| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 38.2 | Very low | 40.4 | Very low | 214 Ų | 214 | 116.6 Ų | 116.6 | 100% | 1.054 | 65% | 0.65 | S | S | * | * | 0 | -48.3 | 0 | -63.9 | -172.8 | -170.2 | 0 | 0 | 113.9 | K3 L4 | M1-K3 VanDerWaalsContact C-N 3.3Å; M1-K3 PolarHBondContact O-N 3.39Å; M1-L4 PolarHBondContact O-N 2.81Å | |||
| 2 | F | 29.8 | Very low | 41.3 | Very low | 153 Ų | 153 | 111.6 Ų | 111.6 | 67% | 0.671 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -52.3 | -32 | -174.7 | -88.7 | -85.8 | 0 | 0 | 0 | 117.3 | L4 | F2-L4 PolarHBondContact O-N 3.41Å |
| 3 | K | 30.5 | Very low | 42.1 | Very low | 203 Ų | 203 | 105.6 Ų | 105.6 | 88% | 0.883 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -65 | -19.2 | 177.8 | -84.5 | -175.2 | 173.2 | 179.1 | 0 | 114.9 | M1 | M1-K3 VanDerWaalsContact C-N 3.3Å; M1-K3 PolarHBondContact O-N 3.39Å |
| 4 | L | 37.9 | Very low | 42.6 | Very low | 147 Ų | 147 | 105.8 Ų | 105.8 | 77% | 0.77 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -89.2 | -26.5 | -177.9 | -80.2 | 160.7 | 0 | 0 | 0 | 113.8 | M1 F2 P8 | M1-L4 PolarHBondContact O-N 2.81Å; F2-L4 PolarHBondContact O-N 3.41Å; L4-P8 WeakPolarHBondContact O-CD 3.13Å |
| 5 | L | 41.9 | Very low | 43 | Very low | 116 Ų | 116 | 103.7 Ų | 103.7 | 61% | 0.607 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -80.4 | -27.3 | 174.4 | -94.4 | 80 | 0 | 0 | 0 | 113.2 | G7 P8 | L5-G7 VanDerWaalsContact C-N 3.3Å; L5-G7 PolarHBondContact O-N 3.43Å; L5-P8 WeakPolarHBondContact O-CD 3.12Å; L5-P8 WeakPolarHBondContact O-CG 3.17Å |
| 6 | L | 44.1 | Very low | 43.7 | Very low | 119 Ų | 119 | 104.3 Ų | 104.3 | 62% | 0.623 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -67.8 | -29.5 | 177 | -99.4 | 73.8 | 0 | 0 | 0 | 112.8 | A10 | L6-A10 WeakPolarHBondContact O-CB 3.25Å; L6-A10 PolarHBondContact O-N 3.08Å |
| 7 | G | 40.8 | Very low | 44.2 | Very low | 41 Ų | 41 | 103.4 Ų | 103.4 | 42% | 0.423 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -55.4 | -60 | 178.9 | 0 | 0 | 0 | 0 | 0 | 114 | L5 A10 A11 | L5-G7 VanDerWaalsContact C-N 3.3Å; L5-G7 PolarHBondContact O-N 3.43Å; G7-A10 PolarHBondContact O-N 3.03Å; G7-A11 VanDerWaalsContact O-CB 3.29Å; G7-A11 WeakPolarHBondContact O-CB 3.42Å; G7-A11 PolarHBondContact O-N 3.48Å |
| 8 | P | 42.9 | Very low | 44.7 | Very low | 83 Ų | 83 | 105.2 Ų | 105.2 | 54% | 0.539 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -67.2 | -36.7 | -180 | 24.9 | -33.8 | 0 | 0 | 0 | 113.2 | L4 L5 A11 A12 | L4-P8 WeakPolarHBondContact O-CD 3.13Å; L5-P8 WeakPolarHBondContact O-CD 3.12Å; L5-P8 WeakPolarHBondContact O-CG 3.17Å; P8-A11 PolarHBondContact O-N 3.46Å; P8-A12 VanDerWaalsContact O-CB 3.24Å; P8-A12 WeakPolarHBondContact O-CB 3.41Å; P8-A12 PolarHBondContact O-N 3.49Å |
