125.7 | -177.1 | 0 | 0 | 0 | 0 | 119.2 | |||||
| 66 | A | 36.7 | Very low | 35.8 | Very low | 99 Ų | 99 | 138.2 Ų | 138.2 | 82% | 0.818 | 81% | 0.813 | S | S | * | * | trans | -142.5 | 117.8 | 137 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 67 | E | 34.2 | Very low | 35.6 | Very low | 167 Ų | 167 | 140.2 Ų | 140.2 | 78% | 0.78 | 81% | 0.809 | S | S | * | * | trans | -64.3 | 133.5 | 176.8 | -176.1 | 177.3 | 132.5 | 0 | 0 | 111.4 | ||||
| 68 | V | 39.8 | Very low | 35.7 | Very low | 144 Ų | 144 | 140 Ų | 140 | 87% | 0.873 | 81% | 0.811 | S | S | * | * | trans | -135.8 | 122 | 167.9 | -179.8 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 69 | D | 39.2 | Very low | 35.4 | Very low | 143 Ų | 143 | 143 Ų | 143 | 77% | 0.765 | 82% | 0.815 | S | S | * | * | trans | -64.6 | 145.9 | -168.8 | -81.6 | -57.3 | 0 | 0 | 0 | 116.6 | ||||
| 70 | E | 36.7 | Very low | 35.4 | Very low | 178 Ų | 178 | 138.4 Ų | 138.4 | 83% | 0.832 | 81% | 0.809 | S | S | * | * | trans | -89.9 | 130.5 | 175.9 | -164.3 | -174.7 | 150 | 0 | 0 | 110.6 | K72 | E70-K72 PolarHBondContact O-N 3.2Š| ||
| 71 | P | 42 | Very low | 35.7 | Very low | 124 Ų | 124 | 140.8 Ų | 140.8 | 81% | 0.805 | 81% | 0.811 | S | S | * | * | trans | -84.3 | 114.6 | 174.3 | 30 | -28.2 | 0 | 0 | 0 | 111.4 | ||||
| 72 | K | 36.9 | Very low | 35.7 | Very low | 203 Ų | 203 | 136.5 Ų | 136.5 | 88% | 0.883 | 81% | 0.813 | S | S | * | * | trans | -48.6 | 124.4 | 176.9 | -73.5 | 168.1 | 175.7 | 168.1 | 0 | 114.3 | E70 A74 | E70-K72 PolarHBondContact O-N 3.2Å; K72-A74 PolarHBondContact O-N 3.3Å | ||
| 73 | L | 34.5 | Very low | 36.1 | Very low | 160 Ų | 160 | 132 Ų | 132 | 84% | 0.838 | 80% | 0.804 | S | S | * | * | trans | -77.5 | 106.9 | 164.2 | -162.4 | 76.4 | 0 | 0 | 0 | 109.6 | T75 | L73-T75 PolarHBondContact O-N 3.31Å; L73-T75 VanDerWaalsContact O-N 3.12Å | ||
| 74 | A | 39.7 | Very low | 36.3 | Very low | 102 Ų | 102 | 136.5 Ų | 136.5 | 84% | 0.843 | 81% | 0.81 | S | S | * | * | trans | -73.3 | 101.2 | 173.3 | 0 | 0 | 0 | 0 | 0 | 110.1 | K72 | K72-A74 PolarHBondContact O-N 3.3Š| ||
| 75 | T | 32.4 | Very low | 36.3 | Very low | 113 Ų | 113 | 136.1 Ų | 136.1 | 69% | 0.693 | 81% | 0.808 | S | S | * | * | trans | -86.6 | 111.1 | 166.9 | -54.4 | 0 | 0 | 0 | 0 | 108 | L73 | L73-T75 PolarHBondContact O-N 3.31Å; L73-T75 VanDerWaalsContact O-N 3.12Å | ||
| 76 | S | 36.3 | Very low | 36.5 | Very low | 117 Ų | 117 | 137.2 Ų | 137.2 | 82% | 0.818 | 81% | 0.809 | S | S | * | * | trans | -105.8 | 99.1 | 169.5 | 173.2 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 77 | T | 31.3 | Very low | 36.7 | Very low | 122 Ų | 122 | 141.4 Ų | 141.4 | 75% | 0.748 | 81% | 0.811 | S | S | * | * | trans | -82.7 | 116.3 | 172 | -56.4 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 78 | C | 34.2 | Very low | 36.9 | Very low | 127 Ų | 127 | 138.6 Ų | 138.6 | 86% | 0.858 | 82% | 0.817 | S | S | * | * | trans | -115.2 | 118.2 | 163 | -138.3 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 79 | R | 32.2 | Very low | 37 | Very low | 238 Ų | 238 | 141.1 Ų | 141.1 | 90% | 0.898 | 82% | 0.819 | S | S | * | * | trans | -78.7 | 124.5 | -175.5 | -174.3 | -177.3 | -160 | 154.4 | 2.6 | 109.1 | ||||
| 80 | A | 37.2 | Very low | 36.7 | Very low | 90 Ų | 90 | 136.8 Ų | 136.8 | 74% | 0.744 | 81% | 0.808 | S | S | * | * | trans | -108 | 133.4 | 163.6 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 81 | P | 39.5 | Very low | 36.6 | Very low | 123 Ų | 123 | 137 Ų | 137 | 80% | 0.799 | 81% | 0.811 | S | S | * | * | trans | -76.5 | 149.5 | 179.5 | 31.7 | -31.6 | 0 | 0 | 0 | 111.5 | ||||
| 82 | A | 34.1 | Very low | 36.4 | Very low | 111 Ų | 111 | 138.3 Ų | 138.3 | 92% | 0.917 | 81% | 0.812 | S | S | * | * | trans | -66.7 | 142.4 | 176 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 83 | G | 37.3 | Very low | 36.3 | Very low | 65 Ų | 65 | 136.5 Ų | 136.5 | 67% | 0.67 | 81% | 0.806 | S | S | * | * | trans | 167.6 | 105.7 | 166.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 84 | E | 40.7 | Very low | 36.4 | Very low | 185 Ų | 185 | 137 Ų | 137 | 86% | 0.864 | 81% | 0.809 | S | S | * | * | trans | 70.9 | 98.8 | 152.2 | -64 | 171.5 | 127.2 | 0 | 0 | 117.8 | ||||
| 85 | T | 34.3 | Very low | 36.5 | Very low | 120 Ų | 120 | 136.8 Ų | 136.8 | 74% | 0.736 | 80% | 0.797 | S | S | * | * | 54.3 | 124 | 95.7 | 38.8 | 0 | 0 | 0 | 0 | 114.9 | |||||
| 86 | D | 38.3 | Very low | 36.8 | Very low | 150 Ų | 150 | 138.3 Ų | 138.3 | 80% | 0.802 | 80% | 0.801 | S | S | * | * | trans | 99.9 | 49.2 | 162.8 | -53.8 | -24.5 | 0 | 0 | 0 | 119.3 | ||||
| 87 | E | 39.7 | Very low | 37 | Very low | 187 Ų | 187 | 137.5 Ų | 137.5 | 87% | 0.874 | 79% | 0.788 | S | S | * | * | trans | -145.6 | 80.6 | 158 | -70.5 | -159.4 | 142.4 | 0 | 0 | 112.3 | ||||
| 88 | A | 38.8 | Very low | 37.6 | Very low | 108 Ų | 108 | 137 Ų | 137 | 89% | 0.893 | 79% | 0.787 | S | S | * | * | S | Bend | trans | -98.2 | 9.4 | 174.7 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||
| 89 | E | 41.2 | Very low | 38 | Very low | 198 Ų | 198 | 137.1 Ų | 137.1 | 93% | 0.925 | 78% | 0.778 | S | S | * | * | S | Bend | trans | -122.9 | 10.3 | 178.9 | -70 | -169.9 | 139 | 0 | 0 | 114 | ||
| 90 | G | 33.7 | Very low | 38.4 | Very low | 52 Ų | 52 | 134.8 Ų | 134.8 | 54% | 0.536 | 77% | 0.769 | S | S | . | * | trans | -99.1 | 2.7 | -174.8 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 91 | M | 34.6 | Very low | 38.5 | Very low | 181 Ų | 181 | 136.9 Ų | 136.9 | 89% | 0.892 | 77% | 0.773 | S | S | * | * | S | Bend | trans | -99 | 10.4 | -170.7 | -133.8 | -170.2 | -156.2 | 0 | 0 | 115.4 | ||
| 92 | D | 36.9 | Very low | 38.3 | Very low | 153 Ų | 153 | 134.3 Ų | 134.3 | 82% | 0.818 | 76% | 0.762 | S | S | * | * | S | Bend | trans | -103.4 | -8 | 172 | -81 | -30.8 | 0 | 0 | 0 | 113.5 | ||
| 93 | Q | 36.1 | Very low | 38.6 | Very low | 164 Ų | 164 | 135 Ų | 135 | 77% | 0.766 | 76% | 0.758 | S | S | * | * | S | Bend | trans | -92.7 | -4.9 | 179.7 | -94 | -179.1 | 45.7 | 0 | 0 | 114.9 | T95 | Q93-T95 VanDerWaalsContact C-N 3.3Å; Q93-T95 PolarHBondContact O-N 3.01Å |
| 94 | L | 36 | Very low | 38.7 | Very low | 170 Ų | 170 | 137.2 Ų | 137.2 | 89% | 0.89 | 76% | 0.762 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.8 | 14.9 | 178.8 | -138.2 | 74.3 | 0 | 0 | 0 | 114 | ||
| 95 | T | 42.8 | Very low | 39.1 | Very low | 98 Ų | 98 | 135.6 Ų | 135.6 | 60% | 0.601 | 76% | 0.76 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -108.2 | 10 | 171.6 | -1.1 | 0 | 0 | 0 | 0 | 113.5 | Q93 N97 | Q93-T95 VanDerWaalsContact C-N 3.3Å; Q93-T95 PolarHBondContact O-N 3.01Å; T95-N97 PolarHBondContact O-N 3.24Å; T95-N97 PolarHBondContact O-ND2 3.07Å |
| 96 | D | 38 | Very low | 40.1 | Very low | 145 Ų | 145 | 135.3 Ų | 135.3 | 78% | 0.775 | 76% | 0.761 | S | S | * | * | trans | -71.1 | 83.1 | 165.6 | -95.1 | -21.7 | 0 | 0 | 0 | 109.2 | P98 | D96-P98 WeakPolarHBondContact O-CD 3.35Å; D96-P98 VanDerWaalsContact O-N 3.15Å | ||
| 97 | N | 41.2 | Very low | 41.3 | Very low | 100 Ų | 100 | 133.3 Ų | 133.3 | 54% | 0.535 | 75% | 0.75 | S | S | . | * | trans | -52.4 | 114.4 | 179.3 | -77.6 | -69.5 | 0 | 0 | 0 | 111.1 | T95 I99 R100 | T95-N97 PolarHBondContact O-N 3.24Å; T95-N97 PolarHBondContact O-ND2 3.07Å; N97-I99 HydrophobicContact CB-CB 4.47Å; N97-I99 PolarHBondContact O-N 3.44Å; N97-R100 PolarHBondContact O-N 2.85Å | ||
| 98 | P | 42.3 | Very low | 43.1 | Very low | 112 Ų | 112 | 127 Ų | 127 | 73% | 0.727 | 73% | 0.725 | S | S | * | * | G | 310 helix | trans | -66.5 | 2.7 | 169.6 | 27.7 | -33.1 | 0 | 0 | 0 | 113.2 | D96 | D96-P98 WeakPolarHBondContact O-CD 3.35Å; D96-P98 VanDerWaalsContact O-N 3.15Å |
| 99 | I | 43.6 | Very low | 45 | Very low | 130 Ų | 130 | 122.5 Ų | 122.5 | 67% | 0.667 | 69% | 0.687 | S | S | * | * | G | 310 helix | trans | -81 | -16.9 | 178.7 | -51.7 | 178.3 | 0 | 0 | 0 | 111.9 | N97 T101 | N97-I99 HydrophobicContact CB-CB 4.47Å; N97-I99 PolarHBondContact O-N 3.44Å; I99-T101 PolarHBondContact O-N 2.9Å; I99-T101 VanDerWaalsContact O-N 3.1Å |
| 100 | R | 39.2 | Very low | 47 | Very low | 189 Ų | 189 | 115.2 Ų | 115.2 | 71% | 0.713 | 65% | 0.654 | S | S | * | * | G | 310 helix | trans | -70.7 | -4.4 | -178.5 | -106.5 | -171.2 | 177.4 | -166.2 | 2.6 | 115.4 | N97 H262 | N97-R100 PolarHBondContact O-N 2.85Å; R100-H262 PolarHBondContact NH2-CE1 3.01Å |
| 101 | T | 40.3 | Very low | 49.5 | Very low | 134 Ų | 134 | 120.1 Ų | 120.1 | 82% | 0.822 | 66% | 0.658 | S | S | * | * | G | 310 helix | trans | -125.1 | 7 | -171.5 | 23.2 | 0 | 0 | 0 | 0 | 114.6 | I99 | I99-T101 PolarHBondContact O-N 2.9Å; I99-T101 VanDerWaalsContact O-N 3.1Å |
| 102 | A | 35.3 | Very low | 51.9 | Low | 69 Ų | 69 | 112.5 Ų | 112.5 | 57% | 0.57 | 62% | 0.624 | S | S | * | * | S | Bend | trans | -120.1 | 120.5 | -178.3 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||
| 103 | C | 39.3 | Very low | 54.3 | Low | 125 Ų | 125 | 105.3 Ų | 105.3 | 85% | 0.845 | 59% | 0.585 | S | S | * | * | S | Bend | trans | 81.2 | 109.4 | 179.7 | -60.1 | 0 | 0 | 0 | 0 | 114.6 | ||
| 104 | C | 40.3 | Very low | 56.9 | Low | 111 Ų | 111 | 101.9 Ų | 101.9 | 75% | 0.75 | 57% | 0.568 | S | S | * | * | trans | -14.7 | 146.6 | 163.9 | -54.2 | 0 | 0 | 0 | 0 | 116.6 | C106 | C104-C106 PolarHBondContact O-N 3.41Å; C104-C106 PolarHBondContact O-SG 3.07Å | ||
| 105 | D | 50.3 | Low | 59.5 | Low | 152 Ų | 152 | 96.2 Ų | 96.2 | 81% | 0.813 | 55% | 0.546 | S | S | * | . | trans | -49.7 | 67 | 159.3 | -76 | -51.3 | 0 | 0 | 0 | 112.3 | L107 | D105-L107 PolarHBondContact O-N 2.7Š| ||
| 106 | C | 54.8 | Low | 61.8 | Low | 114 Ų | 114 | 92 Ų | 92 | 77% | 0.77 | 52% | 0.52 | S | S | * | . | S | Bend | trans | -70.4 | -16.8 | -177.2 | -75.1 | 0 | 0 | 0 | 0 | 111.5 | C104 | C104-C106 PolarHBondContact O-N 3.41Å; C104-C106 PolarHBondContact O-SG 3.07Å |
| 107 | L | 63.3 | Low | 64.3 | Low | 108 Ų | 108 | 85.1 Ų | 85.1 | 57% | 0.565 | 48% | 0.483 | S | S | * | . | S | Bend | trans | -151 | 109.4 | 169.4 | -164.1 | 69.3 | 0 | 0 | 0 | 108.6 | D105 S109 A112 | D105-L107 PolarHBondContact O-N 2.7Å; L107-S109 PolarHBondContact O-N 2.99Å; L107-A112 HydrophobicContact CD2-CB 3.8Å; L107-A112 HydrophobicContact CG-CB 4.44Å |
| 108 | P | 77.3 | Confident | 66.7 | Low | 54 Ų | 54 | 83.7 Ų | 83.7 | 35% | 0.351 | 48% | 0.478 | S | S | . | . | trans | -55.9 | 134.7 | 176.3 | -20.7 | 28 | 0 | 0 | 0 | 109.5 | N110 Y111 A112 | P108-N110 PolarHBondContact O-N 3.35Å; P108-Y111 HydrophobicContact CB-CD2 3.64Å; P108-Y111 HydrophobicContact CB-CE2 4.07Å; P108-Y111 HydrophobicContact CG-CD2 3.55Å; P108-Y111 HydrophobicContact CG-CE2 3.74Å; P108-Y111 PolarHBondContact O-N 3.46Å; P108-A112 PolarHBondContact O-N 3.47Å | ||
| 109 | S | 79.2 | Confident | 69.2 | Low | 14 Ų | 14 | 81.9 Ų | 81.9 | 10% | 0.098 | 46% | 0.464 | C | S | . | . | H | α-helix | trans | -53.7 | -28.5 | -171.6 | -173.9 | 0 | 0 | 0 | 0 | 113.5 | L107 A112 T113 C260 | L107-S109 PolarHBondContact O-N 2.99Å; S109-A112 PolarHBondContact O-N 3.18Å; S109-T113 WeakPolarHBondContact O-CB 3.32Å; S109-T113 PolarHBondContact O-N 2.94Å; S109-T113 PolarHBondContact O-OG1 3.22Å; S109-C260 WeakPolarHBondContact OG-CA 3.34Å; S109-C260 WeakPolarHBondContact OG-CB 3.35Å; S109-C260 PolarHBondContact OG-N 2.9Å |
| 110 | N | 82.1 | Confident | 71.5 | Confident | 44 Ų | 44 | 76.7 Ų | 76.7 | 24% | 0.235 | 44% | 0.437 | C | S | . | . | H | α-helix | trans | -61.8 | -41.5 | 173.3 | -61.5 | -15.8 | 0 | 0 | 0 | 113 | P108 T113 F114 I171 C260 | P108-N110 PolarHBondContact O-N 3.35Å; N110-T113 PolarHBondContact O-N 3.42Å; N110-F114 VanDerWaalsContact O-CB 3.31Å; N110-F114 WeakPolarHBondContact O-CB 3.44Å; N110-F114 PolarHBondContact O-N 2.9Å; N110-I171 HydrophobicContact CB-CG2 4.17Å; N110-C260 PolarHBondContact OD1-SG 3.37Å |
| 111 | Y | 85.8 | Confident | 74.1 | Confident | 155 Ų | 155 | 69.7 Ų | 69.7 | 61% | 0.608 | 42% | 0.416 | S | S | * | . | H | α-helix | trans | -71 | -39.2 | 178.6 | -69.3 | -76.4 | 0 | 0 | 0 | 111.9 | P108 T113 F114 A115 | P108-Y111 HydrophobicContact CB-CD2 3.64Å; P108-Y111 HydrophobicContact CB-CE2 4.07Å; P108-Y111 HydrophobicContact CG-CD2 3.55Å; P108-Y111 HydrophobicContact CG-CE2 3.74Å; P108-Y111 PolarHBondContact O-N 3.46Å; Y111-T113 VanDerWaalsContact C-N 3.3Å; Y111-T113 PolarHBondContact O-N 2.88Å; Y111-F114 PolarHBondContact O-N 3.13Å; Y111-A115 WeakPolarHBondContact O-CB 3.36Å; Y111-A115 PolarHBondContact O-N 3.24Å |
| 112 | A | 86.5 | Confident | 76.6 | Confident | 22 Ų | 22 | 66.3 Ų | 66.3 | 18% | 0.182 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -59.6 | -45.5 | 174 | 0 | 0 | 0 | 0 | 0 | 110.8 | L107 P108 S109 A115 I116 V256 | L107-A112 HydrophobicContact CD2-CB 3.8Å; L107-A112 HydrophobicContact CG-CB 4.44Å; P108-A112 PolarHBondContact O-N 3.47Å; S109-A112 PolarHBondContact O-N 3.18Å; A112-A115 PolarHBondContact O-N 3.49Å; A112-I116 WeakPolarHBondContact O-CG1 3.49Å; A112-I116 PolarHBondContact O-N 2.63Å; A112-V256 HydrophobicContact CB-CG1 3.84Å |
| 113 | T | 87.5 | Confident | 79.3 | Confident | 1 Ų | 1 | 67.8 Ų | 67.8 | 1% | 0.006 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -67.3 | -38.5 | 178.6 | -50.5 | 0 | 0 | 0 | 0 | 111.7 | S109 N110 Y111 I116 A117 L167 I171 V257 C260 | S109-T113 WeakPolarHBondContact O-CB 3.32Å; S109-T113 PolarHBondContact O-N 2.94Å; S109-T113 PolarHBondContact O-OG1 3.22Å; N110-T113 PolarHBondContact O-N 3.42Å; Y111-T113 VanDerWaalsContact C-N 3.3Å; Y111-T113 PolarHBondContact O-N 2.88Å; T113-I116 PolarHBondContact O-N 3.32Å; T113-A117 WeakPolarHBondContact O-CB 3.41Å; T113-A117 PolarHBondContact O-N 3.06Å; T113-L167 HydrophobicContact CG2-CD1 3.99Å; T113-L167 HydrophobicContact CG2-CD2 4.15Å; T113-L167 HydrophobicContact CG2-CG 4.3Å; T113-I171 HydrophobicContact CG2-CD1 3.73Å; T113-V257 HydrophobicContact CG2-CG2 4.11Å; T113-C260 HydrophobicContact CG2-CB 4.32Å; T113-C260 WeakPolarHBondContact OG1-CB 3.29Å |
| 114 | F | 89.7 | Confident | 81.8 | Confident | 92 Ų | 92 | 62.6 Ų | 62.6 | 40% | 0.404 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -63.1 | -42.7 | 174.4 | -173.4 | -86.9 | 0 | 0 | 0 | 112.4 | N110 Y111 A117 T118 F168 | N110-F114 VanDerWaalsContact O-CB 3.31Å; N110-F114 WeakPolarHBondContact O-CB 3.44Å; N110-F114 PolarHBondContact O-N 2.9Å; Y111-F114 PolarHBondContact O-N 3.13Å; F114-A117 PolarHBondContact O-N 2.97Å; F114-T118 PolarHBondContact O-N 3.23Å; F114-T118 PolarHBondContact O-OG1 2.99Å; F114-F168 AromaticContact CD2-CD1 3.78Å; F114-F168 HydrophobicContact CD2-CD1 3.78Å; F114-F168 AromaticContact CD2-CE1 3.43Å; F114-F168 HydrophobicContact CD2-CE1 3.43Å; F114-F168 VanDerWaalsContact CD2-CE1 3.43Å; F114-F168 AromaticContact CE2-CD1 3.76Å; F114-F168 HydrophobicContact CE2-CD1 3.76Å; F114-F168 AromaticContact CE2-CE1 3.36Å; F114-F168 HydrophobicContact CE2-CE1 3.36Å; F114-F168 HydrophobicContact CE2-CZ 4.45Å; F114-F168 HydrophobicContact CG-CE1 4.17Å; F114-F168 HydrophobicContact CZ-CE1 4.07Å |
| 115 | A | 90.9 | Very high | 84.3 | Confident | 52 Ų | 52 | 61.1 Ų | 61.1 | 43% | 0.43 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -62.3 | -45.2 | 176.2 | 0 | 0 | 0 | 0 | 0 | 110.9 | Y111 A112 T118 V119 | Y111-A115 WeakPolarHBondContact O-CB 3.36Å; Y111-A115 PolarHBondContact O-N 3.24Å; A112-A115 PolarHBondContact O-N 3.49Å; A115-T118 WeakPolarHBondContact O-CB 3.36Å; A115-T118 PolarHBondContact O-N 3.07Å; A115-V119 WeakPolarHBondContact O-CG2 3.32Å; A115-V119 PolarHBondContact O-N 2.96Å |
| 116 | I | 90.6 | Very high | 86.2 | Confident | 10 Ų | 10 | 55.8 Ų | 55.8 | 5% | 0.051 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -63 | -45 | 176.6 | -71.3 | 172.6 | 0 | 0 | 0 | 111.4 | A112 T113 T118 V119 E120 F253 V256 | A112-I116 WeakPolarHBondContact O-CG1 3.49Å; A112-I116 PolarHBondContact O-N 2.63Å; T113-I116 PolarHBondContact O-N 3.32Å; I116-T118 PolarHBondContact O-N 3.45Å; I116-V119 CarbonylContact O-C 3.59Å; I116-V119 PolarHBondContact O-N 3.43Å; I116-V119 VanDerWaalsContact O-N 3.12Å; I116-E120 WeakPolarHBondContact O-CB 3.36Å; I116-E120 PolarHBondContact O-N 3.37Å; I116-F253 HydrophobicContact CB-CD1 4.5Å; I116-F253 HydrophobicContact CD1-CD1 4.18Å; I116-F253 HydrophobicContact CG1-CD1 4.19Å; I116-F253 HydrophobicContact CG1-CE1 4.27Å; I116-F253 HydrophobicContact CG2-CB 3.99Å; I116-F253 HydrophobicContact CG2-CD1 3.57Å; I116-F253 HydrophobicContact CG2-CD2 3.86Å; I116-F253 HydrophobicContact CG2-CE1 3.9Å; I116-F253 HydrophobicContact CG2-CE2 4.17Å; I116-F253 HydrophobicContact CG2-CG 3.55Å; I116-F253 HydrophobicContact CG2-CZ 4.19Å; I116-V256 HydrophobicContact CD1-CB 3.36Å; I116-V256 HydrophobicContact CD1-CG1 3.41Å; I116-V256 VanDerWaalsContact CD1-CG1 3.41Å; I116-V256 HydrophobicContact CD1-CG2 3.59Å |
| 117 | A | 90.7 | Very high | 87.9 | Confident | 0 Ų | 0 | 55 Ų | 55 | 0% | 0 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -58.2 | -39.2 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | T113 F114 E120 V121 V164 L167 F168 | T113-A117 WeakPolarHBondContact O-CB 3.41Å; T113-A117 PolarHBondContact O-N 3.06Å; F114-A117 PolarHBondContact O-N 2.97Å; A117-E120 PolarHBondContact O-N 3.09Å; A117-V121 WeakPolarHBondContact O-CG2 3.37Å; A117-V121 PolarHBondContact O-N 3.44Å; A117-V164 HydrophobicContact CB-CG1 4.03Å; A117-L167 HydrophobicContact CB-CD2 3.47Å; A117-L167 VanDerWaalsContact CB-CD2 3.47Å; A117-F168 HydrophobicContact CB-CE1 3.79Å; A117-F168 HydrophobicContact CB-CE2 3.99Å; A117-F168 HydrophobicContact CB-CZ 3.5Å; A117-F168 VanDerWaalsContact CB-CZ 3.5Å |
| 118 | T | 92.6 | Very high | 89.1 | Confident | 69 Ų | 69 | 52.3 Ų | 52.3 | 42% | 0.423 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -65.6 | -44.3 | 176 | -54 | 0 | 0 | 0 | 0 | 111.6 | F114 A115 I116 E120 V121 A122 | F114-T118 PolarHBondContact O-N 3.23Å; F114-T118 PolarHBondContact O-OG1 2.99Å; A115-T118 WeakPolarHBondContact O-CB 3.36Å; A115-T118 PolarHBondContact O-N 3.07Å; I116-T118 PolarHBondContact O-N 3.45Å; T118-E120 VanDerWaalsContact C-N 3.31Å; T118-E120 PolarHBondContact O-N 3.2Å; T118-V121 PolarHBondContact O-N 3.35Å; T118-A122 PolarHBondContact O-N 2.93Å; T118-A122 VanDerWaalsContact O-N 3.07Å |
| 119 | V | 93.7 | Very high | 89.6 | Confident | 74 Ų | 74 | 53.3 Ų | 53.3 | 45% | 0.448 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -62.5 | -41 | 174.8 | 173.2 | 0 | 0 | 0 | 0 | 110.7 | A115 I116 A122 L123 F253 | A115-V119 WeakPolarHBondContact O-CG2 3.32Å; A115-V119 PolarHBondContact O-N 2.96Å; I116-V119 CarbonylContact O-C 3.59Å; I116-V119 PolarHBondContact O-N 3.43Å; I116-V119 VanDerWaalsContact O-N 3.12Å; V119-A122 WeakPolarHBondContact O-CB 3.12Å; V119-A122 PolarHBondContact O-N 3.18Å; V119-L123 HydrophobicContact CG1-CD1 4.09Å; V119-L123 HydrophobicContact CG1-CG 4.35Å; V119-L123 WeakPolarHBondContact O-CG 3.14Å; V119-L123 PolarHBondContact O-N 3.42Å; V119-F253 HydrophobicContact CG1-CZ 3.98Å |
| 120 | E | 92 | Very high | 89.8 | Confident | 22 Ų | 22 | 57.4 Ų | 57.4 | 10% | 0.103 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -64.8 | -42.5 | 178.6 | -171.8 | 175.3 | -175.7 | 0 | 0 | 111.9 | I116 A117 T118 A122 L123 I124 V164 H182 F253 | I116-E120 WeakPolarHBondContact O-CB 3.36Å; I116-E120 PolarHBondContact O-N 3.37Å; A117-E120 PolarHBondContact O-N 3.09Å; T118-E120 VanDerWaalsContact C-N 3.31Å; T118-E120 PolarHBondContact O-N 3.2Å; E120-A122 VanDerWaalsContact C-N 3.31Å; E120-A122 PolarHBondContact O-N 2.91Å; E120-L123 PolarHBondContact O-N 3.24Å; E120-I124 HydrophobicContact CG-CD1 3.87Å; E120-I124 HydrophobicContact CG-CG1 4.46Å; E120-I124 WeakPolarHBondContact O-CB 3.38Å; E120-I124 VanDerWaalsContact O-CG1 3.26Å; E120-I124 WeakPolarHBondContact O-CG1 3.46Å; E120-I124 PolarHBondContact O-N 3.48Å; E120-V164 HydrophobicContact CG-CG2 4Å; E120-H182 VanDerWaalsContact CD-NE2 3.25Å; E120-H182 IonicContact OE1-CD2 3.02Å; E120-H182 IonicContact OE1-CE1 3.97Å; E120-H182 IonicContact OE1-NE2 3Å; E120-H182 PolarHBondContact OE1-NE2 3.19Å; E120-H182 IonicContact OE2-CD2 2.74Å; E120-H182 IonicContact OE2-CE1 3.85Å; E120-H182 PolarHBondContact OE2-CE1 3.29Å; E120-H182 VanDerWaalsContact OE2-CE1 3.28Å; E120-H182 IonicContact OE2-NE2 2.7Å; E120-H182 PolarHBondContact OE2-NE2 2.78Å; E120-F253 HydrophobicContact CB-CE2 4.39Å |
| 121 | V | 93.4 | Very high | 89.7 | Confident | 42 Ų | 42 | 59 Ų | 59 | 26% | 0.255 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -57.9 | -45.5 | 171.3 | 172.1 | 0 | 0 | 0 | 0 | 110.7 | A117 T118 L123 I124 L125 L161 V164 F168 | A117-V121 WeakPolarHBondContact O-CG2 3.37Å; A117-V121 PolarHBondContact O-N 3.44Å; T118-V121 PolarHBondContact O-N 3.35Å; V121-L123 VanDerWaalsContact C-N 3.33Å; V121-L123 PolarHBondContact O-N 2.96Å; V121-I124 PolarHBondContact O-N 3.46Å; V121-L125 HydrophobicContact CG1-CD1 3.72Å; V121-L125 HydrophobicContact CG1-CG 4.2Å; V121-L125 WeakPolarHBondContact O-CB 3.3Å; V121-L125 VanDerWaalsContact O-CG 3.28Å; V121-L125 WeakPolarHBondContact O-CG 3.43Å; V121-L125 PolarHBondContact O-N 3.49Å; V121-L161 HydrophobicContact CG1-CD2 4.4Å; V121-L161 HydrophobicContact CG2-CD2 4.46Å; V121-V164 HydrophobicContact CG2-CB 4.41Å; V121-V164 HydrophobicContact CG2-CG1 3.73Å; V121-F168 HydrophobicContact CG2-CE2 4.36Å |
| 122 | A | 94 | Very high | 89.4 | Confident | 63 Ų | 63 | 52 Ų | 52 | 52% | 0.521 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -62.4 | -39.9 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | T118 V119 E120 G126 | T118-A122 PolarHBondContact O-N 2.93Å; T118-A122 VanDerWaalsContact O-N 3.07Å; V119-A122 WeakPolarHBondContact O-CB 3.12Å; V119-A122 PolarHBondContact O-N 3.18Å; E120-A122 VanDerWaalsContact C-N 3.31Å; E120-A122 PolarHBondContact O-N 2.91Å; A122-G126 PolarHBondContact O-N 3.21Å |
| 123 | L | 92.3 | Very high | 88.9 | Confident | 100 Ų | 100 | 56.4 Ų | 56.4 | 52% | 0.524 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -67 | -44 | 176 | -71.2 | 174.2 | 0 | 0 | 0 | 112.1 | V119 E120 V121 G126 W127 F253 | V119-L123 HydrophobicContact CG1-CD1 4.09Å; V119-L123 HydrophobicContact CG1-CG 4.35Å; V119-L123 WeakPolarHBondContact O-CG 3.14Å; V119-L123 PolarHBondContact O-N 3.42Å; E120-L123 PolarHBondContact O-N 3.24Å; V121-L123 VanDerWaalsContact C-N 3.33Å; V121-L123 PolarHBondContact O-N 2.96Å; L123-G126 PolarHBondContact O-N 2.99Å; L123-W127 VanDerWaalsContact O-CB 3.24Å; L123-W127 WeakPolarHBondContact O-CB 3.43Å; L123-W127 PolarHBondContact O-N 3.31Å; L123-F253 HydrophobicContact CD1-CE2 4.25Å; L123-F253 HydrophobicContact CD1-CZ 4.37Å |
| 124 | I | 92 | Very high | 88.2 | Confident | 16 Ų | 16 | 60.9 Ų | 60.9 | 8% | 0.082 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -64.4 | -45.5 | 178.5 | -68.7 | 163.9 | 0 | 0 | 0 | 110.5 | E120 V121 W127 F128 T157 L160 L161 V164 | E120-I124 HydrophobicContact CG-CD1 3.87Å; E120-I124 HydrophobicContact CG-CG1 4.46Å; E120-I124 WeakPolarHBondContact O-CB 3.38Å; E120-I124 VanDerWaalsContact O-CG1 3.26Å; E120-I124 WeakPolarHBondContact O-CG1 3.46Å; E120-I124 PolarHBondContact O-N 3.48Å; V121-I124 PolarHBondContact O-N 3.46Å; I124-W127 PolarHBondContact O-N 3.23Å; I124-F128 WeakPolarHBondContact O-CB 3.47Å; I124-F128 PolarHBondContact O-N 2.88Å; I124-T157 HydrophobicContact CG2-CG2 3.77Å; I124-L160 HydrophobicContact CD1-CB 3.92Å; I124-L160 HydrophobicContact CG1-CB 4.4Å; I124-L160 HydrophobicContact CG2-CB 4.4Å; I124-L161 HydrophobicContact CB-CD2 4.4Å; I124-L161 HydrophobicContact CD1-CD2 4.49Å; I124-L161 HydrophobicContact CG2-CD2 3.95Å; I124-L161 HydrophobicContact CG2-CG 3.98Å; I124-V164 HydrophobicContact CD1-CG2 3.86Å |
| 125 | L | 91.7 | Very high | 87.2 | Confident | 79 Ų | 79 | 57.6 Ų | 57.6 | 41% | 0.414 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -66.7 | -43.1 | 177.3 | -69.6 | 177 | 0 | 0 | 0 | 111.5 | V121 W127 F128 V129 L161 | V121-L125 HydrophobicContact CG1-CD1 3.72Å; V121-L125 HydrophobicContact CG1-CG 4.2Å; V121-L125 WeakPolarHBondContact O-CB 3.3Å; V121-L125 VanDerWaalsContact O-CG 3.28Å; V121-L125 WeakPolarHBondContact O-CG 3.43Å; V121-L125 PolarHBondContact O-N 3.49Å; L125-W127 VanDerWaalsContact C-N 3.35Å; L125-W127 PolarHBondContact O-N 3.02Å; L125-F128 PolarHBondContact O-N 2.76Å; L125-V129 WeakPolarHBondContact O-CB 3.11Å; L125-V129 VanDerWaalsContact O-CG2 3.29Å; L125-V129 WeakPolarHBondContact O-CG2 3.39Å; L125-V129 PolarHBondContact O-N 2.87Å; L125-L161 HydrophobicContact CD2-CD1 4.39Å |
| 126 | G | 90.9 | Very high | 86.2 | Confident | 41 Ų | 41 | 59 Ų | 59 | 42% | 0.423 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -59.6 | -45 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112 | A122 L123 V129 L130 | A122-G126 PolarHBondContact O-N 3.21Å; L123-G126 PolarHBondContact O-N 2.99Å; G126-V129 PolarHBondContact O-N 3.18Å; G126-L130 VanDerWaalsContact O-CB 3.25Å; G126-L130 WeakPolarHBondContact O-CB 3.35Å; G126-L130 PolarHBondContact O-N 3Å |
| 127 | W | 89.2 | Confident | 85.1 | Confident | 96 Ų | 96 | 65.6 Ų | 65.6 | 36% | 0.364 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -62 | -45.6 | 174.6 | 178.3 | 82.4 | 0 | 0 | 0 | 112 | L123 I124 L125 L130 H131 R153 | L123-W127 VanDerWaalsContact O-CB 3.24Å; L123-W127 WeakPolarHBondContact O-CB 3.43Å; L123-W127 PolarHBondContact O-N 3.31Å; I124-W127 PolarHBondContact O-N 3.23Å; L125-W127 VanDerWaalsContact C-N 3.35Å; L125-W127 PolarHBondContact O-N 3.02Å; W127-L130 PolarHBondContact O-N 2.74Å; W127-H131 AromaticContact CD1-CD2 3.35Å; W127-H131 AromaticContact CD1-NE2 3.65Å; W127-H131 AromaticContact CE2-CD2 3.61Å; W127-H131 AromaticContact CG-CD2 3.98Å; W127-H131 AromaticContact NE1-CD2 3.07Å; W127-H131 PolarHBondContact NE1-CD2 3.28Å; W127-H131 AromaticContact NE1-CG 3.96Å; W127-H131 AromaticContact NE1-NE2 3.2Å; W127-H131 PolarHBondContact NE1-NE2 3.32Å; W127-H131 WeakPolarHBondContact O-CB 3.32Å; W127-H131 PolarHBondContact O-CD2 2.92Å; W127-H131 PolarHBondContact O-N 2.65Å; W127-R153 HydrophobicContact CH2-CG 4.48Å |
| 128 | F | 89 | Confident | 84 | Confident | 52 Ų | 52 | 70.7 Ų | 70.7 | 23% | 0.228 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -63.1 | -44 | 178.2 | 177.1 | -107.5 | 0 | 0 | 0 | 112 | I124 L125 S132 A154 T157 | I124-F128 WeakPolarHBondContact O-CB 3.47Å; I124-F128 PolarHBondContact O-N 2.88Å; L125-F128 PolarHBondContact O-N 2.76Å; F128-S132 WeakPolarHBondContact CD2-OG 3.11Å; F128-S132 WeakPolarHBondContact CE2-OG 3.32Å; F128-S132 WeakPolarHBondContact O-CB 3.31Å; F128-S132 PolarHBondContact O-N 3.38Å; F128-S132 PolarHBondContact O-OG 3.02Å; F128-A154 HydrophobicContact CE2-CB 3.96Å; F128-A154 HydrophobicContact CZ-CB 4.35Å; F128-T157 HydrophobicContact CB-CG2 3.88Å; F128-T157 HydrophobicContact CD2-CG2 4.11Å; F128-T157 WeakPolarHBondContact CD2-OG1 3.35Å; F128-T157 HydrophobicContact CG-CG2 3.95Å |
| 129 | V | 87.3 | Confident | 82.5 | Confident | 75 Ų | 75 | 70.2 Ų | 70.2 | 46% | 0.455 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -65.1 | -47.3 | 177.7 | 170.7 | 0 | 0 | 0 | 0 | 110.2 | L125 G126 S132 F133 | L125-V129 WeakPolarHBondContact O-CB 3.11Å; L125-V129 VanDerWaalsContact O-CG2 3.29Å; L125-V129 WeakPolarHBondContact O-CG2 3.39Å; L125-V129 PolarHBondContact O-N 2.87Å; G126-V129 PolarHBondContact O-N 3.18Å; V129-S132 PolarHBondContact O-N 3.47Å; V129-F133 HydrophobicContact CB-CD2 4.25Å; V129-F133 HydrophobicContact CG1-CD2 3.81Å; V129-F133 HydrophobicContact CG1-CE2 4.41Å; V129-F133 HydrophobicContact CG2-CD2 4.5Å; V129-F133 HydrophobicContact CG2-CE2 4.44Å; V129-F133 VanDerWaalsContact O-CB 3.32Å; V129-F133 WeakPolarHBondContact O-CB 3.39Å; V129-F133 WeakPolarHBondContact O-CD2 3.27Å; V129-F133 PolarHBondContact O-N 2.8Å |
| 130 | L | 84.6 | Confident | 81 | Confident | 101 Ų | 101 | 77 Ų | 77 | 53% | 0.529 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -59.2 | -52.8 | 177.8 | -173.1 | 66.3 | 0 | 0 | 0 | 110.3 | G126 W127 S132 Y134 | G126-L130 VanDerWaalsContact O-CB 3.25Å; G126-L130 WeakPolarHBondContact O-CB 3.35Å; G126-L130 PolarHBondContact O-N 3Å; W127-L130 PolarHBondContact O-N 2.74Å; L130-S132 PolarHBondContact O-N 3.46Å; L130-Y134 HydrophobicContact CD1-CD2 4.22Å; L130-Y134 WeakPolarHBondContact O-CA 3.35Å; L130-Y134 WeakPolarHBondContact O-CB 3.45Å; L130-Y134 PolarHBondContact O-N 3.45Å |
| 131 | H | 79.4 | Confident | 79.3 | Confident | 76 Ų | 76 | 82.4 Ų | 82.4 | 35% | 0.352 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -73.8 | -25.2 | -177.4 | -82.1 | -88.9 | 0 | 0 | 0 | 114.6 | W127 P135 R153 | W127-H131 AromaticContact CD1-CD2 3.35Å; W127-H131 AromaticContact CD1-NE2 3.65Å; W127-H131 AromaticContact CE2-CD2 3.61Å; W127-H131 AromaticContact CG-CD2 3.98Å; W127-H131 AromaticContact NE1-CD2 3.07Å; W127-H131 PolarHBondContact NE1-CD2 3.28Å; W127-H131 AromaticContact NE1-CG 3.96Å; W127-H131 AromaticContact NE1-NE2 3.2Å; W127-H131 PolarHBondContact NE1-NE2 3.32Å; W127-H131 WeakPolarHBondContact O-CB 3.32Å; W127-H131 PolarHBondContact O-CD2 2.92Å; W127-H131 PolarHBondContact O-N 2.65Å; H131-P135 VanDerWaalsContact O-CD 3.23Å; H131-P135 WeakPolarHBondContact O-CD 3.3Å; H131-P135 WeakPolarHBondContact O-CG 3.27Å; H131-R153 PolarHBondContact O-NH1 3.33Å |
| 132 | S | 79.3 | Confident | 77.4 | Confident | 10 Ų | 10 | 85.5 Ų | 85.5 | 7% | 0.07 | 45% | 0.445 | C | S | . | . | H | α-helix | trans | -86.2 | -39.4 | 179.3 | -54.9 | 0 | 0 | 0 | 0 | 112.2 | F128 V129 L130 V136 | F128-S132 WeakPolarHBondContact CD2-OG 3.11Å; F128-S132 WeakPolarHBondContact CE2-OG 3.32Å; F128-S132 WeakPolarHBondContact O-CB 3.31Å; F128-S132 PolarHBondContact O-N 3.38Å; F128-S132 PolarHBondContact O-OG 3.02Å; V129-S132 PolarHBondContact O-N 3.47Å; L130-S132 PolarHBondContact O-N 3.46Å; S132-V136 WeakPolarHBondContact O-CG2 3.36Å |
| 133 | F | 76 | Confident | 75.6 | Confident | 113 Ų | 113 | 86.7 Ų | 86.7 | 50% | 0.496 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -95.2 | -28.2 | -176.7 | -67.4 | -84.5 | 0 | 0 | 0 | 113.7 | V129 V136 M137 | V129-F133 HydrophobicContact CB-CD2 4.25Å; V129-F133 HydrophobicContact CG1-CD2 3.81Å; V129-F133 HydrophobicContact CG1-CE2 4.41Å; V129-F133 HydrophobicContact CG2-CD2 4.5Å; V129-F133 HydrophobicContact CG2-CE2 4.44Å; V129-F133 VanDerWaalsContact O-CB 3.32Å; V129-F133 WeakPolarHBondContact O-CB 3.39Å; V129-F133 WeakPolarHBondContact O-CD2 3.27Å; V129-F133 PolarHBondContact O-N 2.8Å; F133-V136 PolarHBondContact O-N 3.3Å; F133-V136 VanDerWaalsContact O-N 3.13Å; F133-M137 WeakPolarHBondContact O-CB 3.37Å; F133-M137 WeakPolarHBondContact O-CG 3.24Å; F133-M137 PolarHBondContact O-N 2.94Å |
| 134 | Y | 73.3 | Confident | 73.8 | Confident | 96 Ų | 96 | 91.2 Ų | 91.2 | 38% | 0.376 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -54.8 | -47 | 177.3 | -169.9 | -96.6 | 0 | 0 | 0 | 113.7 | L130 V136 M137 I138 W226 | L130-Y134 HydrophobicContact CD1-CD2 4.22Å; L130-Y134 WeakPolarHBondContact O-CA 3.35Å; L130-Y134 WeakPolarHBondContact O-CB 3.45Å; L130-Y134 PolarHBondContact O-N 3.45Å; Y134-V136 PolarHBondContact O-N 3.41Å; Y134-M137 PolarHBondContact O-N 3.45Å; Y134-I138 HydrophobicContact CD1-CG1 4.32Å; Y134-I138 HydrophobicContact CD2-CG1 4.05Å; Y134-I138 HydrophobicContact CE1-CG1 4.09Å; Y134-I138 HydrophobicContact CE2-CD1 4.43Å; Y134-I138 HydrophobicContact CE2-CG1 3.8Å; Y134-I138 HydrophobicContact CG-CG1 4.3Å; Y134-I138 WeakPolarHBondContact O-CB 3.4Å; Y134-I138 WeakPolarHBondContact O-CG1 3.3Å; Y134-I138 PolarHBondContact O-N 2.93Å; Y134-W226 AromaticContact CZ-NE1 3.71Å; Y134-W226 PolarHBondContact OH-NE1 3.34Å |
| 135 | P | 69.6 | Low | 72 | Confident | 23 Ų | 23 | 98.2 Ų | 98.2 | 15% | 0.149 | 51% | 0.507 | C | S | . | . | H | α-helix | trans | -63.5 | -42.1 | 174.9 | 24.4 | -33 | 0 | 0 | 0 | 111.6 | H131 M137 I138 T139 | H131-P135 VanDerWaalsContact O-CD 3.23Å; H131-P135 WeakPolarHBondContact O-CD 3.3Å; H131-P135 WeakPolarHBondContact O-CG 3.27Å; P135-M137 VanDerWaalsContact C-N 3.26Å; P135-M137 PolarHBondContact O-N 3.23Å; P135-I138 PolarHBondContact O-N 3.47Å; P135-T139 CarbonylContact O-C 3.52Å; P135-T139 WeakPolarHBondContact O-CA 3.2Å; P135-T139 PolarHBondContact O-N 2.98Å; P135-T139 PolarHBondContact O-OG1 3.24Å |
| 136 | V | 69.4 | Low | 70.7 | Confident | 80 Ų | 80 | 96.7 Ų | 96.7 | 49% | 0.485 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -61.9 | -35 | 178.8 | 179.6 | 0 | 0 | 0 | 0 | 112.2 | S132 F133 Y134 | S132-V136 WeakPolarHBondContact O-CG2 3.36Å; F133-V136 PolarHBondContact O-N 3.3Å; F133-V136 VanDerWaalsContact O-N 3.13Å; Y134-V136 PolarHBondContact O-N 3.41Å |
| 137 | M | 67.2 | Low | 69.7 | Low | 149 Ų | 149 | 97.7 Ų | 97.7 | 73% | 0.734 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -83.5 | -37.9 | -176.8 | -69.2 | -66.2 | -71.9 | 0 | 0 | 113.2 | F133 Y134 P135 | F133-M137 WeakPolarHBondContact O-CB 3.37Å; F133-M137 WeakPolarHBondContact O-CG 3.24Å; F133-M137 PolarHBondContact O-N 2.94Å; Y134-M137 PolarHBondContact O-N 3.45Å; P135-M137 VanDerWaalsContact C-N 3.26Å; P135-M137 PolarHBondContact O-N 3.23Å |
| 138 | I | 66.2 | Low | 69.2 | Low | 107 Ų | 107 | 95.3 Ų | 95.3 | 55% | 0.549 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -94.5 | -42.4 | -173.8 | -60.9 | -61.9 | 0 | 0 | 0 | 111.5 | Y134 P135 | Y134-I138 HydrophobicContact CD1-CG1 4.32Å; Y134-I138 HydrophobicContact CD2-CG1 4.05Å; Y134-I138 HydrophobicContact CE1-CG1 4.09Å; Y134-I138 HydrophobicContact CE2-CD1 4.43Å; Y134-I138 HydrophobicContact CE2-CG1 3.8Å; Y134-I138 HydrophobicContact CG-CG1 4.3Å; Y134-I138 WeakPolarHBondContact O-CB 3.4Å; Y134-I138 WeakPolarHBondContact O-CG1 3.3Å; Y134-I138 PolarHBondContact O-N 2.93Å; P135-I138 PolarHBondContact O-N 3.47Å |
| 139 | T | 62.4 | Low | 68.6 | Low | 60 Ų | 60 | 94.9 Ų | 94.9 | 37% | 0.368 | 51% | 0.514 | S | S | . | . | trans | -102.6 | 105.7 | -177.4 | 55.6 | 0 | 0 | 0 | 0 | 108.6 | P135 Q141 | P135-T139 CarbonylContact O-C 3.52Å; P135-T139 WeakPolarHBondContact O-CA 3.2Å; P135-T139 PolarHBondContact O-N 2.98Å; P135-T139 PolarHBondContact O-OG1 3.24Å; T139-Q141 PolarHBondContact O-N 2.86Å | ||
| 140 | K | 61.9 | Low | 68.3 | Low | 215 Ų | 215 | 94 Ų | 94 | 94% | 0.935 | 51% | 0.506 | S | S | * | . | trans | -65.8 | 24.9 | 172.6 | -69.9 | -174.8 | 174.8 | 179.1 | 0 | 113.1 | ||||
| 141 | Q | 56.2 | Low | 68.3 | Low | 137 Ų | 137 | 92.3 Ų | 92.3 | 64% | 0.64 | 50% | 0.502 | S | S | * | . | trans | -111.5 | 92.2 | -156.8 | -149 | 167.5 | -27.9 | 0 | 0 | 112.2 | T139 | T139-Q141 PolarHBondContact O-N 2.86Š| ||
| 142 | T | 54 | Low | 68.6 | Low | 106 Ų | 106 | 91.3 Ų | 91.3 | 65% | 0.65 | 51% | 0.507 | S | S | * | . | trans | 65.2 | 70.1 | 141 | 59 | 0 | 0 | 0 | 0 | 119.6 | K144 | T142-K144 VanDerWaalsContact C-N 3.25Å; T142-K144 PolarHBondContact O-N 3.31Å | ||
| 143 | A | 55.6 | Low | 68.9 | Low | 89 Ų | 89 | 94.7 Ų | 94.7 | 74% | 0.736 | 52% | 0.518 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 26.4 | -21.4 | 133.4 | 0 | 0 | 0 | 0 | 0 | 124.7 | ||
| 144 | K | 55.5 | Low | 69.5 | Low | 194 Ų | 194 | 90.6 Ų | 90.6 | 84% | 0.843 | 51% | 0.505 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -114.6 | -36.3 | -170.9 | -73.6 | -171.9 | 178.8 | 179.5 | 0 | 115.4 | T142 | T142-K144 VanDerWaalsContact C-N 3.25Å; T142-K144 PolarHBondContact O-N 3.31Å |
| 145 | L | 53.1 | Low | 70.4 | Confident | 163 Ų | 163 | 90 Ų | 90 | 85% | 0.853 | 51% | 0.511 | S | S | * | . | S | Bend | trans | -80.9 | -24.4 | 173.8 | -110 | 96.9 | 0 | 0 | 0 | 112.5 | A147 | L145-A147 PolarHBondContact O-N 2.86Š|
| 146 | E | 65 | Low | 71.4 | Confident | 47 Ų | 47 | 92.1 Ų | 92.1 | 22% | 0.22 | 52% | 0.524 | C | S | . | . | H | α-helix | trans | -73 | -27.8 | -175.3 | -60 | -161 | 137 | 0 | 0 | 113.4 | G148 A149 I150 | E146-G148 VanDerWaalsContact C-N 3.28Å; E146-G148 PolarHBondContact O-N 3.47Å; E146-A149 PolarHBondContact O-N 3.5Å; E146-I150 HydrophobicContact CB-CD1 3.95Å; E146-I150 WeakPolarHBondContact O-CB 3.45Å; E146-I150 WeakPolarHBondContact O-CD1 3.32Å; E146-I150 WeakPolarHBondContact O-CG1 3.39Å; E146-I150 PolarHBondContact O-N 3.46Å |