| 9 | C | 43.5 | Very low | 45.3 | Very low | 87 Ų | 87 | 108.8 Ų | 108.8 | 59% | 0.588 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -67.1 | -40.6 | 175.5 | -69.5 | 0 | 0 | 0 | 0 | 112.3 | A12 A13 | C9-A12 PolarHBondContact O-N 3.2Å; C9-A13 VanDerWaalsContact O-CB 3.28Å; C9-A13 WeakPolarHBondContact O-CB 3.38Å; C9-A13 PolarHBondContact O-N 3.22Å |
| 10 | A | 47.9 | Very low | 45.5 | Very low | 61 Ų | 61 | 106 Ų | 106 | 50% | 0.504 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -67.4 | -38.7 | 174 | 0 | 0 | 0 | 0 | 0 | 111.6 | L6 G7 L14 | L6-A10 WeakPolarHBondContact O-CB 3.25Å; L6-A10 PolarHBondContact O-N 3.08Å; G7-A10 PolarHBondContact O-N 3.03Å; A10-L14 WeakPolarHBondContact O-CB 3.41Å; A10-L14 PolarHBondContact O-N 3.44Å |
| 11 | A | 47.3 | Very low | 46.1 | Very low | 59 Ų | 59 | 107.9 Ų | 107.9 | 49% | 0.488 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -66.7 | -40.6 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | G7 P8 L14 C15 | G7-A11 VanDerWaalsContact O-CB 3.29Å; G7-A11 WeakPolarHBondContact O-CB 3.42Å; G7-A11 PolarHBondContact O-N 3.48Å; P8-A11 PolarHBondContact O-N 3.46Å; A11-L14 PolarHBondContact O-N 3.46Å; A11-C15 WeakPolarHBondContact O-CB 3.43Å; A11-C15 PolarHBondContact O-N 3.46Å |
| 12 | A | 50.5 | Low | 47.3 | Very low | 56 Ų | 56 | 102.5 Ų | 102.5 | 46% | 0.463 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -64.2 | -48.5 | 173.7 | 0 | 0 | 0 | 0 | 0 | 111 | P8 C9 L14 C15 E16 | P8-A12 VanDerWaalsContact O-CB 3.24Å; P8-A12 WeakPolarHBondContact O-CB 3.41Å; P8-A12 PolarHBondContact O-N 3.49Å; C9-A12 PolarHBondContact O-N 3.2Å; A12-L14 VanDerWaalsContact C-N 3.32Å; A12-L14 PolarHBondContact O-N 3.44Å; A12-C15 WeakPolarHBondContact O-CB 3.34Å; A12-C15 PolarHBondContact O-N 3.21Å; A12-C15 VanDerWaalsContact O-N 3.15Å; A12-E16 WeakPolarHBondContact O-CB 3.44Å; A12-E16 WeakPolarHBondContact O-CG 3.46Å; A12-E16 PolarHBondContact O-N 3.17Å |
| 13 | A | 51.6 | Low | 48.6 | Very low | 34 Ų | 34 | 104.8 Ų | 104.8 | 28% | 0.281 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -60.8 | -38.7 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | C9 T17 | C9-A13 VanDerWaalsContact O-CB 3.28Å; C9-A13 WeakPolarHBondContact O-CB 3.38Å; C9-A13 PolarHBondContact O-N 3.22Å; A13-T17 WeakPolarHBondContact O-CB 3.41Å; A13-T17 PolarHBondContact O-N 3.35Å; A13-T17 PolarHBondContact O-OG1 2.97Å |
| 14 | L | 49.8 | Very low | 49.8 | Very low | 108 Ų | 108 | 97.7 Ų | 97.7 | 57% | 0.565 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -71 | -34.2 | 175.5 | -158.1 | 79.8 | 0 | 0 | 0 | 111.9 | A10 A11 A12 K18 | A10-L14 WeakPolarHBondContact O-CB 3.41Å; A10-L14 PolarHBondContact O-N 3.44Å; A11-L14 PolarHBondContact O-N 3.46Å; A12-L14 VanDerWaalsContact C-N 3.32Å; A12-L14 PolarHBondContact O-N 3.44Å; L14-K18 VanDerWaalsContact O-CB 3.31Å; L14-K18 WeakPolarHBondContact O-CB 3.32Å; L14-K18 VanDerWaalsContact O-CG 3.28Å; L14-K18 WeakPolarHBondContact O-CG 3.35Å; L14-K18 PolarHBondContact O-N 3.47Å |
| 15 | C | 47.8 | Very low | 50.6 | Low | 75 Ų | 75 | 93.1 Ų | 93.1 | 51% | 0.507 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -68.8 | -49.9 | 175.2 | -168.6 | 0 | 0 | 0 | 0 | 110.9 | A11 A12 T17 K18 R19 | A11-C15 WeakPolarHBondContact O-CB 3.43Å; A11-C15 PolarHBondContact O-N 3.46Å; A12-C15 WeakPolarHBondContact O-CB 3.34Å; A12-C15 PolarHBondContact O-N 3.21Å; A12-C15 VanDerWaalsContact O-N 3.15Å; C15-T17 PolarHBondContact O-N 3.35Å; C15-K18 CarbonylContact O-C 3.58Å; C15-K18 PolarHBondContact O-N 2.99Å; C15-R19 WeakPolarHBondContact O-CB 3.38Å; C15-R19 PolarHBondContact O-N 3.48Å |
| 16 | E | 53.9 | Low | 51.4 | Low | 112 Ų | 112 | 92.4 Ų | 92.4 | 52% | 0.523 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -57.8 | -46.4 | 172.5 | -77.7 | -68.5 | 118.4 | 0 | 0 | 111.3 | A12 K18 R19 A20 | A12-E16 WeakPolarHBondContact O-CB 3.44Å; A12-E16 WeakPolarHBondContact O-CG 3.46Å; A12-E16 PolarHBondContact O-N 3.17Å; E16-K18 PolarHBondContact O-N 3.21Å; E16-R19 CarbonylContact O-C 3.58Å; E16-R19 PolarHBondContact O-N 3.01Å; E16-R19 VanDerWaalsContact O-N 3.1Å; E16-A20 WeakPolarHBondContact O-CB 3.38Å; E16-A20 PolarHBondContact O-N 3.47Å |
| 17 | T | 52.1 | Low | 52.1 | Low | 90 Ų | 90 | 90.4 Ų | 90.4 | 55% | 0.552 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -63.6 | -39.3 | 176.6 | -56.6 | 0 | 0 | 0 | 0 | 111.6 | A13 C15 F21 | A13-T17 WeakPolarHBondContact O-CB 3.41Å; A13-T17 PolarHBondContact O-N 3.35Å; A13-T17 PolarHBondContact O-OG1 2.97Å; C15-T17 PolarHBondContact O-N 3.35Å; T17-F21 WeakPolarHBondContact O-CB 3.25Å; T17-F21 PolarHBondContact O-N 3.31Å |
| 18 | K | 53.8 | Low | 52.8 | Low | 136 Ų | 136 | 92.4 Ų | 92.4 | 59% | 0.591 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -65.3 | -38.3 | 172 | -80.8 | -177.8 | 177.9 | -171.6 | 0 | 111.8 | L14 C15 E16 F21 I22 | L14-K18 VanDerWaalsContact O-CB 3.31Å; L14-K18 WeakPolarHBondContact O-CB 3.32Å; L14-K18 VanDerWaalsContact O-CG 3.28Å; L14-K18 WeakPolarHBondContact O-CG 3.35Å; L14-K18 PolarHBondContact O-N 3.47Å; C15-K18 CarbonylContact O-C 3.58Å; C15-K18 PolarHBondContact O-N 2.99Å; E16-K18 PolarHBondContact O-N 3.21Å; K18-F21 PolarHBondContact O-N 3.13Å; K18-I22 WeakPolarHBondContact O-CB 3.36Å; K18-I22 VanDerWaalsContact O-CG1 3.24Å; K18-I22 WeakPolarHBondContact O-CG1 3.22Å; K18-I22 PolarHBondContact O-N 3.04Å |