| 147 | A | 70.2 | Confident | 72.4 | Confident | 62 Ų | 62 | 88.6 Ų | 88.6 | 51% | 0.512 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -60.4 | -38.4 | -178.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | L145 S151 | L145-A147 PolarHBondContact O-N 2.86Å; A147-S151 VanDerWaalsContact O-CB 3.29Å; A147-S151 WeakPolarHBondContact O-CB 3.41Å; A147-S151 PolarHBondContact O-N 3.33Å; A147-S151 PolarHBondContact O-OG 2.94Å |
| 148 | G | 78.2 | Confident | 73.6 | Confident | 46 Ų | 46 | 86.9 Ų | 86.9 | 47% | 0.474 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -67.9 | -44.1 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | E146 S151 A152 | E146-G148 VanDerWaalsContact C-N 3.28Å; E146-G148 PolarHBondContact O-N 3.47Å; G148-S151 WeakPolarHBondContact CA-OG 3.4Å; G148-S151 PolarHBondContact O-OG 3.14Å; G148-A152 WeakPolarHBondContact O-CB 3.29Å; G148-A152 PolarHBondContact O-N 3.22Å |
| 149 | A | 77.3 | Confident | 74.9 | Confident | 44 Ų | 44 | 86.8 Ų | 86.8 | 36% | 0.364 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -68.7 | -40 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | E146 A152 R153 | E146-A149 PolarHBondContact O-N 3.5Å; A149-A152 PolarHBondContact O-N 3.27Å; A149-R153 WeakPolarHBondContact O-CB 3.44Å; A149-R153 VanDerWaalsContact O-CG 3.24Å; A149-R153 WeakPolarHBondContact O-CG 3.45Å; A149-R153 PolarHBondContact O-N 2.86Å |
| 150 | I | 80.2 | Confident | 76.4 | Confident | 56 Ų | 56 | 85.2 Ų | 85.2 | 29% | 0.287 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -66 | -45.8 | 176.7 | -66 | 164.1 | 0 | 0 | 0 | 110.1 | E146 A152 R153 A154 | E146-I150 HydrophobicContact CB-CD1 3.95Å; E146-I150 WeakPolarHBondContact O-CB 3.45Å; E146-I150 WeakPolarHBondContact O-CD1 3.32Å; E146-I150 WeakPolarHBondContact O-CG1 3.39Å; E146-I150 PolarHBondContact O-N 3.46Å; I150-A152 PolarHBondContact O-N 2.9Å; I150-R153 PolarHBondContact O-N 2.93Å; I150-A154 WeakPolarHBondContact O-CB 3.41Å; I150-A154 PolarHBondContact O-N 3.1Å |
| 151 | S | 83.9 | Confident | 77.9 | Confident | 65 Ų | 65 | 77.2 Ų | 77.2 | 46% | 0.455 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -62.8 | -41.8 | 177.2 | 55.7 | 0 | 0 | 0 | 0 | 112 | A147 G148 A154 V155 | A147-S151 VanDerWaalsContact O-CB 3.29Å; A147-S151 WeakPolarHBondContact O-CB 3.41Å; A147-S151 PolarHBondContact O-N 3.33Å; A147-S151 PolarHBondContact O-OG 2.94Å; G148-S151 WeakPolarHBondContact CA-OG 3.4Å; G148-S151 PolarHBondContact O-OG 3.14Å; S151-A154 PolarHBondContact O-N 3.31Å; S151-V155 VanDerWaalsContact O-CG2 3.3Å; S151-V155 WeakPolarHBondContact O-CG2 3.4Å; S151-V155 PolarHBondContact O-N 3.34Å |
| 152 | A | 86 | Confident | 79.6 | Confident | 55 Ų | 55 | 73.1 Ų | 73.1 | 46% | 0.455 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -61.1 | -45.5 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | G148 A149 I150 A154 V155 V156 | G148-A152 WeakPolarHBondContact O-CB 3.29Å; G148-A152 PolarHBondContact O-N 3.22Å; A149-A152 PolarHBondContact O-N 3.27Å; I150-A152 PolarHBondContact O-N 2.9Å; A152-A154 VanDerWaalsContact C-N 3.35Å; A152-A154 PolarHBondContact O-N 3.38Å; A152-V155 PolarHBondContact O-N 2.91Å; A152-V156 WeakPolarHBondContact O-CG2 3.47Å; A152-V156 PolarHBondContact O-N 3.31Å |
| 153 | R | 86.2 | Confident | 81.4 | Confident | 81 Ų | 81 | 68.7 Ų | 68.7 | 31% | 0.306 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -61.8 | -42.3 | 175.9 | -71.5 | 169.4 | -172.3 | 172.6 | 7.7 | 111.6 | W127 H131 A149 I150 V155 V156 T157 | W127-R153 HydrophobicContact CH2-CG 4.48Å; H131-R153 PolarHBondContact O-NH1 3.33Å; A149-R153 WeakPolarHBondContact O-CB 3.44Å; A149-R153 VanDerWaalsContact O-CG 3.24Å; A149-R153 WeakPolarHBondContact O-CG 3.45Å; A149-R153 PolarHBondContact O-N 2.86Å; I150-R153 PolarHBondContact O-N 2.93Å; R153-V155 PolarHBondContact O-N 3.29Å; R153-V156 PolarHBondContact O-N 2.85Å; R153-T157 PolarHBondContact O-N 3.19Å; R153-T157 PolarHBondContact O-OG1 3.42Å |
| 154 | A | 87.6 | Confident | 83.2 | Confident | 27 Ų | 27 | 64.5 Ų | 64.5 | 22% | 0.223 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -61.7 | -43.5 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | F128 I150 S151 A152 V156 T157 I158 | F128-A154 HydrophobicContact CE2-CB 3.96Å; F128-A154 HydrophobicContact CZ-CB 4.35Å; I150-A154 WeakPolarHBondContact O-CB 3.41Å; I150-A154 PolarHBondContact O-N 3.1Å; S151-A154 PolarHBondContact O-N 3.31Å; A152-A154 VanDerWaalsContact C-N 3.35Å; A152-A154 PolarHBondContact O-N 3.38Å; A154-V156 PolarHBondContact O-N 3.46Å; A154-T157 PolarHBondContact O-N 3.5Å; A154-I158 VanDerWaalsContact O-CG1 3.24Å; A154-I158 WeakPolarHBondContact O-CG1 3.38Å; A154-I158 PolarHBondContact O-N 3.29Å |
| 155 | V | 92 | Very high | 84.9 | Confident | 83 Ų | 83 | 59.3 Ų | 59.3 | 50% | 0.503 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -60.5 | -45.3 | 175.6 | 171.9 | 0 | 0 | 0 | 0 | 110.9 | S151 A152 R153 T157 I158 L159 | S151-V155 VanDerWaalsContact O-CG2 3.3Å; S151-V155 WeakPolarHBondContact O-CG2 3.4Å; S151-V155 PolarHBondContact O-N 3.34Å; A152-V155 PolarHBondContact O-N 2.91Å; R153-V155 PolarHBondContact O-N 3.29Å; V155-T157 PolarHBondContact O-N 3.49Å; V155-I158 PolarHBondContact O-N 2.89Å; V155-L159 HydrophobicContact CG1-CD1 4.24Å; V155-L159 WeakPolarHBondContact O-CG 3.43Å; V155-L159 PolarHBondContact O-N 3.4Å |
| 156 | V | 91.2 | Very high | 86.8 | Confident | 69 Ų | 69 | 54.7 Ų | 54.7 | 42% | 0.418 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -60.7 | -45.1 | 176.2 | 174 | 0 | 0 | 0 | 0 | 111 | A152 R153 A154 I158 L159 L160 | A152-V156 WeakPolarHBondContact O-CG2 3.47Å; A152-V156 PolarHBondContact O-N 3.31Å; R153-V156 PolarHBondContact O-N 2.85Å; A154-V156 PolarHBondContact O-N 3.46Å; V156-I158 PolarHBondContact O-N 3.46Å; V156-L159 PolarHBondContact O-N 2.95Å; V156-L160 HydrophobicContact CG1-CD1 4.09Å; V156-L160 HydrophobicContact CG1-CG 4.39Å; V156-L160 WeakPolarHBondContact O-CG 3.26Å; V156-L160 PolarHBondContact O-N 3.16Å |
| 157 | T | 90.9 | Very high | 88 | Confident | 6 Ų | 6 | 52.5 Ų | 52.5 | 4% | 0.037 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -59.8 | -44.6 | 176.9 | -58.4 | 0 | 0 | 0 | 0 | 111.9 | I124 F128 R153 A154 V155 L159 L160 L161 | I124-T157 HydrophobicContact CG2-CG2 3.77Å; F128-T157 HydrophobicContact CB-CG2 3.88Å; F128-T157 HydrophobicContact CD2-CG2 4.11Å; F128-T157 WeakPolarHBondContact CD2-OG1 3.35Å; F128-T157 HydrophobicContact CG-CG2 3.95Å; R153-T157 PolarHBondContact O-N 3.19Å; R153-T157 PolarHBondContact O-OG1 3.42Å; A154-T157 PolarHBondContact O-N 3.5Å; V155-T157 PolarHBondContact O-N 3.49Å; T157-L159 VanDerWaalsContact C-N 3.33Å; T157-L159 PolarHBondContact O-N 3.46Å; T157-L160 PolarHBondContact O-N 2.93Å; T157-L161 HydrophobicContact CG2-CD1 3.99Å; T157-L161 HydrophobicContact CG2-CG 4.34Å; T157-L161 WeakPolarHBondContact O-CB 3.37Å; T157-L161 VanDerWaalsContact O-CG 3.3Å; T157-L161 WeakPolarHBondContact O-CG 3.35Å; T157-L161 PolarHBondContact O-N 2.95Å |
| 158 | I | 93 | Very high | 89 | Confident | 113 Ų | 113 | 51.6 Ų | 51.6 | 58% | 0.579 | 31% | 0.311 | S | S | * | . | H | α-helix | trans | -61.6 | -43.1 | 177.5 | -67.9 | 166.1 | 0 | 0 | 0 | 110.4 | A154 V155 V156 L161 S162 | A154-I158 VanDerWaalsContact O-CG1 3.24Å; A154-I158 WeakPolarHBondContact O-CG1 3.38Å; A154-I158 PolarHBondContact O-N 3.29Å; V155-I158 PolarHBondContact O-N 2.89Å; V156-I158 PolarHBondContact O-N 3.46Å; I158-L161 PolarHBondContact O-N 3.43Å; I158-S162 WeakPolarHBondContact O-CB 3.35Å; I158-S162 PolarHBondContact O-N 3.27Å |
| 159 | L | 93.3 | Very high | 89.6 | Confident | 105 Ų | 105 | 52.1 Ų | 52.1 | 55% | 0.55 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -61.9 | -47 | 176.8 | -71.3 | 173.9 | 0 | 0 | 0 | 111.4 | V155 V156 T157 S162 T163 | V155-L159 HydrophobicContact CG1-CD1 4.24Å; V155-L159 WeakPolarHBondContact O-CG 3.43Å; V155-L159 PolarHBondContact O-N 3.4Å; V156-L159 PolarHBondContact O-N 2.95Å; T157-L159 VanDerWaalsContact C-N 3.33Å; T157-L159 PolarHBondContact O-N 3.46Å; L159-S162 WeakPolarHBondContact O-CB 3.28Å; L159-S162 PolarHBondContact O-N 3.21Å; L159-S162 PolarHBondContact O-OG 2.62Å; L159-T163 PolarHBondContact O-N 3.02Å |
| 160 | L | 92.1 | Very high | 90.1 | Very high | 26 Ų | 26 | 50 Ų | 50 | 14% | 0.136 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -62.4 | -47.2 | 177.4 | -66.6 | 177 | 0 | 0 | 0 | 111.6 | I124 V156 T157 S162 T163 V164 V185 F189 | I124-L160 HydrophobicContact CD1-CB 3.92Å; I124-L160 HydrophobicContact CG1-CB 4.4Å; I124-L160 HydrophobicContact CG2-CB 4.4Å; V156-L160 HydrophobicContact CG1-CD1 4.09Å; V156-L160 HydrophobicContact CG1-CG 4.39Å; V156-L160 WeakPolarHBondContact O-CG 3.26Å; V156-L160 PolarHBondContact O-N 3.16Å; T157-L160 PolarHBondContact O-N 2.93Å; L160-S162 VanDerWaalsContact C-N 3.27Å; L160-S162 PolarHBondContact O-N 3.45Å; L160-T163 PolarHBondContact O-N 3.35Å; L160-T163 PolarHBondContact O-OG1 3.04Å; L160-V164 PolarHBondContact O-N 2.85Å; L160-V185 HydrophobicContact CD2-CG1 3.87Å; L160-F189 HydrophobicContact CD1-CZ 4.18Å; L160-F189 HydrophobicContact CD2-CE2 3.7Å; L160-F189 HydrophobicContact CD2-CZ 4.04Å |
| 161 | L | 93.7 | Very high | 90.5 | Very high | 47 Ų | 47 | 48.3 Ų | 48.3 | 25% | 0.246 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -59.1 | -39 | 175.7 | -72.5 | 175.2 | 0 | 0 | 0 | 111.9 | V121 I124 L125 T157 I158 T163 V164 V165 | V121-L161 HydrophobicContact CG1-CD2 4.4Å; V121-L161 HydrophobicContact CG2-CD2 4.46Å; I124-L161 HydrophobicContact CB-CD2 4.4Å; I124-L161 HydrophobicContact CD1-CD2 4.49Å; I124-L161 HydrophobicContact CG2-CD2 3.95Å; I124-L161 HydrophobicContact CG2-CG 3.98Å; L125-L161 HydrophobicContact CD2-CD1 4.39Å; T157-L161 HydrophobicContact CG2-CD1 3.99Å; T157-L161 HydrophobicContact CG2-CG 4.34Å; T157-L161 WeakPolarHBondContact O-CB 3.37Å; T157-L161 VanDerWaalsContact O-CG 3.3Å; T157-L161 WeakPolarHBondContact O-CG 3.35Å; T157-L161 PolarHBondContact O-N 2.95Å; I158-L161 PolarHBondContact O-N 3.43Å; L161-T163 VanDerWaalsContact C-N 3.25Å; L161-T163 PolarHBondContact O-N 2.91Å; L161-V164 PolarHBondContact O-N 3.23Å; L161-V164 VanDerWaalsContact O-N 3.14Å; L161-V165 WeakPolarHBondContact O-CG2 3.16Å; L161-V165 PolarHBondContact O-N 3.42Å |
| 162 | S | 93.3 | Very high | 90.7 | Very high | 51 Ų | 51 | 52.6 Ų | 52.6 | 36% | 0.357 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -60.1 | -36.5 | 176.9 | 80.2 | 0 | 0 | 0 | 0 | 112.2 | I158 L159 L160 V165 L166 | I158-S162 WeakPolarHBondContact O-CB 3.35Å; I158-S162 PolarHBondContact O-N 3.27Å; L159-S162 WeakPolarHBondContact O-CB 3.28Å; L159-S162 PolarHBondContact O-N 3.21Å; L159-S162 PolarHBondContact O-OG 2.62Å; L160-S162 VanDerWaalsContact C-N 3.27Å; L160-S162 PolarHBondContact O-N 3.45Å; S162-V165 PolarHBondContact O-N 2.92Å; S162-L166 WeakPolarHBondContact O-CG 3.37Å; S162-L166 PolarHBondContact O-N 3.41Å |
| 163 | T | 91.8 | Very high | 90.8 | Very high | 14 Ų | 14 | 55.6 Ų | 55.6 | 9% | 0.086 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -69.6 | -35.5 | 176.2 | 65.6 | 0 | 0 | 0 | 0 | 112.7 | L159 L160 L161 L166 L167 V185 | L159-T163 PolarHBondContact O-N 3.02Å; L160-T163 PolarHBondContact O-N 3.35Å; L160-T163 PolarHBondContact O-OG1 3.04Å; L161-T163 VanDerWaalsContact C-N 3.25Å; L161-T163 PolarHBondContact O-N 2.91Å; T163-L166 PolarHBondContact O-N 3.28Å; T163-L167 PolarHBondContact O-N 3.48Å; T163-V185 HydrophobicContact CG2-CG2 4.1Å |
| 164 | V | 92 | Very high | 90.7 | Very high | 1 Ų | 1 | 58.1 Ų | 58.1 | 1% | 0.006 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -71.4 | -37.4 | 175.2 | -172.9 | 0 | 0 | 0 | 0 | 111.2 | A117 E120 V121 I124 L160 L161 L167 F168 | A117-V164 HydrophobicContact CB-CG1 4.03Å; E120-V164 HydrophobicContact CG-CG2 4Å; V121-V164 HydrophobicContact CG2-CB 4.41Å; V121-V164 HydrophobicContact CG2-CG1 3.73Å; I124-V164 HydrophobicContact CD1-CG2 3.86Å; L160-V164 PolarHBondContact O-N 2.85Å; L161-V164 PolarHBondContact O-N 3.23Å; L161-V164 VanDerWaalsContact O-N 3.14Å; V164-L167 WeakPolarHBondContact O-CB 3.43Å; V164-L167 PolarHBondContact O-N 2.77Å; V164-F168 HydrophobicContact CG1-CD2 4.15Å; V164-F168 HydrophobicContact CG1-CE2 3.78Å; V164-F168 VanDerWaalsContact O-CD2 3.27Å; V164-F168 WeakPolarHBondContact O-CD2 3.38Å; V164-F168 PolarHBondContact O-N 3.29Å |
| 165 | V | 92.6 | Very high | 90.6 | Very high | 84 Ų | 84 | 62.7 Ų | 62.7 | 51% | 0.509 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -61.7 | -43.7 | 172.1 | 173 | 0 | 0 | 0 | 0 | 110.9 | L161 S162 L167 F168 V169 | L161-V165 WeakPolarHBondContact O-CG2 3.16Å; L161-V165 PolarHBondContact O-N 3.42Å; S162-V165 PolarHBondContact O-N 2.92Å; V165-L167 VanDerWaalsContact C-N 3.25Å; V165-L167 PolarHBondContact O-N 3.49Å; V165-F168 PolarHBondContact O-N 3.23Å; V165-F168 VanDerWaalsContact O-N 3.13Å; V165-V169 HydrophobicContact CG1-CG2 4.31Å; V165-V169 WeakPolarHBondContact O-CG2 3.18Å; V165-V169 PolarHBondContact O-N 2.98Å |
| 166 | L | 92.1 | Very high | 90.2 | Very high | 67 Ų | 67 | 59.5 Ų | 59.5 | 35% | 0.351 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -58.8 | -38.1 | 174.2 | -77.1 | 168.2 | 0 | 0 | 0 | 112.1 | S162 T163 V169 G170 L178 P181 | S162-L166 WeakPolarHBondContact O-CG 3.37Å; S162-L166 PolarHBondContact O-N 3.41Å; T163-L166 PolarHBondContact O-N 3.28Å; L166-V169 PolarHBondContact O-N 3.36Å; L166-G170 PolarHBondContact O-N 2.82Å; L166-L178 HydrophobicContact CD2-CD2 4.21Å; L166-P181 HydrophobicContact CD1-CG 3.97Å |
| 167 | L | 90.8 | Very high | 90 | Very high | 1 Ų | 1 | 64.1 Ų | 64.1 | 1% | 0.005 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -63.2 | -46.4 | 173.5 | 173.7 | 151.4 | 0 | 0 | 0 | 111.6 | T113 A117 T163 V164 V165 V169 G170 I171 H182 V257 | T113-L167 HydrophobicContact CG2-CD1 3.99Å; T113-L167 HydrophobicContact CG2-CD2 4.15Å; T113-L167 HydrophobicContact CG2-CG 4.3Å; A117-L167 HydrophobicContact CB-CD2 3.47Å; A117-L167 VanDerWaalsContact CB-CD2 3.47Å; T163-L167 PolarHBondContact O-N 3.48Å; V164-L167 WeakPolarHBondContact O-CB 3.43Å; V164-L167 PolarHBondContact O-N 2.77Å; V165-L167 VanDerWaalsContact C-N 3.25Å; V165-L167 PolarHBondContact O-N 3.49Å; L167-V169 PolarHBondContact O-N 3.12Å; L167-G170 PolarHBondContact O-N 2.92Å; L167-I171 HydrophobicContact CD2-CD1 3.59Å; L167-I171 HydrophobicContact CG-CD1 4.19Å; L167-I171 VanDerWaalsContact O-CG1 3.32Å; L167-I171 WeakPolarHBondContact O-CG1 3.29Å; L167-I171 PolarHBondContact O-N 2.97Å; L167-H182 HydrophobicContact CB-CB 4.44Å; L167-H182 WeakPolarHBondContact CD1-CE1 3.37Å; L167-H182 VanDerWaalsContact CD1-ND1 3.27Å; L167-H182 WeakPolarHBondContact CD1-ND1 3.48Å; L167-V257 HydrophobicContact CD1-CG1 4.17Å; L167-V257 HydrophobicContact CD1-CG2 3.91Å |
| 168 | F | 91.6 | Very high | 89.9 | Confident | 43 Ų | 43 | 64.8 Ų | 64.8 | 19% | 0.189 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -59 | -48.6 | 175.3 | -76.7 | -64.1 | 0 | 0 | 0 | 111.5 | F114 A117 V121 V164 V165 G170 I171 F172 | F114-F168 AromaticContact CD2-CD1 3.78Å; F114-F168 HydrophobicContact CD2-CD1 3.78Å; F114-F168 AromaticContact CD2-CE1 3.43Å; F114-F168 HydrophobicContact CD2-CE1 3.43Å; F114-F168 VanDerWaalsContact CD2-CE1 3.43Å; F114-F168 AromaticContact CE2-CD1 3.76Å; F114-F168 HydrophobicContact CE2-CD1 3.76Å; F114-F168 AromaticContact CE2-CE1 3.36Å; F114-F168 HydrophobicContact CE2-CE1 3.36Å; F114-F168 HydrophobicContact CE2-CZ 4.45Å; F114-F168 HydrophobicContact CG-CE1 4.17Å; F114-F168 HydrophobicContact CZ-CE1 4.07Å; A117-F168 HydrophobicContact CB-CE1 3.79Å; A117-F168 HydrophobicContact CB-CE2 3.99Å; A117-F168 HydrophobicContact CB-CZ 3.5Å; A117-F168 VanDerWaalsContact CB-CZ 3.5Å; V121-F168 HydrophobicContact CG2-CE2 4.36Å; V164-F168 HydrophobicContact CG1-CD2 4.15Å; V164-F168 HydrophobicContact CG1-CE2 3.78Å; V164-F168 VanDerWaalsContact O-CD2 3.27Å; V164-F168 WeakPolarHBondContact O-CD2 3.38Å; V164-F168 PolarHBondContact O-N 3.29Å; V165-F168 PolarHBondContact O-N 3.23Å; V165-F168 VanDerWaalsContact O-N 3.13Å; F168-G170 VanDerWaalsContact C-N 3.29Å; F168-G170 PolarHBondContact O-N 2.98Å; F168-I171 PolarHBondContact O-N 2.98Å; F168-F172 WeakPolarHBondContact O-CD2 3.28Å; F168-F172 PolarHBondContact O-N 3.48Å |
| 169 | V | 90.9 | Very high | 89.6 | Confident | 56 Ų | 56 | 59.4 Ų | 59.4 | 34% | 0.339 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -60.9 | -39.5 | 177.9 | 178.5 | 0 | 0 | 0 | 0 | 110.9 | V165 L166 L167 I171 F172 M173 L178 | V165-V169 HydrophobicContact CG1-CG2 4.31Å; V165-V169 WeakPolarHBondContact O-CG2 3.18Å; V165-V169 PolarHBondContact O-N 2.98Å; L166-V169 PolarHBondContact O-N 3.36Å; L167-V169 PolarHBondContact O-N 3.12Å; V169-I171 PolarHBondContact O-N 3.29Å; V169-F172 PolarHBondContact O-N 3.4Å; V169-M173 HydrophobicContact CG1-CG 4.01Å; V169-M173 HydrophobicContact CG1-SD 3.54Å; V169-M173 VanDerWaalsContact CG1-SD 3.54Å; V169-M173 VanDerWaalsContact O-CB 3.31Å; V169-M173 WeakPolarHBondContact O-CB 3.27Å; V169-M173 WeakPolarHBondContact O-CG 3.47Å; V169-M173 PolarHBondContact O-N 3.49Å; V169-L178 HydrophobicContact CB-CD2 3.92Å; V169-L178 HydrophobicContact CG1-CD2 3.56Å |
| 170 | G | 87.2 | Confident | 89.4 | Confident | 0 Ų | 0 | 62.1 Ų | 62.1 | 0% | 0 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -62.2 | -41.3 | 176.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | L166 L167 F168 K174 R175 | L166-G170 PolarHBondContact O-N 2.82Å; L167-G170 PolarHBondContact O-N 2.92Å; F168-G170 VanDerWaalsContact C-N 3.29Å; F168-G170 PolarHBondContact O-N 2.98Å; G170-K174 WeakPolarHBondContact O-CA 3.26Å; G170-K174 PolarHBondContact O-N 3.31Å; G170-R175 PolarHBondContact O-N 2.85Å; G170-R175 VanDerWaalsContact O-N 3.11Å |
| 171 | I | 87.7 | Confident | 89.4 | Confident | 20 Ų | 20 | 63 Ų | 63 | 10% | 0.103 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -66.1 | -47.3 | 174.9 | -64.3 | 166.3 | 0 | 0 | 0 | 110.5 | N110 T113 L167 F168 V169 K174 | N110-I171 HydrophobicContact CB-CG2 4.17Å; T113-I171 HydrophobicContact CG2-CD1 3.73Å; L167-I171 HydrophobicContact CD2-CD1 3.59Å; L167-I171 HydrophobicContact CG-CD1 4.19Å; L167-I171 VanDerWaalsContact O-CG1 3.32Å; L167-I171 WeakPolarHBondContact O-CG1 3.29Å; L167-I171 PolarHBondContact O-N 2.97Å; F168-I171 PolarHBondContact O-N 2.98Å; V169-I171 PolarHBondContact O-N 3.29Å; I171-K174 PolarHBondContact O-N 2.98Å |
| 172 | F | 88.6 | Confident | 89.3 | Confident | 155 Ų | 155 | 60.7 Ų | 60.7 | 68% | 0.68 | 29% | 0.285 | S | S | * | . | H | α-helix | trans | -66.6 | -42 | -179.2 | -78.6 | -65 | 0 | 0 | 0 | 113.1 | F168 V169 K174 | F168-F172 WeakPolarHBondContact O-CD2 3.28Å; F168-F172 PolarHBondContact O-N 3.48Å; V169-F172 PolarHBondContact O-N 3.4Å; F172-K174 VanDerWaalsContact C-N 3.28Å; F172-K174 PolarHBondContact O-N 2.91Å |
| 173 | M | 88.1 | Confident | 89.1 | Confident | 118 Ų | 118 | 59 Ų | 59 | 58% | 0.581 | 27% | 0.272 | S | S | * | . | H | α-helix | trans | -82.8 | -3.8 | 179.4 | -62.5 | -173.3 | 77 | 0 | 0 | 113.2 | V169 R175 | V169-M173 HydrophobicContact CG1-CG 4.01Å; V169-M173 HydrophobicContact CG1-SD 3.54Å; V169-M173 VanDerWaalsContact CG1-SD 3.54Å; V169-M173 VanDerWaalsContact O-CB 3.31Å; V169-M173 WeakPolarHBondContact O-CB 3.27Å; V169-M173 WeakPolarHBondContact O-CG 3.47Å; V169-M173 PolarHBondContact O-N 3.49Å; M173-R175 HydrophobicContact CB-CB 4.46Å; M173-R175 HydrophobicContact CB-CG 3.95Å; M173-R175 WeakPolarHBondContact O-CG 3.39Å; M173-R175 PolarHBondContact O-N 3.48Å |
| 174 | K | 84.2 | Confident | 89.2 | Confident | 135 Ų | 135 | 62.2 Ų | 62.2 | 59% | 0.587 | 29% | 0.288 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 50.9 | 35.3 | -174.3 | -60.5 | -178.8 | 178.7 | 173.6 | 0 | 113.2 | G170 I171 F172 I264 N268 | G170-K174 WeakPolarHBondContact O-CA 3.26Å; G170-K174 PolarHBondContact O-N 3.31Å; I171-K174 PolarHBondContact O-N 2.98Å; F172-K174 VanDerWaalsContact C-N 3.28Å; F172-K174 PolarHBondContact O-N 2.91Å; K174-I264 HydrophobicContact CB-CG2 4.39Å; K174-I264 WeakPolarHBondContact O-CG2 3.14Å; K174-N268 PolarHBondContact O-ND2 3.11Å |
| 175 | R | 85.1 | Confident | 89.2 | Confident | 123 Ų | 123 | 64 Ų | 64 | 46% | 0.464 | 30% | 0.298 | S | S | . | . | trans | -104.6 | 106.7 | -179.3 | -67.3 | -56.7 | -171.2 | 166.2 | -0.1 | 109.2 | G170 M173 W177 L178 | G170-R175 PolarHBondContact O-N 2.85Å; G170-R175 VanDerWaalsContact O-N 3.11Å; M173-R175 HydrophobicContact CB-CB 4.46Å; M173-R175 HydrophobicContact CB-CG 3.95Å; M173-R175 WeakPolarHBondContact O-CG 3.39Å; M173-R175 PolarHBondContact O-N 3.48Å; R175-W177 HydrophobicContact CB-CD2 4.3Å; R175-W177 HydrophobicContact CB-CE3 4.21Å; R175-W177 HydrophobicContact CB-CH2 4.43Å; R175-W177 HydrophobicContact CB-CZ3 4.3Å; R175-W177 HydrophobicContact CG-CH2 4Å; R175-W177 HydrophobicContact CG-CZ2 4.37Å; R175-W177 HydrophobicContact CG-CZ3 4.09Å; R175-W177 PolarHBondContact O-N 3.45Å; R175-L178 HydrophobicContact CB-CD1 3.57Å; R175-L178 HydrophobicContact CG-CD1 4.34Å; R175-L178 PolarHBondContact O-N 3.28Å | ||
| 176 | P | 83.7 | Confident | 89.1 | Confident | 15 Ų | 15 | 60.3 Ų | 60.3 | 10% | 0.097 | 28% | 0.275 | C | S | . | . | G | 310 helix | trans | -65.2 | -28.3 | -174 | 25.2 | -33.3 | 0 | 0 | 0 | 112.7 | L178 L179 Y261 I264 | P176-L178 PolarHBondContact O-N 2.98Å; P176-L179 PolarHBondContact O-N 2.9Å; P176-L179 VanDerWaalsContact O-N 3.12Å; P176-Y261 HydrophobicContact CB-CD2 3.74Å; P176-Y261 HydrophobicContact CB-CE2 3.58Å; P176-Y261 WeakPolarHBondContact O-CD2 3.47Å; P176-Y261 VanDerWaalsContact O-CE2 3.29Å; P176-Y261 WeakPolarHBondContact O-CE2 3.45Å; P176-I264 HydrophobicContact CB-CG2 4.32Å |
| 177 | W | 87.8 | Confident | 89.1 | Confident | 167 Ų | 167 | 61.4 Ų | 61.4 | 63% | 0.633 | 28% | 0.28 | S | S | * | . | G | 310 helix | trans | -62.3 | -25.6 | -179.6 | 84.5 | 69.7 | 0 | 0 | 0 | 113.3 | R175 L179 W180 | R175-W177 HydrophobicContact CB-CD2 4.3Å; R175-W177 HydrophobicContact CB-CE3 4.21Å; R175-W177 HydrophobicContact CB-CH2 4.43Å; R175-W177 HydrophobicContact CB-CZ3 4.3Å; R175-W177 HydrophobicContact CG-CH2 4Å; R175-W177 HydrophobicContact CG-CZ2 4.37Å; R175-W177 HydrophobicContact CG-CZ3 4.09Å; R175-W177 PolarHBondContact O-N 3.45Å; W177-L179 VanDerWaalsContact C-N 3.27Å; W177-L179 PolarHBondContact O-N 3.07Å; W177-W180 WeakPolarHBondContact O-CB 3.45Å; W177-W180 PolarHBondContact O-N 2.81Å |
| 178 | L | 88.1 | Confident | 89.2 | Confident | 20 Ų | 20 | 63.8 Ų | 63.8 | 11% | 0.105 | 30% | 0.3 | C | S | . | . | G | 310 helix | trans | -72.8 | -19.8 | 179.4 | -88 | 90.3 | 0 | 0 | 0 | 112.9 | L166 V169 R175 P176 W180 P181 | L166-L178 HydrophobicContact CD2-CD2 4.21Å; V169-L178 HydrophobicContact CB-CD2 3.92Å; V169-L178 HydrophobicContact CG1-CD2 3.56Å; R175-L178 HydrophobicContact CB-CD1 3.57Å; R175-L178 HydrophobicContact CG-CD1 4.34Å; R175-L178 PolarHBondContact O-N 3.28Å; P176-L178 PolarHBondContact O-N 2.98Å; L178-W180 VanDerWaalsContact C-N 3.34Å; L178-P181 WeakPolarHBondContact O-CD 3.45Å; L178-P181 WeakPolarHBondContact O-CG 3.34Å |
| 179 | L | 88 | Confident | 89.2 | Confident | 0 Ų | 0 | 67 Ų | 67 | 0% | 0 | 31% | 0.314 | C | S | . | . | G | 310 helix | trans | -81.4 | -18 | 178.7 | -74.6 | 73.4 | 0 | 0 | 0 | 111.9 | P176 W177 H182 M183 V257 Y261 | P176-L179 PolarHBondContact O-N 2.9Å; P176-L179 VanDerWaalsContact O-N 3.12Å; W177-L179 VanDerWaalsContact C-N 3.27Å; W177-L179 PolarHBondContact O-N 3.07Å; L179-H182 PolarHBondContact O-N 3.4Å; L179-M183 PolarHBondContact O-N 3.43Å; L179-M183 VanDerWaalsContact O-N 3.07Å; L179-V257 HydrophobicContact CD2-CG1 4.24Å; L179-Y261 HydrophobicContact CB-CD2 4.35Å |
| 180 | W | 89 | Confident | 89.3 | Confident | 161 Ų | 161 | 65 Ų | 65 | 61% | 0.61 | 30% | 0.302 | S | S | * | . | H | α-helix | trans | -58.9 | -47.9 | -177.5 | -157.2 | 64.4 | 0 | 0 | 0 | 115 | W177 L178 H182 M183 I184 | W177-W180 WeakPolarHBondContact O-CB 3.45Å; W177-W180 PolarHBondContact O-N 2.81Å; L178-W180 VanDerWaalsContact C-N 3.34Å; W180-H182 VanDerWaalsContact C-N 3.26Å; W180-H182 PolarHBondContact O-N 3.31Å; W180-M183 HydrophobicContact CB-CE 4.43Å; W180-M183 PolarHBondContact O-N 2.91Å; W180-I184 HydrophobicContact CD2-CD1 3.62Å; W180-I184 HydrophobicContact CD2-CG1 4.4Å; W180-I184 HydrophobicContact CE3-CD1 3.48Å; W180-I184 VanDerWaalsContact CE3-CD1 3.48Å; W180-I184 HydrophobicContact CG-CD1 4.39Å; W180-I184 HydrophobicContact CH2-CD1 3.76Å; W180-I184 HydrophobicContact CZ2-CD1 3.88Å; W180-I184 HydrophobicContact CZ3-CD1 3.56Å; W180-I184 WeakPolarHBondContact O-CG1 3.42Å; W180-I184 PolarHBondContact O-N 3.45Å |
| 181 | P | 90.6 | Very high | 89.6 | Confident | 44 Ų | 44 | 68.1 Ų | 68.1 | 29% | 0.286 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -59.5 | -37.2 | 177.7 | 21.6 | -34.1 | 0 | 0 | 0 | 112.8 | L166 L178 I184 V185 | L166-P181 HydrophobicContact CD1-CG 3.97Å; L178-P181 WeakPolarHBondContact O-CD 3.45Å; L178-P181 WeakPolarHBondContact O-CG 3.34Å; P181-I184 PolarHBondContact O-N 2.97Å; P181-V185 WeakPolarHBondContact O-CG2 3.41Å; P181-V185 PolarHBondContact O-N 3.5Å; P181-V185 VanDerWaalsContact O-N 3.09Å |
| 182 | H | 91.3 | Very high | 89.9 | Confident | 0 Ų | 0 | 71.4 Ų | 71.4 | 0% | 0 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -67.9 | -44.5 | 177.7 | -177.3 | -102.1 | 0 | 0 | 0 | 111.8 | E120 L167 L179 W180 I184 V185 Q186 | E120-H182 VanDerWaalsContact CD-NE2 3.25Å; E120-H182 IonicContact OE1-CD2 3.02Å; E120-H182 IonicContact OE1-CE1 3.97Å; E120-H182 IonicContact OE1-NE2 3Å; E120-H182 PolarHBondContact OE1-NE2 3.19Å; E120-H182 IonicContact OE2-CD2 2.74Å; E120-H182 IonicContact OE2-CE1 3.85Å; E120-H182 PolarHBondContact OE2-CE1 3.29Å; E120-H182 VanDerWaalsContact OE2-CE1 3.28Å; E120-H182 IonicContact OE2-NE2 2.7Å; E120-H182 PolarHBondContact OE2-NE2 2.78Å; L167-H182 HydrophobicContact CB-CB 4.44Å; L167-H182 WeakPolarHBondContact CD1-CE1 3.37Å; L167-H182 VanDerWaalsContact CD1-ND1 3.27Å; L167-H182 WeakPolarHBondContact CD1-ND1 3.48Å; L179-H182 PolarHBondContact O-N 3.4Å; W180-H182 VanDerWaalsContact C-N 3.26Å; W180-H182 PolarHBondContact O-N 3.31Å; H182-I184 VanDerWaalsContact C-N 3.3Å; H182-I184 PolarHBondContact O-N 2.97Å; H182-V185 PolarHBondContact O-N 3.15Å; H182-Q186 PolarHBondContact CE1-NE2 3.29Å; H182-Q186 WeakPolarHBondContact O-CG 3.24Å; H182-Q186 PolarHBondContact O-N 2.91Å |
| 183 | M | 90 | Very high | 90 | Very high | 16 Ų | 16 | 64.5 Ų | 64.5 | 8% | 0.079 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -58.9 | -39.2 | 174.1 | -73.6 | -170.2 | -65.4 | 0 | 0 | 112.8 | L179 W180 Q186 M187 Y254 V257 K258 Y261 | L179-M183 PolarHBondContact O-N 3.43Å; L179-M183 VanDerWaalsContact O-N 3.07Å; W180-M183 HydrophobicContact CB-CE 4.43Å; W180-M183 PolarHBondContact O-N 2.91Å; M183-Q186 PolarHBondContact O-N 2.87Å; M183-M187 WeakPolarHBondContact O-CB 3.17Å; M183-M187 PolarHBondContact O-N 3.28Å; M183-Y254 HydrophobicContact CB-CD2 4.34Å; M183-Y254 HydrophobicContact CB-CE2 3.98Å; M183-Y254 HydrophobicContact CG-CD2 4.46Å; M183-Y254 HydrophobicContact CG-CE2 4.27Å; M183-V257 HydrophobicContact CG-CG1 3.69Å; M183-V257 HydrophobicContact SD-CG1 4.37Å; M183-K258 HydrophobicContact SD-CB 4.4Å; M183-Y261 HydrophobicContact CE-CD2 3.73Å; M183-Y261 HydrophobicContact CE-CE2 4.16Å; M183-Y261 HydrophobicContact CE-CG 4Å |
| 184 | I | 93.1 | Very high | 90.2 | Very high | 81 Ų | 81 | 63.6 Ų | 63.6 | 42% | 0.415 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -64.5 | -46.3 | 176.4 | -68.8 | 167.5 | 0 | 0 | 0 | 110.8 | W180 P181 H182 Q186 M187 A188 | W180-I184 HydrophobicContact CD2-CD1 3.62Å; W180-I184 HydrophobicContact CD2-CG1 4.4Å; W180-I184 HydrophobicContact CE3-CD1 3.48Å; W180-I184 VanDerWaalsContact CE3-CD1 3.48Å; W180-I184 HydrophobicContact CG-CD1 4.39Å; W180-I184 HydrophobicContact CH2-CD1 3.76Å; W180-I184 HydrophobicContact CZ2-CD1 3.88Å; W180-I184 HydrophobicContact CZ3-CD1 3.56Å; W180-I184 WeakPolarHBondContact O-CG1 3.42Å; W180-I184 PolarHBondContact O-N 3.45Å; P181-I184 PolarHBondContact O-N 2.97Å; H182-I184 VanDerWaalsContact C-N 3.3Å; H182-I184 PolarHBondContact O-N 2.97Å; I184-Q186 VanDerWaalsContact C-N 3.34Å; I184-Q186 PolarHBondContact O-N 2.89Å; I184-M187 PolarHBondContact O-N 3.39Å; I184-A188 PolarHBondContact O-N 2.92Å |
| 185 | V | 91.8 | Very high | 90.7 | Very high | 38 Ų | 38 | 61.2 Ų | 61.2 | 23% | 0.23 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -62 | -43.4 | 178.6 | 168.7 | 0 | 0 | 0 | 0 | 110.9 | L160 T163 P181 H182 M187 A188 F189 | L160-V185 HydrophobicContact CD2-CG1 3.87Å; T163-V185 HydrophobicContact CG2-CG2 4.1Å; P181-V185 WeakPolarHBondContact O-CG2 3.41Å; P181-V185 PolarHBondContact O-N 3.5Å; P181-V185 VanDerWaalsContact O-N 3.09Å; H182-V185 PolarHBondContact O-N 3.15Å; V185-M187 PolarHBondContact O-N 2.93Å; V185-A188 WeakPolarHBondContact O-CB 3.34Å; V185-A188 PolarHBondContact O-N 3.36Å; V185-F189 HydrophobicContact CG1-CD2 3.83Å; V185-F189 HydrophobicContact CG1-CE2 3.71Å; V185-F189 VanDerWaalsContact O-CD2 3.29Å; V185-F189 WeakPolarHBondContact O-CD2 3.24Å; V185-F189 PolarHBondContact O-N 2.87Å |
| 186 | Q | 91.4 | Very high | 90.9 | Very high | 6 Ų | 6 | 56.8 Ų | 56.8 | 3% | 0.028 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -61.3 | -42.8 | 174.9 | -71.9 | -175 | -24.1 | 0 | 0 | 112.4 | H182 M183 I184 A188 F189 V190 Y254 | H182-Q186 PolarHBondContact CE1-NE2 3.29Å; H182-Q186 WeakPolarHBondContact O-CG 3.24Å; H182-Q186 PolarHBondContact O-N 2.91Å; M183-Q186 PolarHBondContact O-N 2.87Å; I184-Q186 VanDerWaalsContact C-N 3.34Å; I184-Q186 PolarHBondContact O-N 2.89Å; Q186-A188 VanDerWaalsContact C-N 3.3Å; Q186-A188 PolarHBondContact O-N 3.19Å; Q186-F189 WeakPolarHBondContact O-CB 3.44Å; Q186-F189 PolarHBondContact O-N 3.17Å; Q186-F189 VanDerWaalsContact O-N 3.16Å; Q186-V190 WeakPolarHBondContact O-CG2 3.45Å; Q186-V190 PolarHBondContact O-N 3.49Å; Q186-Y254 HydrophobicContact CB-CD2 4.39Å |
| 187 | M | 92.4 | Very high | 91.3 | Very high | 90 Ų | 90 | 56.8 Ų | 56.8 | 44% | 0.443 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -62.2 | -39.7 | 175.8 | -169.8 | 63.6 | -169.2 | 0 | 0 | 111.5 | M183 I184 V185 F189 V190 C191 | M183-M187 WeakPolarHBondContact O-CB 3.17Å; M183-M187 PolarHBondContact O-N 3.28Å; I184-M187 PolarHBondContact O-N 3.39Å; V185-M187 PolarHBondContact O-N 2.93Å; M187-F189 PolarHBondContact O-N 3.35Å; M187-V190 PolarHBondContact O-N 3.2Å; M187-C191 PolarHBondContact O-N 3.07Å; M187-C191 PolarHBondContact O-SG 3.46Å; M187-C191 VanDerWaalsContact O-SG 3.34Å |
| 188 | A | 92.9 | Very high | 91.5 | Very high | 52 Ų | 52 | 55 Ų | 55 | 43% | 0.43 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -61.5 | -42.6 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | I184 V185 Q186 C191 V192 | I184-A188 PolarHBondContact O-N 2.92Å; V185-A188 WeakPolarHBondContact O-CB 3.34Å; V185-A188 PolarHBondContact O-N 3.36Å; Q186-A188 VanDerWaalsContact C-N 3.3Å; Q186-A188 PolarHBondContact O-N 3.19Å; A188-C191 PolarHBondContact O-N 3.43Å; A188-V192 VanDerWaalsContact O-CG2 3.32Å; A188-V192 WeakPolarHBondContact O-CG2 3.43Å; A188-V192 PolarHBondContact O-N 3.49Å |
| 189 | F | 90.9 | Very high | 91.6 | Very high | 111 Ų | 111 | 55.9 Ų | 55.9 | 49% | 0.487 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -60.9 | -43 | 174 | -88.8 | -75.2 | 0 | 0 | 0 | 112.7 | L160 V185 Q186 M187 V192 G193 | L160-F189 HydrophobicContact CD1-CZ 4.18Å; L160-F189 HydrophobicContact CD2-CE2 3.7Å; L160-F189 HydrophobicContact CD2-CZ 4.04Å; V185-F189 HydrophobicContact CG1-CD2 3.83Å; V185-F189 HydrophobicContact CG1-CE2 3.71Å; V185-F189 VanDerWaalsContact O-CD2 3.29Å; V185-F189 WeakPolarHBondContact O-CD2 3.24Å; V185-F189 PolarHBondContact O-N 2.87Å; Q186-F189 WeakPolarHBondContact O-CB 3.44Å; Q186-F189 PolarHBondContact O-N 3.17Å; Q186-F189 VanDerWaalsContact O-N 3.16Å; M187-F189 PolarHBondContact O-N 3.35Å; F189-V192 PolarHBondContact O-N 2.83Å; F189-G193 PolarHBondContact O-N 2.84Å |
| 190 | V | 93.1 | Very high | 91.7 | Very high | 14 Ų | 14 | 56 Ų | 56 | 9% | 0.085 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -60.9 | -48.2 | 175.2 | 174.5 | 0 | 0 | 0 | 0 | 110.4 | Q186 M187 V192 G193 M194 A250 I251 | Q186-V190 WeakPolarHBondContact O-CG2 3.45Å; Q186-V190 PolarHBondContact O-N 3.49Å; M187-V190 PolarHBondContact O-N 3.2Å; V190-V192 PolarHBondContact O-N 3.45Å; V190-G193 PolarHBondContact O-N 2.89Å; V190-M194 HydrophobicContact CG1-CG 4.31Å; V190-M194 WeakPolarHBondContact O-CB 3.08Å; V190-M194 VanDerWaalsContact O-CG 3.27Å; V190-M194 WeakPolarHBondContact O-CG 3.29Å; V190-M194 PolarHBondContact O-N 3.29Å; V190-A250 HydrophobicContact CG2-CB 3.59Å; V190-I251 HydrophobicContact CB-CG1 4.43Å; V190-I251 HydrophobicContact CG1-CD1 4.05Å; V190-I251 HydrophobicContact CG1-CG1 3.71Å; V190-I251 HydrophobicContact CG2-CG1 3.76Å |
| 191 | C | 94.5 | Very high | 91.7 | Very high | 64 Ų | 64 | 51.9 Ų | 51.9 | 43% | 0.432 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -58.5 | -47.7 | 178.1 | -72.8 | 0 | 0 | 0 | 0 | 111.9 | M187 A188 M194 V195 | M187-C191 PolarHBondContact O-N 3.07Å; M187-C191 PolarHBondContact O-SG 3.46Å; M187-C191 VanDerWaalsContact O-SG 3.34Å; A188-C191 PolarHBondContact O-N 3.43Å; C191-M194 PolarHBondContact O-N 3.46Å; C191-V195 VanDerWaalsContact O-CG2 3.28Å; C191-V195 WeakPolarHBondContact O-CG2 3.4Å; C191-V195 PolarHBondContact O-N 2.84Å |
| 192 | V | 92.8 | Very high | 91.7 | Very high | 89 Ų | 89 | 53.4 Ų | 53.4 | 54% | 0.539 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -61.9 | -46.7 | 177.5 | 172.5 | 0 | 0 | 0 | 0 | 110.6 | A188 F189 V190 M194 V195 M196 | A188-V192 VanDerWaalsContact O-CG2 3.32Å; A188-V192 WeakPolarHBondContact O-CG2 3.43Å; A188-V192 PolarHBondContact O-N 3.49Å; F189-V192 PolarHBondContact O-N 2.83Å; V190-V192 PolarHBondContact O-N 3.45Å; V192-M194 VanDerWaalsContact C-N 3.34Å; V192-M194 PolarHBondContact O-N 2.73Å; V192-V195 PolarHBondContact O-N 2.83Å; V192-M196 HydrophobicContact CG1-CG 4.16Å; V192-M196 WeakPolarHBondContact O-CB 3.37Å; V192-M196 WeakPolarHBondContact O-CG 3.43Å; V192-M196 PolarHBondContact O-N 3.46Å |
| 193 | G | 91.5 | Very high | 91.5 | Very high | 11 Ų | 11 | 53.8 Ų | 53.8 | 11% | 0.113 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -59.2 | -42.6 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113 | F189 V190 M196 T197 | F189-G193 PolarHBondContact O-N 2.84Å; V190-G193 PolarHBondContact O-N 2.89Å; G193-M196 PolarHBondContact O-N 2.84Å; G193-T197 WeakPolarHBondContact O-CB 3.27Å; G193-T197 PolarHBondContact O-N 3.46Å; G193-T197 PolarHBondContact O-OG1 2.81Å |
| 194 | M | 92.8 | Very high | 91.3 | Very high | 98 Ų | 98 | 56 Ų | 56 | 48% | 0.483 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -66.6 | -42.9 | 176.9 | -69.5 | -60.4 | -68.4 | 0 | 0 | 112.3 | V190 C191 V192 T197 F198 A247 | V190-M194 HydrophobicContact CG1-CG 4.31Å; V190-M194 WeakPolarHBondContact O-CB 3.08Å; V190-M194 VanDerWaalsContact O-CG 3.27Å; V190-M194 WeakPolarHBondContact O-CG 3.29Å; V190-M194 PolarHBondContact O-N 3.29Å; C191-M194 PolarHBondContact O-N 3.46Å; V192-M194 VanDerWaalsContact C-N 3.34Å; V192-M194 PolarHBondContact O-N 2.73Å; M194-T197 PolarHBondContact O-N 3.43Å; M194-F198 WeakPolarHBondContact O-CB 3.25Å; M194-F198 PolarHBondContact O-N 3.44Å; M194-A247 HydrophobicContact CG-CB 4.39Å; M194-A247 HydrophobicContact SD-CB 4.11Å |
| 195 | V | 93.6 | Very high | 91 | Very high | 86 Ų | 86 | 56.1 Ų | 56.1 | 52% | 0.521 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -62.9 | -44.8 | 175.8 | 171.1 | 0 | 0 | 0 | 0 | 110.6 | C191 V192 T197 F198 V199 | C191-V195 VanDerWaalsContact O-CG2 3.28Å; C191-V195 WeakPolarHBondContact O-CG2 3.4Å; C191-V195 PolarHBondContact O-N 2.84Å; V192-V195 PolarHBondContact O-N 2.83Å; V195-T197 PolarHBondContact O-N 2.85Å; V195-F198 PolarHBondContact O-N 2.71Å; V195-V199 HydrophobicContact CG1-CG2 4.24Å; V195-V199 WeakPolarHBondContact O-CB 3.47Å; V195-V199 VanDerWaalsContact O-CG2 3.27Å; V195-V199 WeakPolarHBondContact O-CG2 3.43Å; V195-V199 PolarHBondContact O-N 2.86Å |