| 19 | R | 55.5 | Low | 53.7 | Low | 174 Ų | 174 | 97.5 Ų | 97.5 | 66% | 0.657 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -70.3 | -41.9 | -179.9 | -152.4 | 174 | -163.7 | 168.3 | 4.5 | 111.4 | C15 E16 I22 R23 | C15-R19 WeakPolarHBondContact O-CB 3.38Å; C15-R19 PolarHBondContact O-N 3.48Å; E16-R19 CarbonylContact O-C 3.58Å; E16-R19 PolarHBondContact O-N 3.01Å; E16-R19 VanDerWaalsContact O-N 3.1Å; R19-I22 PolarHBondContact O-N 3.15Å; R19-R23 WeakPolarHBondContact O-CB 3.32Å; R19-R23 PolarHBondContact O-N 3.43Å |
| 20 | A | 50.8 | Low | 54.3 | Low | 52 Ų | 52 | 99 Ų | 99 | 43% | 0.43 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -63.3 | -45 | 170.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | E16 I22 R23 V24 | E16-A20 WeakPolarHBondContact O-CB 3.38Å; E16-A20 PolarHBondContact O-N 3.47Å; A20-I22 PolarHBondContact O-N 2.98Å; A20-R23 PolarHBondContact O-N 2.91Å; A20-V24 WeakPolarHBondContact O-CB 3.24Å; A20-V24 WeakPolarHBondContact O-CG2 3.47Å; A20-V24 PolarHBondContact O-N 3.28Å |
| 21 | F | 57.9 | Low | 54.7 | Low | 146 Ų | 146 | 101.5 Ų | 101.5 | 64% | 0.64 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -61.7 | -41.8 | 175.5 | -175.8 | -94 | 0 | 0 | 0 | 112.4 | T17 K18 S25 | T17-F21 WeakPolarHBondContact O-CB 3.25Å; T17-F21 PolarHBondContact O-N 3.31Å; K18-F21 PolarHBondContact O-N 3.13Å; F21-S25 VanDerWaalsContact O-CB 3.22Å; F21-S25 WeakPolarHBondContact O-CB 3.48Å; F21-S25 PolarHBondContact O-N 3.29Å; F21-S25 PolarHBondContact O-OG 2.94Å |
| 22 | I | 61.8 | Low | 55 | Low | 100 Ų | 100 | 107.6 Ų | 107.6 | 51% | 0.513 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -63.7 | -43.8 | 173 | -74.2 | 168.1 | 0 | 0 | 0 | 110.4 | K18 R19 A20 S25 L26 | K18-I22 WeakPolarHBondContact O-CB 3.36Å; K18-I22 VanDerWaalsContact O-CG1 3.24Å; K18-I22 WeakPolarHBondContact O-CG1 3.22Å; K18-I22 PolarHBondContact O-N 3.04Å; R19-I22 PolarHBondContact O-N 3.15Å; A20-I22 PolarHBondContact O-N 2.98Å; I22-S25 PolarHBondContact O-N 3.03Å; I22-L26 HydrophobicContact CG2-CD1 3.78Å; I22-L26 HydrophobicContact CG2-CG 4.36Å; I22-L26 WeakPolarHBondContact O-CB 3.07Å; I22-L26 VanDerWaalsContact O-CG 3.27Å; I22-L26 WeakPolarHBondContact O-CG 3.47Å; I22-L26 PolarHBondContact O-N 2.82Å |
| 23 | R | 58.2 | Low | 54.7 | Low | 202 Ų | 202 | 107.5 Ų | 107.5 | 76% | 0.762 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -64 | -44.2 | 179.1 | -163.9 | 174.7 | -164.3 | 151.5 | 4.4 | 112.2 | R19 A20 L26 D27 | R19-R23 WeakPolarHBondContact O-CB 3.32Å; R19-R23 PolarHBondContact O-N 3.43Å; A20-R23 PolarHBondContact O-N 2.91Å; R23-L26 PolarHBondContact O-N 2.8Å; R23-D27 WeakPolarHBondContact O-CB 3.43Å; R23-D27 PolarHBondContact O-N 3.33Å |