| 196 | M | 90.6 | Very high | 90.7 | Very high | 30 Ų | 30 | 57.4 Ų | 57.4 | 15% | 0.148 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -64.2 | -41.1 | 178.7 | -68.7 | -58 | -70.8 | 0 | 0 | 111.8 | V192 G193 V199 T200 L218 F219 F243 | V192-M196 HydrophobicContact CG1-CG 4.16Å; V192-M196 WeakPolarHBondContact O-CB 3.37Å; V192-M196 WeakPolarHBondContact O-CG 3.43Å; V192-M196 PolarHBondContact O-N 3.46Å; G193-M196 PolarHBondContact O-N 2.84Å; M196-V199 PolarHBondContact O-N 3.41Å; M196-T200 WeakPolarHBondContact O-CB 3.22Å; M196-T200 PolarHBondContact O-N 2.92Å; M196-T200 PolarHBondContact O-OG1 3.26Å; M196-L218 HydrophobicContact CE-CD1 4.05Å; M196-L218 HydrophobicContact SD-CD1 4.44Å; M196-F219 HydrophobicContact CE-CD2 4.46Å; M196-F219 HydrophobicContact CE-CE1 4.33Å; M196-F219 HydrophobicContact CE-CE2 3.29Å; M196-F219 HydrophobicContact CE-CZ 3.2Å; M196-F243 HydrophobicContact CB-CD2 3.87Å; M196-F243 HydrophobicContact CB-CE2 4.22Å; M196-F243 HydrophobicContact CB-CG 4.13Å; M196-F243 HydrophobicContact CE-CE2 4.38Å; M196-F243 HydrophobicContact CE-CZ 4.48Å |
| 197 | T | 91.2 | Very high | 90.3 | Very high | 14 Ų | 14 | 58.6 Ų | 58.6 | 9% | 0.086 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -59.5 | -49.1 | 173.3 | -56 | 0 | 0 | 0 | 0 | 110.8 | G193 M194 V195 T200 V201 F243 N244 | G193-T197 WeakPolarHBondContact O-CB 3.27Å; G193-T197 PolarHBondContact O-N 3.46Å; G193-T197 PolarHBondContact O-OG1 2.81Å; M194-T197 PolarHBondContact O-N 3.43Å; V195-T197 PolarHBondContact O-N 2.85Å; T197-T200 PolarHBondContact O-N 2.91Å; T197-V201 WeakPolarHBondContact O-CG2 3.42Å; T197-V201 PolarHBondContact O-N 3.48Å; T197-F243 VanDerWaalsContact OG1-CB 3.25Å; T197-F243 WeakPolarHBondContact OG1-CB 3.29Å; T197-N244 HydrophobicContact CG2-CB 4.14Å; T197-N244 PolarHBondContact OG1-N 3.26Å |
| 198 | F | 91.6 | Very high | 89.6 | Confident | 131 Ų | 131 | 58.2 Ų | 58.2 | 58% | 0.575 | 34% | 0.341 | S | S | * | . | H | α-helix | trans | -61.6 | -46.4 | 179.5 | -179.6 | -106.4 | 0 | 0 | 0 | 112.4 | M194 V195 T200 V201 L202 | M194-F198 WeakPolarHBondContact O-CB 3.25Å; M194-F198 PolarHBondContact O-N 3.44Å; V195-F198 PolarHBondContact O-N 2.71Å; F198-T200 VanDerWaalsContact C-N 3.32Å; F198-T200 PolarHBondContact O-N 3.42Å; F198-V201 PolarHBondContact O-N 2.91Å; F198-L202 HydrophobicContact CD1-CD1 3.78Å; F198-L202 HydrophobicContact CD1-CG 4.27Å; F198-L202 HydrophobicContact CD2-CG 4.49Å; F198-L202 HydrophobicContact CE1-CD1 3.2Å; F198-L202 HydrophobicContact CE1-CG 3.94Å; F198-L202 HydrophobicContact CE2-CD1 4.25Å; F198-L202 HydrophobicContact CE2-CD2 4.32Å; F198-L202 HydrophobicContact CE2-CG 4.15Å; F198-L202 HydrophobicContact CZ-CD1 3.48Å; F198-L202 VanDerWaalsContact CZ-CD1 3.48Å; F198-L202 HydrophobicContact CZ-CD2 4.13Å; F198-L202 HydrophobicContact CZ-CG 3.87Å; F198-L202 WeakPolarHBondContact O-CB 3.32Å; F198-L202 WeakPolarHBondContact O-CG 3.38Å; F198-L202 PolarHBondContact O-N 3.22Å |
| 199 | V | 90.6 | Very high | 89.1 | Confident | 38 Ų | 38 | 62.9 Ų | 62.9 | 23% | 0.23 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -59.6 | -45.5 | 176.2 | 170.9 | 0 | 0 | 0 | 0 | 110.3 | V195 M196 V201 L202 V203 V214 L218 | V195-V199 HydrophobicContact CG1-CG2 4.24Å; V195-V199 WeakPolarHBondContact O-CB 3.47Å; V195-V199 VanDerWaalsContact O-CG2 3.27Å; V195-V199 WeakPolarHBondContact O-CG2 3.43Å; V195-V199 PolarHBondContact O-N 2.86Å; M196-V199 PolarHBondContact O-N 3.41Å; V199-V201 PolarHBondContact O-N 3.39Å; V199-L202 PolarHBondContact O-N 3.4Å; V199-V203 HydrophobicContact CG1-CG2 4.1Å; V199-V203 VanDerWaalsContact O-CB 3.27Å; V199-V203 WeakPolarHBondContact O-CB 3.42Å; V199-V203 WeakPolarHBondContact O-CG2 3.23Å; V199-V203 PolarHBondContact O-N 2.74Å; V199-V214 HydrophobicContact CG1-CG1 3.9Å; V199-L218 HydrophobicContact CG1-CD1 4Å |
| 200 | T | 89 | Confident | 88.6 | Confident | 1 Ų | 1 | 57.9 Ų | 57.9 | 1% | 0.006 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -61 | -46.6 | 180 | -54.5 | 0 | 0 | 0 | 0 | 111.3 | M196 T197 F198 V203 M204 F215 P236 A240 | M196-T200 WeakPolarHBondContact O-CB 3.22Å; M196-T200 PolarHBondContact O-N 2.92Å; M196-T200 PolarHBondContact O-OG1 3.26Å; T197-T200 PolarHBondContact O-N 2.91Å; F198-T200 VanDerWaalsContact C-N 3.32Å; F198-T200 PolarHBondContact O-N 3.42Å; T200-V203 PolarHBondContact O-N 2.9Å; T200-M204 HydrophobicContact CG2-CE 4.08Å; T200-M204 VanDerWaalsContact O-CG 3.32Å; T200-M204 WeakPolarHBondContact O-CG 2.82Å; T200-M204 PolarHBondContact O-N 2.87Å; T200-F215 HydrophobicContact CG2-CE2 4.17Å; T200-F215 HydrophobicContact CG2-CZ 3.55Å; T200-F215 WeakPolarHBondContact OG1-CZ 3.38Å; T200-P236 HydrophobicContact CG2-CB 4.46Å; T200-P236 WeakPolarHBondContact CG2-O 3.32Å; T200-A240 HydrophobicContact CG2-CB 3.7Å |
| 201 | V | 90.1 | Very high | 88.1 | Confident | 76 Ų | 76 | 57.5 Ų | 57.5 | 46% | 0.461 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -63.9 | -43.7 | 177.9 | 173.3 | 0 | 0 | 0 | 0 | 112.1 | T197 F198 V199 V203 M204 S205 A240 | T197-V201 WeakPolarHBondContact O-CG2 3.42Å; T197-V201 PolarHBondContact O-N 3.48Å; F198-V201 PolarHBondContact O-N 2.91Å; V199-V201 PolarHBondContact O-N 3.39Å; V201-V203 VanDerWaalsContact C-N 3.32Å; V201-V203 PolarHBondContact O-N 3.24Å; V201-M204 HydrophobicContact CB-CE 4.35Å; V201-M204 HydrophobicContact CG2-CE 3.98Å; V201-M204 PolarHBondContact O-N 2.88Å; V201-S205 PolarHBondContact O-N 3.49Å; V201-S205 VanDerWaalsContact O-N 3.17Å; V201-A240 HydrophobicContact CG2-CB 4.09Å |
| 202 | L | 89.9 | Confident | 87.4 | Confident | 75 Ų | 75 | 59.5 Ų | 59.5 | 39% | 0.393 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -61 | -44.4 | 176.8 | -79.3 | -173.8 | 0 | 0 | 0 | 111.7 | F198 V199 M204 S205 I206 | F198-L202 HydrophobicContact CD1-CD1 3.78Å; F198-L202 HydrophobicContact CD1-CG 4.27Å; F198-L202 HydrophobicContact CD2-CG 4.49Å; F198-L202 HydrophobicContact CE1-CD1 3.2Å; F198-L202 HydrophobicContact CE1-CG 3.94Å; F198-L202 HydrophobicContact CE2-CD1 4.25Å; F198-L202 HydrophobicContact CE2-CD2 4.32Å; F198-L202 HydrophobicContact CE2-CG 4.15Å; F198-L202 HydrophobicContact CZ-CD1 3.48Å; F198-L202 VanDerWaalsContact CZ-CD1 3.48Å; F198-L202 HydrophobicContact CZ-CD2 4.13Å; F198-L202 HydrophobicContact CZ-CG 3.87Å; F198-L202 WeakPolarHBondContact O-CB 3.32Å; F198-L202 WeakPolarHBondContact O-CG 3.38Å; F198-L202 PolarHBondContact O-N 3.22Å; V199-L202 PolarHBondContact O-N 3.4Å; L202-M204 VanDerWaalsContact C-N 3.34Å; L202-S205 WeakPolarHBondContact O-CB 3.22Å; L202-S205 PolarHBondContact O-N 3.43Å; L202-S205 PolarHBondContact O-OG 2.87Å; L202-I206 WeakPolarHBondContact O-CG1 3.44Å; L202-I206 PolarHBondContact O-N 2.87Å |
| 203 | V | 88 | Confident | 86.9 | Confident | 9 Ų | 9 | 60.6 Ų | 60.6 | 6% | 0.055 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -68.4 | -38 | -176.4 | 172.6 | 0 | 0 | 0 | 0 | 111 | V199 T200 V201 S205 I206 G207 A210 S211 V214 | V199-V203 HydrophobicContact CG1-CG2 4.1Å; V199-V203 VanDerWaalsContact O-CB 3.27Å; V199-V203 WeakPolarHBondContact O-CB 3.42Å; V199-V203 WeakPolarHBondContact O-CG2 3.23Å; V199-V203 PolarHBondContact O-N 2.74Å; T200-V203 PolarHBondContact O-N 2.9Å; V201-V203 VanDerWaalsContact C-N 3.32Å; V201-V203 PolarHBondContact O-N 3.24Å; V203-S205 PolarHBondContact O-N 2.91Å; V203-I206 PolarHBondContact O-N 3.13Å; V203-I206 VanDerWaalsContact O-N 3.11Å; V203-G207 PolarHBondContact O-N 2.71Å; V203-A210 HydrophobicContact CG1-CB 4.41Å; V203-S211 VanDerWaalsContact CG1-N 3.33Å; V203-V214 HydrophobicContact CG1-CB 4.3Å; V203-V214 HydrophobicContact CG1-CG2 4.48Å; V203-V214 HydrophobicContact CG2-CB 4Å; V203-V214 HydrophobicContact CG2-CG1 3.92Å; V203-V214 HydrophobicContact CG2-CG2 3.92Å |
| 204 | M | 85.2 | Confident | 86.6 | Confident | 63 Ų | 63 | 62 Ų | 62 | 31% | 0.31 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -58.5 | -32.9 | 169.3 | -73 | -171.7 | -68.9 | 0 | 0 | 113 | T200 V201 L202 I206 P236 F237 A240 | T200-M204 HydrophobicContact CG2-CE 4.08Å; T200-M204 VanDerWaalsContact O-CG 3.32Å; T200-M204 WeakPolarHBondContact O-CG 2.82Å; T200-M204 PolarHBondContact O-N 2.87Å; V201-M204 HydrophobicContact CB-CE 4.35Å; V201-M204 HydrophobicContact CG2-CE 3.98Å; V201-M204 PolarHBondContact O-N 2.88Å; L202-M204 VanDerWaalsContact C-N 3.34Å; M204-I206 VanDerWaalsContact C-N 3.3Å; M204-I206 PolarHBondContact O-N 2.84Å; M204-P236 HydrophobicContact CG-CB 3.73Å; M204-P236 VanDerWaalsContact SD-C 3.56Å; M204-P236 HydrophobicContact SD-CB 3.9Å; M204-F237 WeakPolarHBondContact SD-CA 3.38Å; M204-F237 HydrophobicContact SD-CB 3.82Å; M204-F237 PolarHBondContact SD-N 3.45Å; M204-A240 HydrophobicContact CE-CB 3.87Å |
| 205 | S | 87.1 | Confident | 86.1 | Confident | 82 Ų | 82 | 57.3 Ų | 57.3 | 57% | 0.573 | 31% | 0.312 | S | S | * | . | H | α-helix | trans | -74.7 | -16.7 | 178.2 | 79.2 | 0 | 0 | 0 | 0 | 114.5 | V201 L202 V203 | V201-S205 PolarHBondContact O-N 3.49Å; V201-S205 VanDerWaalsContact O-N 3.17Å; L202-S205 WeakPolarHBondContact O-CB 3.22Å; L202-S205 PolarHBondContact O-N 3.43Å; L202-S205 PolarHBondContact O-OG 2.87Å; V203-S205 PolarHBondContact O-N 2.91Å |
| 206 | I | 86.7 | Confident | 85.4 | Confident | 66 Ų | 66 | 54.6 Ų | 54.6 | 34% | 0.338 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -91.4 | -39.2 | -179.8 | -62.8 | 165.9 | 0 | 0 | 0 | 110.8 | L19 L202 V203 M204 A210 | L19-I206 HydrophobicContact CD2-CD1 4.31Å; L19-I206 HydrophobicContact CD2-CG2 4.4Å; L202-I206 WeakPolarHBondContact O-CG1 3.44Å; L202-I206 PolarHBondContact O-N 2.87Å; V203-I206 PolarHBondContact O-N 3.13Å; V203-I206 VanDerWaalsContact O-N 3.11Å; M204-I206 VanDerWaalsContact C-N 3.3Å; M204-I206 PolarHBondContact O-N 2.84Å; I206-A210 HydrophobicContact CB-CB 4.04Å; I206-A210 HydrophobicContact CG2-CB 3.66Å |
| 207 | G | 82.1 | Confident | 85.1 | Confident | 31 Ų | 31 | 61 Ų | 61 | 32% | 0.32 | 33% | 0.326 | S | S | . | . | trans | 142 | 168.6 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | V203 E209 A210 S211 | V203-G207 PolarHBondContact O-N 2.71Å; G207-E209 PolarHBondContact O-N 2.92Å; G207-A210 PolarHBondContact O-N 3.28Å; G207-S211 PolarHBondContact O-N 3.44Å | ||
| 208 | S | 77.9 | Confident | 84.6 | Confident | 82 Ų | 82 | 64.2 Ų | 64.2 | 57% | 0.573 | 34% | 0.342 | S | S | * | . | H | α-helix | trans | -61.8 | -41.2 | -177.9 | 51.2 | 0 | 0 | 0 | 0 | 113.1 | A210 S211 E212 | S208-A210 VanDerWaalsContact C-N 3.29Å; S208-A210 PolarHBondContact O-N 2.92Å; S208-S211 WeakPolarHBondContact O-CA 3.37Å; S208-S211 WeakPolarHBondContact O-CB 3.32Å; S208-S211 PolarHBondContact O-N 3.48Å; S208-S211 PolarHBondContact O-OG 3.45Å; S208-E212 PolarHBondContact O-N 3.35Å; S208-E212 VanDerWaalsContact O-N 3.08Å |
| 209 | E | 81.1 | Confident | 83.8 | Confident | 149 Ų | 149 | 61.1 Ų | 61.1 | 70% | 0.696 | 33% | 0.329 | S | S | * | . | H | α-helix | trans | -59.9 | -38.7 | 178.7 | -62.8 | -176.7 | -178.3 | 0 | 0 | 112.4 | G207 S211 Y213 | G207-E209 PolarHBondContact O-N 2.92Å; E209-S211 VanDerWaalsContact C-N 3.3Å; E209-Y213 PolarHBondContact O-N 2.97Å |
| 210 | A | 81.3 | Confident | 82.9 | Confident | 7 Ų | 7 | 62.8 Ų | 62.8 | 6% | 0.058 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -68.9 | -33.3 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | L23 V203 I206 G207 S208 V214 | L23-A210 HydrophobicContact CD1-CB 4Å; V203-A210 HydrophobicContact CG1-CB 4.41Å; I206-A210 HydrophobicContact CB-CB 4.04Å; I206-A210 HydrophobicContact CG2-CB 3.66Å; G207-A210 PolarHBondContact O-N 3.28Å; S208-A210 VanDerWaalsContact C-N 3.29Å; S208-A210 PolarHBondContact O-N 2.92Å; A210-V214 WeakPolarHBondContact O-CB 3.33Å; A210-V214 VanDerWaalsContact O-CG2 3.32Å; A210-V214 WeakPolarHBondContact O-CG2 3.36Å; A210-V214 PolarHBondContact O-N 2.86Å |
| 211 | S | 81.8 | Confident | 82 | Confident | 6 Ų | 6 | 67 Ų | 67 | 4% | 0.042 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -61.5 | -53.6 | 175 | 79.6 | 0 | 0 | 0 | 0 | 112.3 | V203 G207 S208 E209 Y213 V214 F215 | V203-S211 VanDerWaalsContact CG1-N 3.33Å; G207-S211 PolarHBondContact O-N 3.44Å; S208-S211 WeakPolarHBondContact O-CA 3.37Å; S208-S211 WeakPolarHBondContact O-CB 3.32Å; S208-S211 PolarHBondContact O-N 3.48Å; S208-S211 PolarHBondContact O-OG 3.45Å; E209-S211 VanDerWaalsContact C-N 3.3Å; S211-Y213 VanDerWaalsContact C-N 3.28Å; S211-Y213 PolarHBondContact O-N 2.7Å; S211-V214 PolarHBondContact O-N 3Å; S211-F215 VanDerWaalsContact O-CB 3.28Å; S211-F215 WeakPolarHBondContact O-CB 3.08Å; S211-F215 WeakPolarHBondContact O-CD2 3.27Å; S211-F215 PolarHBondContact O-N 2.93Å |
| 212 | E | 79.7 | Confident | 80.9 | Confident | 105 Ų | 105 | 71.5 Ų | 71.5 | 49% | 0.491 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -58 | -43.2 | 178.7 | -68 | 172.8 | -161.9 | 0 | 0 | 111.7 | S208 A216 I224 | S208-E212 PolarHBondContact O-N 3.35Å; S208-E212 VanDerWaalsContact O-N 3.08Å; E212-A216 WeakPolarHBondContact O-CB 3.25Å; E212-A216 PolarHBondContact O-N 3.24Å; E212-I224 HydrophobicContact CB-CD1 4.47Å |
| 213 | Y | 83.1 | Confident | 80.1 | Confident | 113 Ų | 113 | 69 Ų | 69 | 44% | 0.443 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -64.7 | -47 | 179.4 | -177.9 | -101.5 | 0 | 0 | 0 | 113.3 | L23 E209 S211 K217 | L23-Y213 HydrophobicContact CD2-CD1 4.15Å; E209-Y213 PolarHBondContact O-N 2.97Å; S211-Y213 VanDerWaalsContact C-N 3.28Å; S211-Y213 PolarHBondContact O-N 2.7Å; Y213-K217 PolarHBondContact O-N 3.35Å |
| 214 | V | 84.6 | Confident | 79.5 | Confident | 40 Ų | 40 | 69.8 Ų | 69.8 | 24% | 0.242 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -70.3 | -41.3 | -178.5 | 174 | 0 | 0 | 0 | 0 | 110.8 | V199 V203 A210 S211 K217 L218 | V199-V214 HydrophobicContact CG1-CG1 3.9Å; V203-V214 HydrophobicContact CG1-CB 4.3Å; V203-V214 HydrophobicContact CG1-CG2 4.48Å; V203-V214 HydrophobicContact CG2-CB 4Å; V203-V214 HydrophobicContact CG2-CG1 3.92Å; V203-V214 HydrophobicContact CG2-CG2 3.92Å; A210-V214 WeakPolarHBondContact O-CB 3.33Å; A210-V214 VanDerWaalsContact O-CG2 3.32Å; A210-V214 WeakPolarHBondContact O-CG2 3.36Å; A210-V214 PolarHBondContact O-N 2.86Å; S211-V214 PolarHBondContact O-N 3Å; V214-K217 WeakPolarHBondContact O-CB 3.47Å; V214-K217 PolarHBondContact O-N 3.22Å; V214-L218 HydrophobicContact CG1-CD1 3.72Å; V214-L218 HydrophobicContact CG1-CG 4.37Å; V214-L218 WeakPolarHBondContact O-CG 3.44Å; V214-L218 PolarHBondContact O-N 3.25Å |
| 215 | F | 82.2 | Confident | 79.1 | Confident | 0 Ų | 0 | 70.3 Ų | 70.3 | 0% | 0 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -70.7 | -36 | 178.1 | -79.6 | -80.1 | 0 | 0 | 0 | 112.6 | T200 S211 K217 L218 F219 W235 P236 L239 | T200-F215 HydrophobicContact CG2-CE2 4.17Å; T200-F215 HydrophobicContact CG2-CZ 3.55Å; T200-F215 WeakPolarHBondContact OG1-CZ 3.38Å; S211-F215 VanDerWaalsContact O-CB 3.28Å; S211-F215 WeakPolarHBondContact O-CB 3.08Å; S211-F215 WeakPolarHBondContact O-CD2 3.27Å; S211-F215 PolarHBondContact O-N 2.93Å; F215-K217 PolarHBondContact O-N 3.46Å; F215-L218 PolarHBondContact O-N 2.86Å; F215-L218 VanDerWaalsContact O-N 3.13Å; F215-F219 AromaticContact CD1-CD2 3.55Å; F215-F219 HydrophobicContact CD1-CD2 3.55Å; F215-F219 AromaticContact CD1-CE2 3.7Å; F215-F219 HydrophobicContact CD1-CE2 3.7Å; F215-F219 HydrophobicContact CE1-CD2 4.1Å; F215-F219 AromaticContact CE1-CE2 3.76Å; F215-F219 HydrophobicContact CE1-CE2 3.76Å; F215-F219 PolarHBondContact O-N 3.45Å; F215-W235 HydrophobicContact CB-CH2 3.59Å; F215-W235 HydrophobicContact CB-CZ3 4.17Å; F215-W235 AromaticContact CD1-CH2 3.98Å; F215-W235 HydrophobicContact CD1-CH2 3.98Å; F215-W235 AromaticContact CD1-CZ3 3.71Å; F215-W235 HydrophobicContact CD1-CZ3 3.71Å; F215-W235 AromaticContact CD2-CH2 3.4Å; F215-W235 HydrophobicContact CD2-CH2 3.4Å; F215-W235 VanDerWaalsContact CD2-CH2 3.4Å; F215-W235 HydrophobicContact CD2-CZ2 4.48Å; F215-W235 AromaticContact CD2-CZ3 3.77Å; F215-W235 HydrophobicContact CD2-CZ3 3.77Å; F215-W235 HydrophobicContact CE1-CZ3 4.03Å; F215-W235 HydrophobicContact CE2-CH2 4.08Å; F215-W235 HydrophobicContact CE2-CZ3 4.07Å; F215-W235 AromaticContact CG-CH2 3.38Å; F215-W235 HydrophobicContact CG-CH2 3.38Å; F215-W235 AromaticContact CG-CZ3 3.62Å; F215-W235 HydrophobicContact CG-CZ3 3.62Å; F215-W235 HydrophobicContact CZ-CZ3 4.2Å; F215-P236 HydrophobicContact CE2-CB 4.38Å; F215-L239 HydrophobicContact CD1-CD1 4.22Å; F215-L239 HydrophobicContact CE1-CD1 3.75Å; F215-L239 HydrophobicContact CZ-CD1 4.35Å |
| 216 | A | 79.8 | Confident | 78.7 | Confident | 29 Ų | 29 | 72 Ų | 72 | 24% | 0.24 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -58.6 | -34.6 | 171.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | E212 S220 P221 I224 | E212-A216 WeakPolarHBondContact O-CB 3.25Å; E212-A216 PolarHBondContact O-N 3.24Å; A216-S220 CarbonylContact O-C 3.45Å; A216-S220 VanDerWaalsContact O-CA 3.3Å; A216-S220 WeakPolarHBondContact O-CA 3.33Å; A216-S220 PolarHBondContact O-N 3.48Å; A216-P221 HydrophobicContact CB-CB 4.26Å; A216-I224 HydrophobicContact CB-CD1 3.91Å |
| 217 | K | 83.9 | Confident | 78.4 | Confident | 164 Ų | 164 | 69.8 Ų | 69.8 | 71% | 0.713 | 37% | 0.368 | S | S | * | . | H | α-helix | trans | -76.9 | -31.5 | 176.7 | -168.1 | 166.8 | -176 | 169.6 | 0 | 113.5 | Y213 V214 F215 | Y213-K217 PolarHBondContact O-N 3.35Å; V214-K217 WeakPolarHBondContact O-CB 3.47Å; V214-K217 PolarHBondContact O-N 3.22Å; F215-K217 PolarHBondContact O-N 3.46Å |
| 218 | L | 81.9 | Confident | 78.5 | Confident | 82 Ų | 82 | 73.6 Ų | 73.6 | 43% | 0.429 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -88.4 | -40.8 | -177.3 | -71 | 171.3 | 0 | 0 | 0 | 113.6 | M196 V199 V214 F215 | M196-L218 HydrophobicContact CE-CD1 4.05Å; M196-L218 HydrophobicContact SD-CD1 4.44Å; V199-L218 HydrophobicContact CG1-CD1 4Å; V214-L218 HydrophobicContact CG1-CD1 3.72Å; V214-L218 HydrophobicContact CG1-CG 4.37Å; V214-L218 WeakPolarHBondContact O-CG 3.44Å; V214-L218 PolarHBondContact O-N 3.25Å; F215-L218 PolarHBondContact O-N 2.86Å; F215-L218 VanDerWaalsContact O-N 3.13Å |
| 219 | F | 73 | Confident | 78.8 | Confident | 65 Ų | 65 | 75.7 Ų | 75.7 | 29% | 0.285 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -116.5 | 7.3 | -170.3 | -67.8 | -83.1 | 0 | 0 | 0 | 114.3 | M196 F215 S223 F227 F243 | M196-F219 HydrophobicContact CE-CD2 4.46Å; M196-F219 HydrophobicContact CE-CE1 4.33Å; M196-F219 HydrophobicContact CE-CE2 3.29Å; M196-F219 HydrophobicContact CE-CZ 3.2Å; F215-F219 AromaticContact CD1-CD2 3.55Å; F215-F219 HydrophobicContact CD1-CD2 3.55Å; F215-F219 AromaticContact CD1-CE2 3.7Å; F215-F219 HydrophobicContact CD1-CE2 3.7Å; F215-F219 HydrophobicContact CE1-CD2 4.1Å; F215-F219 AromaticContact CE1-CE2 3.76Å; F215-F219 HydrophobicContact CE1-CE2 3.76Å; F215-F219 PolarHBondContact O-N 3.45Å; F219-S223 WeakPolarHBondContact CB-OG 3.18Å; F219-S223 PolarHBondContact O-OG 3.36Å; F219-F227 HydrophobicContact CB-CE2 4.13Å; F219-F227 HydrophobicContact CD1-CZ 4.38Å; F219-F227 HydrophobicContact CG-CE2 4.27Å; F219-F227 HydrophobicContact CG-CZ 4.4Å; F219-F243 HydrophobicContact CE1-CZ 4.21Å; F219-F243 HydrophobicContact CE2-CE2 4.45Å; F219-F243 HydrophobicContact CE2-CZ 4.11Å; F219-F243 HydrophobicContact CZ-CE1 4.21Å; F219-F243 HydrophobicContact CZ-CE2 4.12Å; F219-F243 AromaticContact CZ-CZ 3.41Å; F219-F243 HydrophobicContact CZ-CZ 3.41Å; F219-F243 VanDerWaalsContact CZ-CZ 3.41Å |
| 220 | S | 72.5 | Confident | 79 | Confident | 73 Ų | 73 | 72 Ų | 72 | 51% | 0.51 | 37% | 0.374 | S | S | . | . | trans | 71.3 | 146.1 | -167.9 | -48.5 | 0 | 0 | 0 | 0 | 112.4 | A216 E222 S223 | A216-S220 CarbonylContact O-C 3.45Å; A216-S220 VanDerWaalsContact O-CA 3.3Å; A216-S220 WeakPolarHBondContact O-CA 3.33Å; A216-S220 PolarHBondContact O-N 3.48Å; S220-E222 PolarHBondContact O-N 3.39Å; S220-E222 VanDerWaalsContact O-N 3.16Å; S220-S223 PolarHBondContact O-N 3.26Å; S220-S223 PolarHBondContact O-OG 2.9Å | ||
| 221 | P | 70 | Confident | 79.2 | Confident | 91 Ų | 91 | 74 Ų | 74 | 59% | 0.591 | 38% | 0.384 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.7 | -26.2 | -177.2 | 23.7 | -34 | 0 | 0 | 0 | 113.3 | A216 S223 I224 | A216-P221 HydrophobicContact CB-CB 4.26Å; P221-S223 VanDerWaalsContact C-N 3.28Å; P221-S223 PolarHBondContact O-N 2.91Å; P221-I224 PolarHBondContact O-N 3.38Å |
| 222 | E | 68.2 | Low | 79.4 | Confident | 170 Ų | 170 | 74.9 Ų | 74.9 | 79% | 0.794 | 39% | 0.393 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70 | -19.3 | -179.2 | -64 | -177.6 | 174.8 | 0 | 0 | 114 | S220 P225 | S220-E222 PolarHBondContact O-N 3.39Å; S220-E222 VanDerWaalsContact O-N 3.16Å; E222-P225 WeakPolarHBondContact O-CD 3.35Å; E222-P225 WeakPolarHBondContact O-CG 3.3Å |
| 223 | S | 72.7 | Confident | 79.6 | Confident | 22 Ų | 22 | 75.2 Ų | 75.2 | 15% | 0.154 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -80.2 | -22.1 | -179.6 | 67.2 | 0 | 0 | 0 | 0 | 113.3 | F219 S220 P221 W226 F227 | F219-S223 WeakPolarHBondContact CB-OG 3.18Å; F219-S223 PolarHBondContact O-OG 3.36Å; S220-S223 PolarHBondContact O-N 3.26Å; S220-S223 PolarHBondContact O-OG 2.9Å; P221-S223 VanDerWaalsContact C-N 3.28Å; P221-S223 PolarHBondContact O-N 2.91Å; S223-W226 WeakPolarHBondContact O-CB 3.43Å; S223-W226 PolarHBondContact O-N 3.16Å; S223-F227 WeakPolarHBondContact O-CD2 3.42Å; S223-F227 WeakPolarHBondContact O-CG 3.27Å; S223-F227 PolarHBondContact O-N 2.7Å; S223-F227 WeakPolarHBondContact OG-CE2 3.44Å |
| 224 | I | 74.4 | Confident | 79.7 | Confident | 25 Ų | 25 | 75 Ų | 75 | 13% | 0.128 | 41% | 0.41 | C | S | . | . | H | α-helix | trans | -58.7 | -52.5 | -177.6 | -58.9 | 174.5 | 0 | 0 | 0 | 112 | E212 A216 P221 W226 F227 E228 W235 | E212-I224 HydrophobicContact CB-CD1 4.47Å; A216-I224 HydrophobicContact CB-CD1 3.91Å; P221-I224 PolarHBondContact O-N 3.38Å; I224-W226 PolarHBondContact O-N 2.94Å; I224-F227 PolarHBondContact O-N 3.13Å; I224-F227 VanDerWaalsContact O-N 3.09Å; I224-E228 PolarHBondContact O-N 3.26Å; I224-W235 HydrophobicContact CG2-CZ2 4.17Å |
| 225 | P | 77.1 | Confident | 79.8 | Confident | 75 Ų | 75 | 73.7 Ų | 73.7 | 49% | 0.487 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -62.4 | -31.3 | 178.3 | 24 | -35 | 0 | 0 | 0 | 112.2 | E222 E228 V229 | E222-P225 WeakPolarHBondContact O-CD 3.35Å; E222-P225 WeakPolarHBondContact O-CG 3.3Å; P225-E228 PolarHBondContact O-N 2.82Å; P225-V229 WeakPolarHBondContact O-CB 3.25Å; P225-V229 VanDerWaalsContact O-CG2 3.25Å; P225-V229 WeakPolarHBondContact O-CG2 3.37Å; P225-V229 PolarHBondContact O-N 2.81Å |
| 226 | W | 78.4 | Confident | 80.1 | Confident | 118 Ų | 118 | 74.4 Ų | 74.4 | 45% | 0.447 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -66.8 | -41.6 | 175 | -175.9 | 86.2 | 0 | 0 | 0 | 112 | Y134 S223 I224 V229 T230 | Y134-W226 AromaticContact CZ-NE1 3.71Å; Y134-W226 PolarHBondContact OH-NE1 3.34Å; S223-W226 WeakPolarHBondContact O-CB 3.43Å; S223-W226 PolarHBondContact O-N 3.16Å; I224-W226 PolarHBondContact O-N 2.94Å; W226-V229 PolarHBondContact O-N 3.22Å; W226-T230 HydrophobicContact CD2-CG2 4.14Å; W226-T230 HydrophobicContact CH2-CG2 4.45Å; W226-T230 HydrophobicContact CZ2-CG2 3.99Å; W226-T230 WeakPolarHBondContact O-CB 3.19Å; W226-T230 WeakPolarHBondContact O-CG2 3.44Å; W226-T230 PolarHBondContact O-N 3.15Å; W226-T230 PolarHBondContact O-OG1 3.33Å |
| 227 | F | 80.8 | Confident | 80.4 | Confident | 18 Ų | 18 | 78.6 Ų | 78.6 | 8% | 0.079 | 42% | 0.418 | C | S | . | . | H | α-helix | trans | -64.5 | -41 | 175.1 | -67.4 | -49 | 0 | 0 | 0 | 112.2 | F219 S223 I224 T230 L231 W235 L239 | F219-F227 HydrophobicContact CB-CE2 4.13Å; F219-F227 HydrophobicContact CD1-CZ 4.38Å; F219-F227 HydrophobicContact CG-CE2 4.27Å; F219-F227 HydrophobicContact CG-CZ 4.4Å; S223-F227 WeakPolarHBondContact O-CD2 3.42Å; S223-F227 WeakPolarHBondContact O-CG 3.27Å; S223-F227 PolarHBondContact O-N 2.7Å; S223-F227 WeakPolarHBondContact OG-CE2 3.44Å; I224-F227 PolarHBondContact O-N 3.13Å; I224-F227 VanDerWaalsContact O-N 3.09Å; F227-T230 WeakPolarHBondContact CA-OG1 3.34Å; F227-T230 PolarHBondContact O-N 2.96Å; F227-T230 PolarHBondContact O-OG1 3.49Å; F227-L231 HydrophobicContact CD1-CD1 4.35Å; F227-L231 WeakPolarHBondContact O-CB 3.4Å; F227-L231 PolarHBondContact O-N 2.67Å; F227-W235 HydrophobicContact CB-CB 4.1Å; F227-W235 HydrophobicContact CB-CD2 3.89Å; F227-W235 HydrophobicContact CB-CE3 3.77Å; F227-W235 HydrophobicContact CB-CG 4.04Å; F227-W235 HydrophobicContact CD2-CE3 4.09Å; F227-W235 HydrophobicContact CD2-CZ3 4.05Å; F227-W235 HydrophobicContact CG-CE3 4.11Å; F227-L239 HydrophobicContact CD1-CD1 4.27Å; F227-L239 HydrophobicContact CD1-CD2 4.16Å; F227-L239 HydrophobicContact CD2-CD1 4.18Å; F227-L239 HydrophobicContact CE1-CD1 4.24Å; F227-L239 HydrophobicContact CE1-CD2 3.89Å; F227-L239 HydrophobicContact CE2-CD1 4.15Å; F227-L239 HydrophobicContact CG-CD1 4.27Å; F227-L239 HydrophobicContact CZ-CD1 4.19Å; F227-L239 HydrophobicContact CZ-CD2 4.41Å |
| 228 | E | 83.3 | Confident | 80.8 | Confident | 111 Ų | 111 | 72.2 Ų | 72.2 | 52% | 0.519 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -65.8 | -40.8 | 179 | -169.7 | 173.8 | -175.3 | 0 | 0 | 112 | I224 P225 G232 | I224-E228 PolarHBondContact O-N 3.26Å; P225-E228 PolarHBondContact O-N 2.82Å; E228-G232 CarbonylContact O-C 3.55Å; E228-G232 WeakPolarHBondContact O-CA 3.36Å; E228-G232 PolarHBondContact O-N 2.76Å |
| 229 | V | 85.3 | Confident | 81.1 | Confident | 127 Ų | 127 | 68.7 Ų | 68.7 | 77% | 0.77 | 38% | 0.376 | S | S | * | . | H | α-helix | trans | -67.8 | -36.3 | 176.2 | 171.9 | 0 | 0 | 0 | 0 | 112 | P225 W226 | P225-V229 WeakPolarHBondContact O-CB 3.25Å; P225-V229 VanDerWaalsContact O-CG2 3.25Å; P225-V229 WeakPolarHBondContact O-CG2 3.37Å; P225-V229 PolarHBondContact O-N 2.81Å; W226-V229 PolarHBondContact O-N 3.22Å |
| 230 | T | 85.2 | Confident | 81.9 | Confident | 72 Ų | 72 | 65.9 Ų | 65.9 | 44% | 0.442 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -87.5 | -37.2 | -174.4 | 50.8 | 0 | 0 | 0 | 0 | 114.2 | W226 F227 | W226-T230 HydrophobicContact CD2-CG2 4.14Å; W226-T230 HydrophobicContact CH2-CG2 4.45Å; W226-T230 HydrophobicContact CZ2-CG2 3.99Å; W226-T230 WeakPolarHBondContact O-CB 3.19Å; W226-T230 WeakPolarHBondContact O-CG2 3.44Å; W226-T230 PolarHBondContact O-N 3.15Å; W226-T230 PolarHBondContact O-OG1 3.33Å; F227-T230 WeakPolarHBondContact CA-OG1 3.34Å; F227-T230 PolarHBondContact O-N 2.96Å; F227-T230 PolarHBondContact O-OG1 3.49Å |
| 231 | L | 86 | Confident | 82.8 | Confident | 49 Ų | 49 | 64.9 Ų | 64.9 | 26% | 0.257 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -109.7 | -7.8 | -174 | -58.5 | 173.2 | 0 | 0 | 0 | 112.8 | F227 W235 C238 L239 I242 | F227-L231 HydrophobicContact CD1-CD1 4.35Å; F227-L231 WeakPolarHBondContact O-CB 3.4Å; F227-L231 PolarHBondContact O-N 2.67Å; L231-W235 HydrophobicContact CB-CB 3.68Å; L231-W235 HydrophobicContact CD1-CB 4.14Å; L231-W235 HydrophobicContact CG-CB 4.5Å; L231-C238 HydrophobicContact CB-CB 3.99Å; L231-C238 HydrophobicContact CD1-CB 3.86Å; L231-C238 HydrophobicContact CD2-CB 3.96Å; L231-C238 HydrophobicContact CG-CB 4.15Å; L231-L239 HydrophobicContact CD1-CD2 4.02Å; L231-L239 HydrophobicContact CD1-CG 3.97Å; L231-I242 HydrophobicContact CD1-CD1 4.4Å; L231-I242 HydrophobicContact CD2-CD1 4.17Å |
| 232 | G | 86.4 | Confident | 83.8 | Confident | 23 Ų | 23 | 64.1 Ų | 64.1 | 24% | 0.237 | 35% | 0.345 | C | S | . | . | trans | 80.3 | -170.8 | -176.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | E228 I234 W235 | E228-G232 CarbonylContact O-C 3.55Å; E228-G232 WeakPolarHBondContact O-CA 3.36Å; E228-G232 PolarHBondContact O-N 2.76Å; G232-I234 PolarHBondContact O-N 2.88Å; G232-I234 VanDerWaalsContact O-N 3.1Å; G232-W235 WeakPolarHBondContact O-CB 3.42Å; G232-W235 PolarHBondContact O-N 3.49Å; G232-W235 VanDerWaalsContact O-N 3.09Å | ||
| 233 | P | 81.9 | Confident | 85 | Confident | 113 Ų | 113 | 57.6 Ų | 57.6 | 73% | 0.734 | 31% | 0.314 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65 | -18.1 | -175.2 | 25.7 | -35 | 0 | 0 | 0 | 113.8 | W235 | P233-W235 VanDerWaalsContact C-N 3.33Š|
| 234 | I | 85.7 | Confident | 85.9 | Confident | 108 Ų | 108 | 60.4 Ų | 60.4 | 55% | 0.554 | 33% | 0.328 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -95.7 | 24.6 | 176.9 | 59.8 | 167.2 | 0 | 0 | 0 | 112.8 | G232 P236 F237 C238 | G232-I234 PolarHBondContact O-N 2.88Å; G232-I234 VanDerWaalsContact O-N 3.1Å; I234-P236 VanDerWaalsContact C-N 3.32Å; I234-P236 VanDerWaalsContact O-N 3.17Å; I234-F237 WeakPolarHBondContact O-CB 3.49Å; I234-F237 PolarHBondContact O-N 2.86Å; I234-C238 PolarHBondContact O-N 3.35Å |
| 235 | W | 88.2 | Confident | 86.8 | Confident | 13 Ų | 13 | 65.7 Ų | 65.7 | 5% | 0.049 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -52 | -35.2 | -176.6 | 71 | -93.6 | 0 | 0 | 0 | 115.5 | F215 I224 F227 L231 G232 P233 F237 C238 L239 | F215-W235 HydrophobicContact CB-CH2 3.59Å; F215-W235 HydrophobicContact CB-CZ3 4.17Å; F215-W235 AromaticContact CD1-CH2 3.98Å; F215-W235 HydrophobicContact CD1-CH2 3.98Å; F215-W235 AromaticContact CD1-CZ3 3.71Å; F215-W235 HydrophobicContact CD1-CZ3 3.71Å; F215-W235 AromaticContact CD2-CH2 3.4Å; F215-W235 HydrophobicContact CD2-CH2 3.4Å; F215-W235 VanDerWaalsContact CD2-CH2 3.4Å; F215-W235 HydrophobicContact CD2-CZ2 4.48Å; F215-W235 AromaticContact CD2-CZ3 3.77Å; F215-W235 HydrophobicContact CD2-CZ3 3.77Å; F215-W235 HydrophobicContact CE1-CZ3 4.03Å; F215-W235 HydrophobicContact CE2-CH2 4.08Å; F215-W235 HydrophobicContact CE2-CZ3 4.07Å; F215-W235 AromaticContact CG-CH2 3.38Å; F215-W235 HydrophobicContact CG-CH2 3.38Å; F215-W235 AromaticContact CG-CZ3 3.62Å; F215-W235 HydrophobicContact CG-CZ3 3.62Å; F215-W235 HydrophobicContact CZ-CZ3 4.2Å; I224-W235 HydrophobicContact CG2-CZ2 4.17Å; F227-W235 HydrophobicContact CB-CB 4.1Å; F227-W235 HydrophobicContact CB-CD2 3.89Å; F227-W235 HydrophobicContact CB-CE3 3.77Å; F227-W235 HydrophobicContact CB-CG 4.04Å; F227-W235 HydrophobicContact CD2-CE3 4.09Å; F227-W235 HydrophobicContact CD2-CZ3 4.05Å; F227-W235 HydrophobicContact CG-CE3 4.11Å; L231-W235 HydrophobicContact CB-CB 3.68Å; L231-W235 HydrophobicContact CD1-CB 4.14Å; L231-W235 HydrophobicContact CG-CB 4.5Å; G232-W235 WeakPolarHBondContact O-CB 3.42Å; G232-W235 PolarHBondContact O-N 3.49Å; G232-W235 VanDerWaalsContact O-N 3.09Å; P233-W235 VanDerWaalsContact C-N 3.33Å; W235-F237 VanDerWaalsContact C-N 3.32Å; W235-F237 PolarHBondContact O-N 2.97Å; W235-C238 PolarHBondContact O-N 3.05Å; W235-L239 HydrophobicContact CE3-CD1 3.48Å; W235-L239 VanDerWaalsContact CE3-CD1 3.48Å; W235-L239 HydrophobicContact CE3-CG 4.2Å; W235-L239 HydrophobicContact CZ3-CD1 3.49Å; W235-L239 VanDerWaalsContact CZ3-CD1 3.49Å; W235-L239 PolarHBondContact O-N 3.26Å |
| 236 | P | 87 | Confident | 87.5 | Confident | 14 Ų | 14 | 65.7 Ų | 65.7 | 9% | 0.091 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -65.6 | -35.9 | 178.7 | -20.9 | 34.9 | 0 | 0 | 0 | 112.1 | T200 M204 F215 I234 L239 A240 | T200-P236 HydrophobicContact CG2-CB 4.46Å; T200-P236 WeakPolarHBondContact CG2-O 3.32Å; M204-P236 HydrophobicContact CG-CB 3.73Å; M204-P236 VanDerWaalsContact SD-C 3.56Å; M204-P236 HydrophobicContact SD-CB 3.9Å; F215-P236 HydrophobicContact CE2-CB 4.38Å; I234-P236 VanDerWaalsContact C-N 3.32Å; I234-P236 VanDerWaalsContact O-N 3.17Å; P236-L239 PolarHBondContact O-N 2.67Å; P236-A240 PolarHBondContact O-N 3.32Å |
| 237 | F | 87.4 | Confident | 88.2 | Confident | 118 Ų | 118 | 60.2 Ų | 60.2 | 52% | 0.518 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -66.9 | -46.1 | 176.7 | 175.5 | -101.9 | 0 | 0 | 0 | 110.6 | M204 I234 W235 L239 A240 V241 | M204-F237 WeakPolarHBondContact SD-CA 3.38Å; M204-F237 HydrophobicContact SD-CB 3.82Å; M204-F237 PolarHBondContact SD-N 3.45Å; I234-F237 WeakPolarHBondContact O-CB 3.49Å; I234-F237 PolarHBondContact O-N 2.86Å; W235-F237 VanDerWaalsContact C-N 3.32Å; W235-F237 PolarHBondContact O-N 2.97Å; F237-L239 VanDerWaalsContact C-N 3.28Å; F237-L239 PolarHBondContact O-N 2.61Å; F237-A240 WeakPolarHBondContact O-CB 3.32Å; F237-A240 PolarHBondContact O-N 3.33Å; F237-A240 VanDerWaalsContact O-N 3.16Å; F237-V241 HydrophobicContact CD1-CG2 4.39Å; F237-V241 HydrophobicContact CE1-CG2 3.95Å; F237-V241 HydrophobicContact CE2-CG2 4.25Å; F237-V241 HydrophobicContact CZ-CG2 3.87Å; F237-V241 WeakPolarHBondContact O-CG2 3.35Å; F237-V241 PolarHBondContact O-N 3.17Å |
| 238 | C | 90.6 | Very high | 88.7 | Confident | 30 Ų | 30 | 61.7 Ų | 61.7 | 20% | 0.203 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -58.6 | -40.9 | 175.9 | -65 | 0 | 0 | 0 | 0 | 111.7 | L231 I234 W235 V241 I242 | L231-C238 HydrophobicContact CB-CB 3.99Å; L231-C238 HydrophobicContact CD1-CB 3.86Å; L231-C238 HydrophobicContact CD2-CB 3.96Å; L231-C238 HydrophobicContact CG-CB 4.15Å; I234-C238 PolarHBondContact O-N 3.35Å; W235-C238 PolarHBondContact O-N 3.05Å; C238-V241 PolarHBondContact O-N 3.44Å; C238-I242 VanDerWaalsContact O-CG1 3.25Å; C238-I242 WeakPolarHBondContact O-CG1 3.16Å; C238-I242 PolarHBondContact O-N 3.45Å |
| 239 | L | 88.6 | Confident | 89.2 | Confident | 8 Ų | 8 | 60.4 Ų | 60.4 | 4% | 0.042 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -63.8 | -42.5 | 174.8 | -79.1 | -175.9 | 0 | 0 | 0 | 113.1 | F215 F227 L231 W235 P236 F237 V241 I242 F243 | F215-L239 HydrophobicContact CD1-CD1 4.22Å; F215-L239 HydrophobicContact CE1-CD1 3.75Å; F215-L239 HydrophobicContact CZ-CD1 4.35Å; F227-L239 HydrophobicContact CD1-CD1 4.27Å; F227-L239 HydrophobicContact CD1-CD2 4.16Å; F227-L239 HydrophobicContact CD2-CD1 4.18Å; F227-L239 HydrophobicContact CE1-CD1 4.24Å; F227-L239 HydrophobicContact CE1-CD2 3.89Å; F227-L239 HydrophobicContact CE2-CD1 4.15Å; F227-L239 HydrophobicContact CG-CD1 4.27Å; F227-L239 HydrophobicContact CZ-CD1 4.19Å; F227-L239 HydrophobicContact CZ-CD2 4.41Å; L231-L239 HydrophobicContact CD1-CD2 4.02Å; L231-L239 HydrophobicContact CD1-CG 3.97Å; W235-L239 HydrophobicContact CE3-CD1 3.48Å; W235-L239 VanDerWaalsContact CE3-CD1 3.48Å; W235-L239 HydrophobicContact CE3-CG 4.2Å; W235-L239 HydrophobicContact CZ3-CD1 3.49Å; W235-L239 VanDerWaalsContact CZ3-CD1 3.49Å; W235-L239 PolarHBondContact O-N 3.26Å; P236-L239 PolarHBondContact O-N 2.67Å; F237-L239 VanDerWaalsContact C-N 3.28Å; F237-L239 PolarHBondContact O-N 2.61Å; L239-V241 VanDerWaalsContact C-N 3.27Å; L239-V241 PolarHBondContact O-N 2.89Å; L239-I242 HydrophobicContact CD2-CD1 4.5Å; L239-I242 PolarHBondContact O-N 3.04Å; L239-F243 HydrophobicContact CB-CE2 4Å; L239-F243 HydrophobicContact CB-CZ 4.39Å; L239-F243 HydrophobicContact CD2-CZ 4.14Å; L239-F243 WeakPolarHBondContact O-CD2 2.98Å; L239-F243 VanDerWaalsContact O-CG 3.27Å; L239-F243 WeakPolarHBondContact O-CG 3.41Å; L239-F243 PolarHBondContact O-N 3.32Å |
| 240 | A | 90 | Very high | 89.5 | Confident | 6 Ų | 6 | 55.1 Ų | 55.1 | 5% | 0.05 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -58 | -43.1 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | T200 V201 M204 P236 F237 F243 N244 | T200-A240 HydrophobicContact CG2-CB 3.7Å; V201-A240 HydrophobicContact CG2-CB 4.09Å; M204-A240 HydrophobicContact CE-CB 3.87Å; P236-A240 PolarHBondContact O-N 3.32Å; F237-A240 WeakPolarHBondContact O-CB 3.32Å; F237-A240 PolarHBondContact O-N 3.33Å; F237-A240 VanDerWaalsContact O-N 3.16Å; A240-F243 PolarHBondContact O-N 3.41Å; A240-N244 WeakPolarHBondContact O-CB 3.48Å; A240-N244 PolarHBondContact O-N 3Å |