| 24 | V | 56.5 | Low | 54.8 | Low | 53 Ų | 53 | 111.3 Ų | 111.3 | 32% | 0.321 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -66.6 | -40.6 | 174.9 | 171.9 | 0 | 0 | 0 | 0 | 111.1 | A20 L26 D27 I28 | A20-V24 WeakPolarHBondContact O-CB 3.24Å; A20-V24 WeakPolarHBondContact O-CG2 3.47Å; A20-V24 PolarHBondContact O-N 3.28Å; V24-L26 VanDerWaalsContact C-N 3.33Å; V24-L26 PolarHBondContact O-N 3.18Å; V24-D27 PolarHBondContact O-N 3.03Å; V24-I28 HydrophobicContact CG1-CD1 3.72Å; V24-I28 HydrophobicContact CG1-CG1 4.41Å; V24-I28 WeakPolarHBondContact O-CB 3.45Å; V24-I28 VanDerWaalsContact O-CG1 3.24Å; V24-I28 WeakPolarHBondContact O-CG1 3.49Å; V24-I28 PolarHBondContact O-N 2.94Å |
| 25 | S | 54.1 | Low | 54.6 | Low | 51 Ų | 51 | 113.3 Ų | 113.3 | 36% | 0.357 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -65.1 | -36.9 | 175.5 | -61 | 0 | 0 | 0 | 0 | 112.4 | F21 I22 R29 | F21-S25 VanDerWaalsContact O-CB 3.22Å; F21-S25 WeakPolarHBondContact O-CB 3.48Å; F21-S25 PolarHBondContact O-N 3.29Å; F21-S25 PolarHBondContact O-OG 2.94Å; I22-S25 PolarHBondContact O-N 3.03Å; S25-R29 VanDerWaalsContact O-CB 3.24Å; S25-R29 WeakPolarHBondContact O-CB 3.35Å; S25-R29 PolarHBondContact O-N 3.25Å |
| 26 | L | 59.3 | Low | 54.4 | Low | 101 Ų | 101 | 119.6 Ų | 119.6 | 53% | 0.529 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -69.6 | -41.8 | 173.7 | -75.9 | 169.9 | 0 | 0 | 0 | 111.8 | I22 R23 V24 R29 M30 | I22-L26 HydrophobicContact CG2-CD1 3.78Å; I22-L26 HydrophobicContact CG2-CG 4.36Å; I22-L26 WeakPolarHBondContact O-CB 3.07Å; I22-L26 VanDerWaalsContact O-CG 3.27Å; I22-L26 WeakPolarHBondContact O-CG 3.47Å; I22-L26 PolarHBondContact O-N 2.82Å; R23-L26 PolarHBondContact O-N 2.8Å; V24-L26 VanDerWaalsContact C-N 3.33Å; V24-L26 PolarHBondContact O-N 3.18Å; L26-R29 PolarHBondContact O-N 2.96Å; L26-M30 VanDerWaalsContact O-CB 3.27Å; L26-M30 WeakPolarHBondContact O-CB 3.43Å; L26-M30 PolarHBondContact O-N 3.1Å |
| 27 | D | 58.8 | Low | 53.6 | Low | 77 Ų | 77 | 119.2 Ų | 119.2 | 41% | 0.412 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -63.5 | -43.8 | 176 | -170.5 | -97.8 | 0 | 0 | 0 | 111.7 | R23 V24 R29 M30 K31 | R23-D27 WeakPolarHBondContact O-CB 3.43Å; R23-D27 PolarHBondContact O-N 3.33Å; V24-D27 PolarHBondContact O-N 3.03Å; D27-R29 PolarHBondContact O-N 2.93Å; D27-M30 PolarHBondContact O-N 2.85Å; D27-K31 WeakPolarHBondContact O-CB 3.49Å; D27-K31 PolarHBondContact O-N 3.25Å; D27-K31 WeakPolarHBondContact OD1-CE 3.37Å; D27-K31 IonicContact OD1-NZ 2.76Å; D27-K31 PolarHBondContact OD1-NZ 3.23Å; D27-K31 IonicContact OD2-NZ 3.78Å |
| 28 | I | 54 | Low | 53 | Low | 84 Ų | 84 | 119.7 Ų | 119.7 | 43% | 0.431 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -63.6 | -40.1 | 174 | -68.9 | 168 | 0 | 0 | 0 | 111.3 | V24 R32 | V24-I28 HydrophobicContact CG1-CD1 3.72Å; V24-I28 HydrophobicContact CG1-CG1 4.41Å; V24-I28 WeakPolarHBondContact O-CB 3.45Å; V24-I28 VanDerWaalsContact O-CG1 3.24Å; V24-I28 WeakPolarHBondContact O-CG1 3.49Å; V24-I28 PolarHBondContact O-N 2.94Å; I28-R32 WeakPolarHBondContact O-CB 3.45Å; I28-R32 PolarHBondContact O-N 3.24Å |