| 241 | V | 92.1 | Very high | 89.8 | Confident | 52 Ų | 52 | 55.3 Ų | 55.3 | 32% | 0.315 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -64.3 | -45.9 | 177.9 | 174.4 | 0 | 0 | 0 | 0 | 110.6 | F237 C238 L239 F243 N244 F245 | F237-V241 HydrophobicContact CD1-CG2 4.39Å; F237-V241 HydrophobicContact CE1-CG2 3.95Å; F237-V241 HydrophobicContact CE2-CG2 4.25Å; F237-V241 HydrophobicContact CZ-CG2 3.87Å; F237-V241 WeakPolarHBondContact O-CG2 3.35Å; F237-V241 PolarHBondContact O-N 3.17Å; C238-V241 PolarHBondContact O-N 3.44Å; L239-V241 VanDerWaalsContact C-N 3.27Å; L239-V241 PolarHBondContact O-N 2.89Å; V241-F243 PolarHBondContact O-N 2.83Å; V241-N244 PolarHBondContact O-N 3.26Å; V241-F245 HydrophobicContact CG1-CD2 3.55Å; V241-F245 HydrophobicContact CG1-CE2 3.45Å; V241-F245 VanDerWaalsContact CG1-CE2 3.45Å; V241-F245 VanDerWaalsContact O-CD2 3.25Å; V241-F245 WeakPolarHBondContact O-CD2 3.09Å; V241-F245 PolarHBondContact O-N 3.25Å |
| 242 | I | 91.8 | Very high | 90.1 | Very high | 75 Ų | 75 | 60.3 Ų | 60.3 | 39% | 0.385 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -60 | -46.5 | 176.7 | -69 | 163.4 | 0 | 0 | 0 | 111.1 | L231 C238 L239 N244 F245 T246 | L231-I242 HydrophobicContact CD1-CD1 4.4Å; L231-I242 HydrophobicContact CD2-CD1 4.17Å; C238-I242 VanDerWaalsContact O-CG1 3.25Å; C238-I242 WeakPolarHBondContact O-CG1 3.16Å; C238-I242 PolarHBondContact O-N 3.45Å; L239-I242 HydrophobicContact CD2-CD1 4.5Å; L239-I242 PolarHBondContact O-N 3.04Å; I242-N244 VanDerWaalsContact C-N 3.32Å; I242-N244 PolarHBondContact O-N 3.36Å; I242-F245 PolarHBondContact O-N 3.47Å; I242-T246 WeakPolarHBondContact O-CB 3.28Å; I242-T246 PolarHBondContact O-N 2.98Å; I242-T246 PolarHBondContact O-OG1 3.21Å |
| 243 | F | 91.4 | Very high | 90.4 | Very high | 33 Ų | 33 | 60 Ų | 60 | 15% | 0.145 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -63.8 | -37.9 | 177.3 | -63.4 | -35.4 | 0 | 0 | 0 | 112.3 | M196 T197 F219 L239 A240 V241 T246 A247 | M196-F243 HydrophobicContact CB-CD2 3.87Å; M196-F243 HydrophobicContact CB-CE2 4.22Å; M196-F243 HydrophobicContact CB-CG 4.13Å; M196-F243 HydrophobicContact CE-CE2 4.38Å; M196-F243 HydrophobicContact CE-CZ 4.48Å; T197-F243 VanDerWaalsContact OG1-CB 3.25Å; T197-F243 WeakPolarHBondContact OG1-CB 3.29Å; F219-F243 HydrophobicContact CE1-CZ 4.21Å; F219-F243 HydrophobicContact CE2-CE2 4.45Å; F219-F243 HydrophobicContact CE2-CZ 4.11Å; F219-F243 HydrophobicContact CZ-CE1 4.21Å; F219-F243 HydrophobicContact CZ-CE2 4.12Å; F219-F243 AromaticContact CZ-CZ 3.41Å; F219-F243 HydrophobicContact CZ-CZ 3.41Å; F219-F243 VanDerWaalsContact CZ-CZ 3.41Å; L239-F243 HydrophobicContact CB-CE2 4Å; L239-F243 HydrophobicContact CB-CZ 4.39Å; L239-F243 HydrophobicContact CD2-CZ 4.14Å; L239-F243 WeakPolarHBondContact O-CD2 2.98Å; L239-F243 VanDerWaalsContact O-CG 3.27Å; L239-F243 WeakPolarHBondContact O-CG 3.41Å; L239-F243 PolarHBondContact O-N 3.32Å; A240-F243 PolarHBondContact O-N 3.41Å; V241-F243 PolarHBondContact O-N 2.83Å; F243-T246 PolarHBondContact O-N 3.17Å; F243-A247 WeakPolarHBondContact O-CB 3.37Å; F243-A247 PolarHBondContact O-N 3.44Å |
| 244 | N | 93.2 | Very high | 90.8 | Very high | 81 Ų | 81 | 57.7 Ų | 57.7 | 43% | 0.433 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -64.6 | -48 | 176 | -169 | -72.2 | 0 | 0 | 0 | 111.6 | T197 A240 V241 I242 T246 A247 A248 | T197-N244 HydrophobicContact CG2-CB 4.14Å; T197-N244 PolarHBondContact OG1-N 3.26Å; A240-N244 WeakPolarHBondContact O-CB 3.48Å; A240-N244 PolarHBondContact O-N 3Å; V241-N244 PolarHBondContact O-N 3.26Å; I242-N244 VanDerWaalsContact C-N 3.32Å; I242-N244 PolarHBondContact O-N 3.36Å; N244-T246 VanDerWaalsContact C-N 3.32Å; N244-T246 PolarHBondContact O-N 3.26Å; N244-A247 PolarHBondContact O-N 3.08Å; N244-A248 PolarHBondContact O-N 3.03Å |
| 245 | F | 93.2 | Very high | 91.1 | Very high | 135 Ų | 135 | 55.8 Ų | 55.8 | 59% | 0.592 | 29% | 0.285 | S | S | * | . | H | α-helix | trans | -62.3 | -39.7 | 175.7 | -83.8 | -67.8 | 0 | 0 | 0 | 112.2 | V241 I242 A247 A248 I249 | V241-F245 HydrophobicContact CG1-CD2 3.55Å; V241-F245 HydrophobicContact CG1-CE2 3.45Å; V241-F245 VanDerWaalsContact CG1-CE2 3.45Å; V241-F245 VanDerWaalsContact O-CD2 3.25Å; V241-F245 WeakPolarHBondContact O-CD2 3.09Å; V241-F245 PolarHBondContact O-N 3.25Å; I242-F245 PolarHBondContact O-N 3.47Å; F245-A247 VanDerWaalsContact C-N 3.34Å; F245-A247 PolarHBondContact O-N 2.97Å; F245-A248 PolarHBondContact O-N 3.05Å; F245-I249 VanDerWaalsContact O-CG1 3.29Å; F245-I249 WeakPolarHBondContact O-CG1 3.41Å; F245-I249 PolarHBondContact O-N 3.27Å |
| 246 | T | 91 | Very high | 91.2 | Very high | 76 Ų | 76 | 56.4 Ų | 56.4 | 47% | 0.466 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -62 | -43.5 | 175.8 | -54 | 0 | 0 | 0 | 0 | 110.8 | I242 F243 N244 I249 A250 | I242-T246 WeakPolarHBondContact O-CB 3.28Å; I242-T246 PolarHBondContact O-N 2.98Å; I242-T246 PolarHBondContact O-OG1 3.21Å; F243-T246 PolarHBondContact O-N 3.17Å; N244-T246 VanDerWaalsContact C-N 3.32Å; N244-T246 PolarHBondContact O-N 3.26Å; T246-I249 PolarHBondContact O-N 3.25Å; T246-A250 WeakPolarHBondContact O-CB 3.11Å; T246-A250 PolarHBondContact O-N 3.3Å |
| 247 | A | 92.4 | Very high | 91.3 | Very high | 3 Ų | 3 | 55.7 Ų | 55.7 | 3% | 0.025 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -63.8 | -40.8 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | M194 F243 N244 F245 A250 I251 | M194-A247 HydrophobicContact CG-CB 4.39Å; M194-A247 HydrophobicContact SD-CB 4.11Å; F243-A247 WeakPolarHBondContact O-CB 3.37Å; F243-A247 PolarHBondContact O-N 3.44Å; N244-A247 PolarHBondContact O-N 3.08Å; F245-A247 VanDerWaalsContact C-N 3.34Å; F245-A247 PolarHBondContact O-N 2.97Å; A247-A250 PolarHBondContact O-N 3.16Å; A247-I251 VanDerWaalsContact O-CG1 3.26Å; A247-I251 WeakPolarHBondContact O-CG1 3.25Å; A247-I251 PolarHBondContact O-N 3.4Å |
| 248 | A | 93 | Very high | 91.4 | Very high | 48 Ų | 48 | 55.5 Ų | 55.5 | 40% | 0.397 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -62.7 | -42.8 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | N244 F245 A250 I251 W252 | N244-A248 PolarHBondContact O-N 3.03Å; F245-A248 PolarHBondContact O-N 3.05Å; A248-A250 VanDerWaalsContact C-N 3.35Å; A248-I251 PolarHBondContact O-N 3.29Å; A248-W252 PolarHBondContact O-N 3.48Å |
| 249 | I | 92.3 | Very high | 91.3 | Very high | 85 Ų | 85 | 59.4 Ų | 59.4 | 44% | 0.436 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -62.6 | -43.2 | 174.5 | -67.2 | 164.8 | 0 | 0 | 0 | 110.5 | F245 T246 I251 W252 F253 | F245-I249 VanDerWaalsContact O-CG1 3.29Å; F245-I249 WeakPolarHBondContact O-CG1 3.41Å; F245-I249 PolarHBondContact O-N 3.27Å; T246-I249 PolarHBondContact O-N 3.25Å; I249-I251 PolarHBondContact O-N 3.31Å; I249-W252 WeakPolarHBondContact O-CB 3.41Å; I249-W252 PolarHBondContact O-N 3.25Å; I249-W252 VanDerWaalsContact O-N 3.15Å; I249-F253 HydrophobicContact CG2-CD1 4.45Å; I249-F253 HydrophobicContact CG2-CE1 4.11Å; I249-F253 HydrophobicContact CG2-CE2 4.34Å; I249-F253 HydrophobicContact CG2-CZ 4.04Å; I249-F253 PolarHBondContact O-N 2.99Å |
| 250 | A | 91.2 | Very high | 91.2 | Very high | 15 Ų | 15 | 59 Ų | 59 | 12% | 0.124 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -64 | -39.7 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | V190 T246 A247 A248 W252 F253 Y254 | V190-A250 HydrophobicContact CG2-CB 3.59Å; T246-A250 WeakPolarHBondContact O-CB 3.11Å; T246-A250 PolarHBondContact O-N 3.3Å; A247-A250 PolarHBondContact O-N 3.16Å; A248-A250 VanDerWaalsContact C-N 3.35Å; A250-W252 VanDerWaalsContact C-N 3.32Å; A250-W252 PolarHBondContact O-N 3.22Å; A250-F253 PolarHBondContact O-N 3.09Å; A250-Y254 WeakPolarHBondContact O-CB 3.42Å; A250-Y254 PolarHBondContact O-N 2.7Å |
| 251 | I | 93.4 | Very high | 91.2 | Very high | 77 Ų | 77 | 62.4 Ų | 62.4 | 40% | 0.395 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -61.9 | -42.2 | 172.1 | -68.4 | 164 | 0 | 0 | 0 | 110.3 | V190 A247 A248 I249 Y254 T255 | V190-I251 HydrophobicContact CB-CG1 4.43Å; V190-I251 HydrophobicContact CG1-CD1 4.05Å; V190-I251 HydrophobicContact CG1-CG1 3.71Å; V190-I251 HydrophobicContact CG2-CG1 3.76Å; A247-I251 VanDerWaalsContact O-CG1 3.26Å; A247-I251 WeakPolarHBondContact O-CG1 3.25Å; A247-I251 PolarHBondContact O-N 3.4Å; A248-I251 PolarHBondContact O-N 3.29Å; I249-I251 PolarHBondContact O-N 3.31Å; I251-Y254 PolarHBondContact O-N 3.36Å; I251-T255 HydrophobicContact CG2-CG2 4.37Å; I251-T255 WeakPolarHBondContact O-CG2 3.41Å; I251-T255 PolarHBondContact O-N 2.96Å; I251-T255 PolarHBondContact O-OG1 2.91Å |
| 252 | W | 92.1 | Very high | 91 | Very high | 154 Ų | 154 | 64.3 Ų | 64.3 | 58% | 0.583 | 32% | 0.315 | S | S | * | . | H | α-helix | trans | -61.9 | -45.9 | 178 | -175.5 | 55.7 | 0 | 0 | 0 | 111.5 | A248 I249 A250 Y254 T255 V256 | A248-W252 PolarHBondContact O-N 3.48Å; I249-W252 WeakPolarHBondContact O-CB 3.41Å; I249-W252 PolarHBondContact O-N 3.25Å; I249-W252 VanDerWaalsContact O-N 3.15Å; A250-W252 VanDerWaalsContact C-N 3.32Å; A250-W252 PolarHBondContact O-N 3.22Å; W252-Y254 PolarHBondContact O-N 3.3Å; W252-T255 PolarHBondContact O-N 2.88Å; W252-T255 PolarHBondContact O-OG1 3.05Å; W252-V256 PolarHBondContact O-N 3.02Å |
| 253 | F | 91.2 | Very high | 90.7 | Very high | 17 Ų | 17 | 62.5 Ų | 62.5 | 8% | 0.075 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -60.6 | -44.8 | 174.5 | -70.8 | 0.4 | 0 | 0 | 0 | 112.1 | I116 V119 E120 L123 I249 A250 T255 V256 V257 | I116-F253 HydrophobicContact CB-CD1 4.5Å; I116-F253 HydrophobicContact CD1-CD1 4.18Å; I116-F253 HydrophobicContact CG1-CD1 4.19Å; I116-F253 HydrophobicContact CG1-CE1 4.27Å; I116-F253 HydrophobicContact CG2-CB 3.99Å; I116-F253 HydrophobicContact CG2-CD1 3.57Å; I116-F253 HydrophobicContact CG2-CD2 3.86Å; I116-F253 HydrophobicContact CG2-CE1 3.9Å; I116-F253 HydrophobicContact CG2-CE2 4.17Å; I116-F253 HydrophobicContact CG2-CG 3.55Å; I116-F253 HydrophobicContact CG2-CZ 4.19Å; V119-F253 HydrophobicContact CG1-CZ 3.98Å; E120-F253 HydrophobicContact CB-CE2 4.39Å; L123-F253 HydrophobicContact CD1-CE2 4.25Å; L123-F253 HydrophobicContact CD1-CZ 4.37Å; I249-F253 HydrophobicContact CG2-CD1 4.45Å; I249-F253 HydrophobicContact CG2-CE1 4.11Å; I249-F253 HydrophobicContact CG2-CE2 4.34Å; I249-F253 HydrophobicContact CG2-CZ 4.04Å; I249-F253 PolarHBondContact O-N 2.99Å; A250-F253 PolarHBondContact O-N 3.09Å; F253-T255 VanDerWaalsContact C-N 3.34Å; F253-T255 PolarHBondContact O-N 3.35Å; F253-V256 PolarHBondContact O-N 2.95Å; F253-V257 WeakPolarHBondContact O-CG2 3.47Å; F253-V257 PolarHBondContact O-N 3.36Å |
| 254 | Y | 92 | Very high | 90.4 | Very high | 63 Ų | 63 | 61.2 Ų | 61.2 | 25% | 0.247 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -58.9 | -43.2 | 177.3 | 176.9 | -97.9 | 0 | 0 | 0 | 112.9 | M183 Q186 A250 I251 W252 V256 V257 K258 | M183-Y254 HydrophobicContact CB-CD2 4.34Å; M183-Y254 HydrophobicContact CB-CE2 3.98Å; M183-Y254 HydrophobicContact CG-CD2 4.46Å; M183-Y254 HydrophobicContact CG-CE2 4.27Å; Q186-Y254 HydrophobicContact CB-CD2 4.39Å; A250-Y254 WeakPolarHBondContact O-CB 3.42Å; A250-Y254 PolarHBondContact O-N 2.7Å; I251-Y254 PolarHBondContact O-N 3.36Å; W252-Y254 PolarHBondContact O-N 3.3Å; Y254-V256 PolarHBondContact O-N 3.03Å; Y254-V257 PolarHBondContact O-N 3.49Å; Y254-K258 HydrophobicContact CE1-CD 3.93Å; Y254-K258 WeakPolarHBondContact O-CB 3.33Å; Y254-K258 PolarHBondContact O-N 2.96Å |
| 255 | T | 91 | Very high | 90.1 | Very high | 68 Ų | 68 | 59.9 Ų | 59.9 | 42% | 0.417 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -64.6 | -38.8 | 179.5 | 51.9 | 0 | 0 | 0 | 0 | 112.4 | I251 W252 F253 H259 | I251-T255 HydrophobicContact CG2-CG2 4.37Å; I251-T255 WeakPolarHBondContact O-CG2 3.41Å; I251-T255 PolarHBondContact O-N 2.96Å; I251-T255 PolarHBondContact O-OG1 2.91Å; W252-T255 PolarHBondContact O-N 2.88Å; W252-T255 PolarHBondContact O-OG1 3.05Å; F253-T255 VanDerWaalsContact C-N 3.34Å; F253-T255 PolarHBondContact O-N 3.35Å; T255-H259 WeakPolarHBondContact O-CB 3.4Å; T255-H259 PolarHBondContact O-N 3.2Å |
| 256 | V | 90.4 | Very high | 89.7 | Confident | 26 Ų | 26 | 54.9 Ų | 54.9 | 16% | 0.158 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -69.6 | -45.5 | 176.9 | 178.4 | 0 | 0 | 0 | 0 | 111.6 | A112 I116 W252 F253 Y254 K258 H259 C260 | A112-V256 HydrophobicContact CB-CG1 3.84Å; I116-V256 HydrophobicContact CD1-CB 3.36Å; I116-V256 HydrophobicContact CD1-CG1 3.41Å; I116-V256 VanDerWaalsContact CD1-CG1 3.41Å; I116-V256 HydrophobicContact CD1-CG2 3.59Å; W252-V256 PolarHBondContact O-N 3.02Å; F253-V256 PolarHBondContact O-N 2.95Å; Y254-V256 PolarHBondContact O-N 3.03Å; V256-K258 VanDerWaalsContact C-N 3.34Å; V256-K258 PolarHBondContact O-N 3.05Å; V256-H259 WeakPolarHBondContact O-CB 3.4Å; V256-H259 PolarHBondContact O-N 3.43Å; V256-C260 PolarHBondContact O-N 3.41Å |
| 257 | V | 89.3 | Confident | 89.2 | Confident | 0 Ų | 0 | 56.5 Ų | 56.5 | 0% | 0 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -62 | -43 | 176.7 | 177.2 | 0 | 0 | 0 | 0 | 110.7 | T113 L167 L179 M183 F253 Y254 H259 C260 Y261 | T113-V257 HydrophobicContact CG2-CG2 4.11Å; L167-V257 HydrophobicContact CD1-CG1 4.17Å; L167-V257 HydrophobicContact CD1-CG2 3.91Å; L179-V257 HydrophobicContact CD2-CG1 4.24Å; M183-V257 HydrophobicContact CG-CG1 3.69Å; M183-V257 HydrophobicContact SD-CG1 4.37Å; F253-V257 WeakPolarHBondContact O-CG2 3.47Å; F253-V257 PolarHBondContact O-N 3.36Å; Y254-V257 PolarHBondContact O-N 3.49Å; V257-H259 VanDerWaalsContact C-N 3.31Å; V257-H259 PolarHBondContact O-N 3.3Å; V257-C260 WeakPolarHBondContact O-CB 3.37Å; V257-C260 PolarHBondContact O-N 3.36Å; V257-Y261 PolarHBondContact O-N 3.12Å |
| 258 | K | 90.1 | Very high | 88.6 | Confident | 114 Ų | 114 | 59 Ų | 59 | 50% | 0.496 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -62 | -38.5 | 175.5 | -177.2 | 178.4 | 178.3 | -177.8 | 0 | 111.9 | M183 Y254 V256 Y261 H262 | M183-K258 HydrophobicContact SD-CB 4.4Å; Y254-K258 HydrophobicContact CE1-CD 3.93Å; Y254-K258 WeakPolarHBondContact O-CB 3.33Å; Y254-K258 PolarHBondContact O-N 2.96Å; V256-K258 VanDerWaalsContact C-N 3.34Å; V256-K258 PolarHBondContact O-N 3.05Å; K258-Y261 PolarHBondContact O-N 3.4Å; K258-H262 PolarHBondContact O-N 2.95Å |
| 259 | H | 87.2 | Confident | 87.8 | Confident | 112 Ų | 112 | 61.5 Ų | 61.5 | 52% | 0.519 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -64.7 | -41.8 | 175.4 | -165.4 | 69.6 | 0 | 0 | 0 | 111.4 | T255 V256 V257 H262 D263 | T255-H259 WeakPolarHBondContact O-CB 3.4Å; T255-H259 PolarHBondContact O-N 3.2Å; V256-H259 WeakPolarHBondContact O-CB 3.4Å; V256-H259 PolarHBondContact O-N 3.43Å; V257-H259 VanDerWaalsContact C-N 3.31Å; V257-H259 PolarHBondContact O-N 3.3Å; H259-H262 PolarHBondContact O-N 3.31Å; H259-D263 WeakPolarHBondContact O-CB 3.46Å; H259-D263 PolarHBondContact O-N 3.45Å |
| 260 | C | 87.7 | Confident | 86.7 | Confident | 0 Ų | 0 | 64.8 Ų | 64.8 | 0% | 0 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -64.6 | -41.8 | 174.6 | -178.6 | 0 | 0 | 0 | 0 | 112.5 | S109 N110 T113 V256 V257 H262 D263 I264 | S109-C260 WeakPolarHBondContact OG-CA 3.34Å; S109-C260 WeakPolarHBondContact OG-CB 3.35Å; S109-C260 PolarHBondContact OG-N 2.9Å; N110-C260 PolarHBondContact OD1-SG 3.37Å; T113-C260 HydrophobicContact CG2-CB 4.32Å; T113-C260 WeakPolarHBondContact OG1-CB 3.29Å; V256-C260 PolarHBondContact O-N 3.41Å; V257-C260 WeakPolarHBondContact O-CB 3.37Å; V257-C260 PolarHBondContact O-N 3.36Å; C260-H262 VanDerWaalsContact C-N 3.33Å; C260-H262 PolarHBondContact O-N 3.37Å; C260-D263 PolarHBondContact O-N 3.02Å; C260-I264 WeakPolarHBondContact O-CB 3.35Å; C260-I264 WeakPolarHBondContact O-CG1 3.44Å; C260-I264 PolarHBondContact O-N 2.88Å |
| 261 | Y | 89.1 | Confident | 85.2 | Confident | 77 Ų | 77 | 68.4 Ų | 68.4 | 30% | 0.302 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -55.9 | -48.5 | 172.9 | 174.8 | -87.8 | 0 | 0 | 0 | 111.4 | P176 L179 M183 V257 K258 I264 N265 | P176-Y261 HydrophobicContact CB-CD2 3.74Å; P176-Y261 HydrophobicContact CB-CE2 3.58Å; P176-Y261 WeakPolarHBondContact O-CD2 3.47Å; P176-Y261 VanDerWaalsContact O-CE2 3.29Å; P176-Y261 WeakPolarHBondContact O-CE2 3.45Å; L179-Y261 HydrophobicContact CB-CD2 4.35Å; M183-Y261 HydrophobicContact CE-CD2 3.73Å; M183-Y261 HydrophobicContact CE-CE2 4.16Å; M183-Y261 HydrophobicContact CE-CG 4Å; V257-Y261 PolarHBondContact O-N 3.12Å; K258-Y261 PolarHBondContact O-N 3.4Å; Y261-I264 PolarHBondContact O-N 3.43Å; Y261-N265 VanDerWaalsContact O-CB 3.31Å; Y261-N265 WeakPolarHBondContact O-CB 3.5Å; Y261-N265 PolarHBondContact O-N 2.9Å |
| 262 | H | 86.8 | Confident | 83.2 | Confident | 92 Ų | 92 | 71 Ų | 71 | 43% | 0.426 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -66 | -40.6 | 178.9 | -175.5 | -67 | 0 | 0 | 0 | 112 | R100 K258 H259 C260 N265 S266 | R100-H262 PolarHBondContact NH2-CE1 3.01Å; K258-H262 PolarHBondContact O-N 2.95Å; H259-H262 PolarHBondContact O-N 3.31Å; C260-H262 VanDerWaalsContact C-N 3.33Å; C260-H262 PolarHBondContact O-N 3.37Å; H262-N265 PolarHBondContact O-N 3.35Å; H262-S266 VanDerWaalsContact O-CB 3.3Å; H262-S266 WeakPolarHBondContact O-CB 3.38Å; H262-S266 PolarHBondContact O-N 3.09Å; H262-S266 PolarHBondContact O-OG 3.44Å |
| 263 | D | 86.6 | Confident | 80.7 | Confident | 36 Ų | 36 | 70.3 Ų | 70.3 | 19% | 0.193 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -60.2 | -50 | 176.2 | 179.7 | 54.4 | 0 | 0 | 0 | 111.4 | H259 C260 N265 S266 K267 | H259-D263 WeakPolarHBondContact O-CB 3.46Å; H259-D263 PolarHBondContact O-N 3.45Å; C260-D263 PolarHBondContact O-N 3.02Å; D263-N265 PolarHBondContact O-N 3.22Å; D263-S266 PolarHBondContact O-N 3.32Å; D263-S266 PolarHBondContact O-OG 3.01Å; D263-K267 WeakPolarHBondContact O-CG 3.45Å; D263-K267 PolarHBondContact O-N 2.9Å; D263-K267 VanDerWaalsContact O-N 3.1Å; D263-K267 WeakPolarHBondContact OD1-CE 3.34Å; D263-K267 IonicContact OD1-NZ 3.98Å; D263-K267 PolarHBondContact OD1-NZ 3.28Å; D263-K267 IonicContact OD2-NZ 2.8Å; D263-K267 PolarHBondContact OD2-NZ 2.95Å |
| 264 | I | 85.3 | Confident | 78.6 | Confident | 6 Ų | 6 | 72.5 Ų | 72.5 | 3% | 0.031 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -62.6 | -43.5 | 177.1 | -65.8 | 170.6 | 0 | 0 | 0 | 111 | K174 P176 C260 Y261 K267 N268 | K174-I264 HydrophobicContact CB-CG2 4.39Å; K174-I264 WeakPolarHBondContact O-CG2 3.14Å; P176-I264 HydrophobicContact CB-CG2 4.32Å; C260-I264 WeakPolarHBondContact O-CB 3.35Å; C260-I264 WeakPolarHBondContact O-CG1 3.44Å; C260-I264 PolarHBondContact O-N 2.88Å; Y261-I264 PolarHBondContact O-N 3.43Å; I264-K267 PolarHBondContact O-N 3.43Å; I264-N268 PolarHBondContact O-N 3.34Å; I264-N268 VanDerWaalsContact O-N 3.07Å; I264-N268 PolarHBondContact O-ND2 3.39Å |
| 265 | N | 86.8 | Confident | 76 | Confident | 54 Ų | 54 | 76.4 Ų | 76.4 | 29% | 0.289 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -63.1 | -46.7 | 179.2 | -160.8 | 78.4 | 0 | 0 | 0 | 111.4 | Y261 H262 D263 K267 N268 D269 | Y261-N265 VanDerWaalsContact O-CB 3.31Å; Y261-N265 WeakPolarHBondContact O-CB 3.5Å; Y261-N265 PolarHBondContact O-N 2.9Å; H262-N265 PolarHBondContact O-N 3.35Å; D263-N265 PolarHBondContact O-N 3.22Å; N265-K267 VanDerWaalsContact C-N 3.26Å; N265-K267 PolarHBondContact O-N 3.15Å; N265-N268 WeakPolarHBondContact O-CB 3.35Å; N265-N268 PolarHBondContact O-N 2.89Å; N265-N268 VanDerWaalsContact O-N 3.08Å; N265-D269 PolarHBondContact ND2-OD2 3.32Å; N265-D269 PolarHBondContact O-N 3.29Å |
| 266 | S | 84.1 | Confident | 73.6 | Confident | 30 Ų | 30 | 79.1 Ų | 79.1 | 21% | 0.21 | 44% | 0.438 | C | S | . | . | H | α-helix | trans | -62.4 | -31.6 | 179 | 74.1 | 0 | 0 | 0 | 0 | 113.5 | H262 D263 Q270 | H262-S266 VanDerWaalsContact O-CB 3.3Å; H262-S266 WeakPolarHBondContact O-CB 3.38Å; H262-S266 PolarHBondContact O-N 3.09Å; H262-S266 PolarHBondContact O-OG 3.44Å; D263-S266 PolarHBondContact O-N 3.32Å; D263-S266 PolarHBondContact O-OG 3.01Å; S266-Q270 WeakPolarHBondContact O-CG 3.25Å; S266-Q270 PolarHBondContact O-N 3.47Å; S266-Q270 VanDerWaalsContact O-N 3.12Å; S266-Q270 PolarHBondContact O-NE2 2.86Å |
| 267 | K | 80.9 | Confident | 71.5 | Confident | 109 Ų | 109 | 81.5 Ų | 81.5 | 47% | 0.474 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -73.1 | -34.5 | 175.2 | -75 | 169.9 | 178.5 | 163.3 | 0 | 112 | D263 I264 N265 S271 | D263-K267 WeakPolarHBondContact O-CG 3.45Å; D263-K267 PolarHBondContact O-N 2.9Å; D263-K267 VanDerWaalsContact O-N 3.1Å; D263-K267 WeakPolarHBondContact OD1-CE 3.34Å; D263-K267 IonicContact OD1-NZ 3.98Å; D263-K267 PolarHBondContact OD1-NZ 3.28Å; D263-K267 IonicContact OD2-NZ 2.8Å; D263-K267 PolarHBondContact OD2-NZ 2.95Å; I264-K267 PolarHBondContact O-N 3.43Å; N265-K267 VanDerWaalsContact C-N 3.26Å; N265-K267 PolarHBondContact O-N 3.15Å; K267-S271 PolarHBondContact O-N 2.87Å |
| 268 | N | 79.4 | Confident | 69.7 | Low | 55 Ų | 55 | 86.5 Ų | 86.5 | 29% | 0.294 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -69.1 | -39.9 | 173.9 | -69.7 | -18.5 | 0 | 0 | 0 | 110.9 | K174 I264 N265 S271 | K174-N268 PolarHBondContact O-ND2 3.11Å; I264-N268 PolarHBondContact O-N 3.34Å; I264-N268 VanDerWaalsContact O-N 3.07Å; I264-N268 PolarHBondContact O-ND2 3.39Å; N265-N268 WeakPolarHBondContact O-CB 3.35Å; N265-N268 PolarHBondContact O-N 2.89Å; N265-N268 VanDerWaalsContact O-N 3.08Å; N268-S271 PolarHBondContact O-N 3.46Å; N268-S271 PolarHBondContact O-OG 3.23Å |
| 269 | D | 77.8 | Confident | 67.5 | Low | 102 Ų | 102 | 86.3 Ų | 86.3 | 55% | 0.545 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -66.4 | -39.4 | 177.5 | -62.4 | -29.9 | 0 | 0 | 0 | 112.2 | N265 S271 L272 | N265-D269 PolarHBondContact ND2-OD2 3.32Å; N265-D269 PolarHBondContact O-N 3.29Å; D269-S271 PolarHBondContact O-N 3.42Å; D269-L272 PolarHBondContact O-N 3.31Å |
| 270 | Q | 68.4 | Low | 65.5 | Low | 153 Ų | 153 | 84.9 Ų | 84.9 | 72% | 0.715 | 50% | 0.5 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.4 | -13.7 | 176 | -77.6 | 175.5 | 68.7 | 0 | 0 | 114.4 | S266 L272 | S266-Q270 WeakPolarHBondContact O-CG 3.25Å; S266-Q270 PolarHBondContact O-N 3.47Å; S266-Q270 VanDerWaalsContact O-N 3.12Å; S266-Q270 PolarHBondContact O-NE2 2.86Å; Q270-L272 VanDerWaalsContact C-N 3.28Å |
| 271 | S | 59.5 | Low | 63.5 | Low | 92 Ų | 92 | 91.7 Ų | 91.7 | 64% | 0.643 | 53% | 0.53 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -82.5 | -3.7 | 178.4 | 71.7 | 0 | 0 | 0 | 0 | 113.7 | K267 N268 D269 | K267-S271 PolarHBondContact O-N 2.87Å; N268-S271 PolarHBondContact O-N 3.46Å; N268-S271 PolarHBondContact O-OG 3.23Å; D269-S271 PolarHBondContact O-N 3.42Å |
| 272 | L | 52.3 | Low | 61.4 | Low | 130 Ų | 130 | 92.3 Ų | 92.3 | 68% | 0.681 | 55% | 0.545 | S | S | * | . | S | Bend | trans | -74.5 | 141.2 | 161.6 | -102.2 | 73.7 | 0 | 0 | 0 | 109.6 | D269 Q270 G274 | D269-L272 PolarHBondContact O-N 3.31Å; Q270-L272 VanDerWaalsContact C-N 3.28Å; L272-G274 VanDerWaalsContact C-N 3.3Å; L272-G274 PolarHBondContact O-N 3.33Å |
| 273 | P | 39.7 | Very low | 59.5 | Low | 140 Ų | 140 | 96.8 Ų | 96.8 | 91% | 0.909 | 56% | 0.559 | S | S | * | * | S | Bend | trans | -69.5 | 88.5 | -178.5 | 30 | -32.8 | 0 | 0 | 0 | 109.9 | ||
| 274 | G | 45.3 | Very low | 57.7 | Low | 63 Ų | 63 | 101.3 Ų | 101.3 | 65% | 0.649 | 58% | 0.577 | S | S | * | * | trans | -132.7 | 98.9 | 171.5 | 0 | 0 | 0 | 0 | 0 | 108.7 | L272 | L272-G274 VanDerWaalsContact C-N 3.3Å; L272-G274 PolarHBondContact O-N 3.33Å | ||
| 275 | D | 37.7 | Very low | 56.1 | Low | 145 Ų | 145 | 110.2 Ų | 110.2 | 78% | 0.775 | 61% | 0.61 | S | S | * | * | trans | 37.7 | 87 | 165.1 | -65.8 | -20.7 | 0 | 0 | 0 | 117.8 | S277 | D275-S277 PolarHBondContact O-N 2.62Š| ||
| 276 | S | 41 | Very low | 54.5 | Low | 126 Ų | 126 | 113.4 Ų | 113.4 | 88% | 0.881 | 63% | 0.627 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.6 | 30.6 | 168.5 | 54.6 | 0 | 0 | 0 | 0 | 114.9 | ||
| 277 | S | 46.4 | Very low | 52.9 | Low | 76 Ų | 76 | 117.3 Ų | 117.3 | 53% | 0.531 | 65% | 0.645 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -96.9 | -10.4 | -170.6 | 81.1 | 0 | 0 | 0 | 0 | 116 | D275 | D275-S277 PolarHBondContact O-N 2.62Š|
| 278 | T | 50.6 | Low | 51.7 | Low | 105 Ų | 105 | 120.6 Ų | 120.6 | 64% | 0.644 | 65% | 0.654 | S | S | * | * | S | Bend | trans | -100.7 | -21.8 | -172.5 | 30.7 | 0 | 0 | 0 | 0 | 115.2 | ||
| 279 | C | 45.8 | Very low | 50.4 | Low | 109 Ų | 109 | 126.4 Ų | 126.4 | 74% | 0.736 | 68% | 0.677 | S | S | * | * | S | Bend | trans | -79.3 | -28.9 | -177.1 | -162.9 | 0 | 0 | 0 | 0 | 113.8 | K281 | C279-K281 PolarHBondContact O-N 3.05Š|
| 280 | S | 44 | Very low | 49.3 | Very low | 82 Ų | 82 | 127.4 Ų | 127.4 | 57% | 0.573 | 69% | 0.686 | S | S | * | * | H | α-helix | trans | -70 | -28.5 | 176.8 | -179.9 | 0 | 0 | 0 | 0 | 113.3 | C282 Y283 F284 | S280-C282 VanDerWaalsContact C-N 3.33Å; S280-C282 PolarHBondContact O-N 3.4Å; S280-Y283 PolarHBondContact O-N 2.97Å; S280-F284 PolarHBondContact O-N 3.09Å |
| 281 | K | 46 | Very low | 48.6 | Very low | 144 Ų | 144 | 129.4 Ų | 129.4 | 63% | 0.626 | 69% | 0.693 | S | S | * | * | H | α-helix | trans | -70.2 | -23.9 | -179 | -83.2 | 175.9 | 179.9 | 165.3 | 0 | 113.8 | C279 R285 | C279-K281 PolarHBondContact O-N 3.05Å; K281-R285 PolarHBondContact O-N 3.48Å |
| 282 | C | 45.4 | Very low | 47.9 | Very low | 90 Ų | 90 | 127.5 Ų | 127.5 | 61% | 0.608 | 69% | 0.687 | S | S | * | * | H | α-helix | trans | -77.7 | -41 | 176.5 | -81.9 | 0 | 0 | 0 | 0 | 112.5 | S280 F284 R285 L286 | S280-C282 VanDerWaalsContact C-N 3.33Å; S280-C282 PolarHBondContact O-N 3.4Å; C282-F284 VanDerWaalsContact C-N 3.35Å; C282-F284 PolarHBondContact O-N 3.05Å; C282-R285 PolarHBondContact O-N 2.99Å; C282-L286 PolarHBondContact O-N 3.1Å |
| 283 | Y | 45.6 | Very low | 47.5 | Very low | 186 Ų | 186 | 128.6 Ų | 128.6 | 73% | 0.729 | 69% | 0.694 | S | S | * | * | H | α-helix | trans | -64.2 | -39.8 | 176.9 | -119.9 | -90.7 | 0 | 0 | 0 | 111.9 | S280 L287 | S280-Y283 PolarHBondContact O-N 2.97Å; Y283-L287 HydrophobicContact CD1-CD1 4.3Å; Y283-L287 PolarHBondContact O-N 3.25Å |
| 284 | F | 48.8 | Very low | 47.6 | Very low | 130 Ų | 130 | 130.1 Ų | 130.1 | 57% | 0.57 | 69% | 0.694 | S | S | * | * | H | α-helix | trans | -72.8 | -30.2 | 179.2 | -125.9 | -83.2 | 0 | 0 | 0 | 113.5 | S280 C282 R288 | S280-F284 PolarHBondContact O-N 3.09Å; C282-F284 VanDerWaalsContact C-N 3.35Å; C282-F284 PolarHBondContact O-N 3.05Å; F284-R288 VanDerWaalsContact O-CB 3.26Å; F284-R288 WeakPolarHBondContact O-CB 3.38Å; F284-R288 PolarHBondContact O-N 2.84Å; F284-R288 VanDerWaalsContact O-N 3.1Å |
| 285 | R | 53.3 | Low | 47.4 | Very low | 193 Ų | 193 | 130.8 Ų | 130.8 | 73% | 0.728 | 70% | 0.701 | S | S | * | * | H | α-helix | trans | -72.5 | -35.5 | 175.8 | -87.6 | -173.7 | -173.6 | 173.3 | 2.8 | 112.9 | K281 C282 K289 | K281-R285 PolarHBondContact O-N 3.48Å; C282-R285 PolarHBondContact O-N 2.99Å; R285-K289 PolarHBondContact O-N 3.05Å; R285-K289 VanDerWaalsContact O-N 3.07Å |
| 286 | L | 51.9 | Low | 47.5 | Very low | 122 Ų | 122 | 130.3 Ų | 130.3 | 64% | 0.639 | 71% | 0.709 | S | S | * | * | H | α-helix | trans | -71.3 | -42.4 | 176.1 | -95.6 | 151.7 | 0 | 0 | 0 | 111.9 | C282 R288 K289 V290 | C282-L286 PolarHBondContact O-N 3.1Å; L286-R288 VanDerWaalsContact C-N 3.28Å; L286-R288 PolarHBondContact O-N 2.88Å; L286-K289 PolarHBondContact O-N 3.26Å; L286-V290 WeakPolarHBondContact O-CG2 3.49Å; L286-V290 PolarHBondContact O-N 2.8Å |
| 287 | L | 51.8 | Low | 47.4 | Very low | 111 Ų | 111 | 127.5 Ų | 127.5 | 58% | 0.581 | 70% | 0.7 | S | S | * | * | H | α-helix | trans | -65.7 | -30.1 | 174.3 | -79.8 | 162.5 | 0 | 0 | 0 | 113 | Y283 K291 | Y283-L287 HydrophobicContact CD1-CD1 4.3Å; Y283-L287 PolarHBondContact O-N 3.25Å; L287-K291 VanDerWaalsContact O-CB 3.3Å; L287-K291 WeakPolarHBondContact O-CB 3.15Å; L287-K291 PolarHBondContact O-N 3.36Å |
| 288 | R | 54.4 | Low | 46.9 | Very low | 179 Ų | 179 | 131.4 Ų | 131.4 | 68% | 0.675 | 72% | 0.715 | S | S | * | * | H | α-helix | trans | -78.4 | -25.9 | 175.4 | -160 | -179.6 | -81.9 | 160.3 | -7 | 113 | F284 L286 | F284-R288 VanDerWaalsContact O-CB 3.26Å; F284-R288 WeakPolarHBondContact O-CB 3.38Å; F284-R288 PolarHBondContact O-N 2.84Å; F284-R288 VanDerWaalsContact O-N 3.1Å; L286-R288 VanDerWaalsContact C-N 3.28Å; L286-R288 PolarHBondContact O-N 2.88Å |
| 289 | K | 52.6 | Low | 46.2 | Very low | 176 Ų | 176 | 132.6 Ų | 132.6 | 77% | 0.765 | 73% | 0.726 | S | S | * | * | H | α-helix | trans | -80.9 | -35.8 | 173.3 | -107.4 | -178 | 174.9 | -177.8 | 0 | 113.3 | R285 L286 K291 | R285-K289 PolarHBondContact O-N 3.05Å; R285-K289 VanDerWaalsContact O-N 3.07Å; L286-K289 PolarHBondContact O-N 3.26Å; K289-K291 VanDerWaalsContact C-N 3.31Å; K289-K291 PolarHBondContact O-N 2.95Å |
| 290 | V | 55.5 | Low | 46 | Very low | 123 Ų | 123 | 133.4 Ų | 133.4 | 75% | 0.745 | 73% | 0.728 | S | S | * | * | H | α-helix | trans | -78.8 | -15.7 | 179.9 | 176.3 | 0 | 0 | 0 | 0 | 112.6 | L286 | L286-V290 WeakPolarHBondContact O-CG2 3.49Å; L286-V290 PolarHBondContact O-N 2.8Å |
| 291 | K | 52.6 | Low | 45.8 | Very low | 196 Ų | 196 | 136.2 Ų | 136.2 | 85% | 0.852 | 73% | 0.732 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -110.1 | 11.3 | -180 | -156.6 | 162.2 | 179.8 | 174.3 | 0 | 114.1 | L287 K289 | L287-K291 VanDerWaalsContact O-CB 3.3Å; L287-K291 WeakPolarHBondContact O-CB 3.15Å; L287-K291 PolarHBondContact O-N 3.36Å; K289-K291 VanDerWaalsContact C-N 3.31Å; K289-K291 PolarHBondContact O-N 2.95Å |
| 292 | G | 44.7 | Very low | 45.5 | Very low | 51 Ų | 51 | 137.7 Ų | 137.7 | 53% | 0.526 | 74% | 0.738 | S | S | . | * | trans | -112.5 | -16.8 | -169.2 | 0 | 0 | 0 | 0 | 0 | 117.5 | N294 | G292-N294 PolarHBondContact O-N 3.4Š| ||
| 293 | D | 44.2 | Very low | 45.2 | Very low | 154 Ų | 154 | 139.8 Ų | 139.8 | 82% | 0.824 | 74% | 0.743 | S | S | * | * | S | Bend | trans | -95.7 | 69.3 | 179.8 | -85.1 | -25.5 | 0 | 0 | 0 | 111.1 | ||
| 294 | N | 42.7 | Very low | 45 | Very low | 172 Ų | 172 | 137 Ų | 137 | 92% | 0.92 | 74% | 0.741 | S | S | * | * | S | Bend | trans | -175.7 | 91.6 | 159.8 | -95.5 | -24.4 | 0 | 0 | 0 | 108.9 | G292 | G292-N294 PolarHBondContact O-N 3.4Š|
| 295 | G | 40.3 | Very low | 44.4 | Very low | 77 Ų | 77 | 136.5 Ų | 136.5 | 79% | 0.794 | 75% | 0.749 | S | S | * | * | trans | 167.1 | 82.3 | 175.2 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 296 | S | 39.7 | Very low | 43.8 | Very low | 134 Ų | 134 | 134.3 Ų | 134.3 | 94% | 0.937 | 75% | 0.752 | S | S | * | * | trans | -45.8 | 144.7 | 161.3 | 176 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 297 | G | 39.7 | Very low | 43.2 | Very low | 67 Ų | 67 | 134.4 Ų | 134.4 | 69% | 0.691 | 76% | 0.763 | S | S | * | * | trans | 124.7 | 101.3 | 148.7 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 298 | N | 35.9 | Very low | 42.5 | Very low | 159 Ų | 159 | 132.8 Ų | 132.8 | 85% | 0.85 | 77% | 0.765 | S | S | * | * | trans | 0 | 132.1 | 149.2 | -64.9 | -20.4 | 0 | 0 | 0 | 118 | ||||
| 299 | C | 35.6 | Very low | 41.8 | Very low | 130 Ų | 130 | 133.9 Ų | 133.9 | 88% | 0.878 | 78% | 0.778 | S | S | * | * | -172.6 | 136.8 | 114.7 | -96.1 | 0 | 0 | 0 | 0 | 112 | |||||
| 300 | T | 41.9 | Very low | 41 | Very low | 125 Ų | 125 | 128.6 Ų | 128.6 | 77% | 0.767 | 77% | 0.773 | S | S | * | * | trans | -65.7 | 158.8 | -178.8 | 28.6 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 301 | E | 39.7 | Very low | 40.1 | Very low | 142 Ų | 142 | 128.1 Ų | 128.1 | 66% | 0.664 | 78% | 0.776 | S | S | * | * | 110.5 | 125.9 | 129.4 | -120.9 | -179.8 | 131.4 | 0 | 0 | 121.3 | |||||
| 302 | K | 39 | Very low | 39.4 | Very low | 174 Ų | 174 | 126.9 Ų | 126.9 | 76% | 0.757 | 77% | 0.773 | S | S | * | * | trans | 63.7 | 110.3 | 150 | -84.7 | 163.7 | -179.8 | 155.1 | 0 | 119 | ||||
| 303 | N | 39.4 | Very low | 39.1 | Very low | 134 Ų | 134 | 131.9 Ų | 131.9 | 72% | 0.717 | 79% | 0.787 | S | S | * | * | 76.5 | 115.2 | 58.5 | -147.1 | 24.9 | 0 | 0 | 0 | 115.5 | |||||
| 304 | N | 40.7 | Very low | 38.8 | Very low | 129 Ų | 129 | 134.5 Ų | 134.5 | 69% | 0.69 | 79% | 0.794 | S | S | * | * | trans | 62.2 | 117.5 | 155.3 | -67.6 | -16.1 | 0 | 0 | 0 | 121.2 | ||||
| 305 | T | 37.9 | Very low | 38.6 | Very low | 119 Ų | 119 | 129.3 Ų | 129.3 | 73% | 0.73 | 78% | 0.782 | S | S | * | * | 166.3 | 129.6 | 93.6 | 31.9 | 0 | 0 | 0 | 0 | 113.5 | |||||
| 306 | N | 39.4 | Very low | 38.7 | Very low | 146 Ų | 146 | 134.4 Ų | 134.4 | 78% | 0.781 | 79% | 0.788 | S | S | * | * | trans | 53.7 | 143.1 | 133.2 | -58.3 | -14.9 | 0 | 0 | 0 | 125.3 | ||||
| 307 | S | 39.2 | Very low | 38.6 | Very low | 125 Ų | 125 | 131.1 Ų | 131.1 | 87% | 0.874 | 78% | 0.776 | S | S | * | * | trans | 76 | 144.7 | 152.8 | -78.8 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 308 | A | 38.5 | Very low | 38.7 | Very low | 77 Ų | 77 | 139.5 Ų | 139.5 | 64% | 0.636 | 79% | 0.787 | S | S | * | * | cis | -175 | 171.7 | -11.6 | 0 | 0 | 0 | 0 | 0 | 105.7 | ||||
| 309 | E | 39.1 | Very low | 38.8 | Very low | 201 Ų | 201 | 139.1 Ų | 139.1 | 94% | 0.939 | 78% | 0.78 | S | S | * | * | trans | 77.1 | 133.5 | 167.7 | -56.2 | -179 | 103.8 | 0 | 0 | 116.5 | ||||
| 310 | G | 35.5 | Very low | 39 | Very low | 65 Ų | 65 | 140.6 Ų | 140.6 | 67% | 0.67 | 78% | 0.778 | S | S | * | * | cis | 177.3 | 147.4 | 2 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 311 | S | 37.2 | Very low | 39 | Very low | 113 Ų | 113 | 143.7 Ų | 143.7 | 79% | 0.79 | 78% | 0.777 | S | S | * | * | trans | 51.8 | 119.7 | 144.4 | 54.9 | 0 | 0 | 0 | 0 | 121.6 | ||||
| 312 | Q | 37.9 | Very low | 39.1 | Very low | 171 Ų | 171 | 144.6 Ų | 144.6 | 80% | 0.799 | 79% | 0.786 | S | S | * | * | 175.5 | 127.5 | 96.9 | -93.9 | -162.5 | 12 | 0 | 0 | 113.7 | |||||
| 313 | L | 38.3 | Very low | 39.1 | Very low | 156 Ų | 156 | 141.3 Ų | 141.3 | 82% | 0.817 | 78% | 0.78 | S | S | * | * | trans | 46.8 | 100 | 145.4 | -76.8 | 95.9 | 0 | 0 | 0 | 120.5 | ||||
| 314 | E | 36.4 | Very low | 39.1 | Very low | 208 Ų | 208 | 144.2 Ų | 144.2 | 97% | 0.972 | 79% | 0.786 | S | S | * | * | trans | -117.2 | 123.1 | 144.4 | -91.4 | -175.5 | 136.7 | 0 | 0 | 109.4 | ||||
| 315 | G | 38.4 | Very low | 39.1 | Very low | 64 Ų | 64 | 149.9 Ų | 149.9 | 66% | 0.66 | 82% | 0.815 | S | S | * | * | trans | -148.6 | 119 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 316 | I | 42.6 | Very low | 39.1 | Very low | 183 Ų | 183 | 151.4 Ų | 151.4 | 94% | 0.938 | 82% | 0.82 | S | S | * | * | trans | 80.8 | 111.6 | 144.4 | -51.1 | 163.3 | 0 | 0 | 0 | 116.6 | ||||
| 317 | G | 39.4 | Very low | 39.1 | Very low | 66 Ų | 66 | 151.7 Ų | 151.7 | 68% | 0.68 | 82% | 0.822 | S | S | * | * | trans | 168.3 | 70.1 | 154.6 | 0 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 318 | R | 41.5 | Very low | 39.1 | Very low | 242 Ų | 242 | 153.2 Ų | 153.2 | 91% | 0.913 | 82% | 0.819 | S | S | * | * | trans | 61.2 | 101.5 | 141.6 | -57.5 | -179.3 | -179.4 | -150.3 | -0.7 | 118 | ||||
| 319 | Q | 38.2 | Very low | 39.1 | Very low | 152 Ų | 152 | 157.6 Ų | 157.6 | 71% | 0.71 | 83% | 0.829 | S | S | * | * | 36.2 | 103.8 | 81.4 | -83.5 | -92 | 16.3 | 0 | 0 | 114.9 | |||||
| 320 | L | 39.2 | Very low | 39.1 | Very low | 161 Ų | 161 | 154.9 Ų | 154.9 | 84% | 0.843 | 82% | 0.823 | S | S | * | * | trans | -152.4 | 100.6 | 138.9 | -135.6 | 105.4 | 0 | 0 | 0 | 110.5 | ||||
| 321 | Y | 40.7 | Very low | 39.4 | Very low | 190 Ų | 190 | 160.9 Ų | 160.9 | 75% | 0.745 | 83% | 0.833 | S | S | * | * | trans | -64.8 | 137.7 | 158.3 | -88.8 | -103.3 | 0 | 0 | 0 | 109.7 | ||||
| 322 | L | 42.2 | Very low | 39.5 | Very low | 160 Ų | 160 | 164.4 Ų | 164.4 | 84% | 0.838 | 84% | 0.836 | S | S | * | * | trans | -138.4 | 105 | 153.6 | -125.6 | 170.8 | 0 | 0 | 0 | 109.3 | ||||
| 323 | V | 39.5 | Very low | 39.7 | Very low | 106 Ų | 106 | 163.8 Ų | 163.8 | 64% | 0.642 | 84% | 0.839 | S | S | * | * | trans | -81.1 | 156.2 | 167.9 | 165.3 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 324 | K | 38.5 | Very low | 39.8 | Very low | 194 Ų | 194 | 164.5 Ų | 164.5 | 84% | 0.843 | 84% | 0.84 | S | S | * | * | trans | 95.5 | 99.6 | 155.8 | -108.1 | 170.5 | 178.9 | 173.6 | 0 | 118.1 | ||||
| 325 | L | 40.8 | Very low | 40.1 | Very low | 248 Ų | 248 | 160.5 Ų | 160.5 | 100% | 1.298 | 83% | 0.828 | S | S | * | * | -161.5 | 0 | 96.5 | -112.3 | 138.8 | 0 | 0 | 0 | 110.3 |
Retrieved 325 of 325 residues in 743.7 ms
(Link to these results)