| 29 | R | 63.1 | Low | 52.4 | Low | 190 Ų | 190 | 118.7 Ų | 118.7 | 72% | 0.717 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -67.3 | -41.1 | 175.6 | 176.7 | 172.7 | -94 | -170.9 | -7.4 | 111.5 | S25 L26 D27 R32 S33 | S25-R29 VanDerWaalsContact O-CB 3.24Å; S25-R29 WeakPolarHBondContact O-CB 3.35Å; S25-R29 PolarHBondContact O-N 3.25Å; L26-R29 PolarHBondContact O-N 2.96Å; D27-R29 PolarHBondContact O-N 2.93Å; R29-R32 WeakPolarHBondContact O-CB 3.36Å; R29-R32 PolarHBondContact O-N 2.81Å; R29-S33 PolarHBondContact O-N 3.37Å; R29-S33 PolarHBondContact O-OG 3.11Å |
| 30 | M | 56 | Low | 51.7 | Low | 118 Ų | 118 | 118 Ų | 118 | 58% | 0.581 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -68.5 | -41.6 | 179.5 | -163.7 | 75.2 | 85.3 | 0 | 0 | 111.8 | L26 D27 R32 S33 L34 | L26-M30 VanDerWaalsContact O-CB 3.27Å; L26-M30 WeakPolarHBondContact O-CB 3.43Å; L26-M30 PolarHBondContact O-N 3.1Å; D27-M30 PolarHBondContact O-N 2.85Å; M30-R32 VanDerWaalsContact C-N 3.31Å; M30-R32 PolarHBondContact O-N 2.88Å; M30-S33 WeakPolarHBondContact CA-OG 3.4Å; M30-S33 PolarHBondContact O-N 2.75Å; M30-S33 PolarHBondContact O-OG 3.36Å; M30-L34 HydrophobicContact CG-CD1 4.23Å; M30-L34 WeakPolarHBondContact O-CB 3.3Å; M30-L34 WeakPolarHBondContact O-CG 3.2Å; M30-L34 PolarHBondContact O-N 3.34Å |
| 31 | K | 56.3 | Low | 51.2 | Low | 114 Ų | 114 | 120.7 Ų | 120.7 | 50% | 0.496 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -63.3 | -36 | 171.4 | -79.7 | 168.7 | 176.2 | 153.2 | 0 | 112.1 | D27 N35 | D27-K31 WeakPolarHBondContact O-CB 3.49Å; D27-K31 PolarHBondContact O-N 3.25Å; D27-K31 WeakPolarHBondContact OD1-CE 3.37Å; D27-K31 IonicContact OD1-NZ 2.76Å; D27-K31 PolarHBondContact OD1-NZ 3.23Å; D27-K31 IonicContact OD2-NZ 3.78Å; K31-N35 WeakPolarHBondContact O-CB 3.31Å; K31-N35 PolarHBondContact O-N 3.1Å; K31-N35 VanDerWaalsContact O-N 3.14Å |
| 32 | R | 52.3 | Low | 50.6 | Low | 187 Ų | 187 | 122.3 Ų | 122.3 | 71% | 0.706 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -67.2 | -38.2 | 171.4 | -98.1 | -173.3 | 165.6 | 92.2 | -1 | 113.2 | I28 R29 M30 Y36 | I28-R32 WeakPolarHBondContact O-CB 3.45Å; I28-R32 PolarHBondContact O-N 3.24Å; R29-R32 WeakPolarHBondContact O-CB 3.36Å; R29-R32 PolarHBondContact O-N 2.81Å; M30-R32 VanDerWaalsContact C-N 3.31Å; M30-R32 PolarHBondContact O-N 2.88Å; R32-Y36 WeakPolarHBondContact O-CB 3.32Å; R32-Y36 PolarHBondContact O-N 3.35Å |
| 33 | S | 45.7 | Very low | 49.7 | Very low | 53 Ų | 53 | 126 Ų | 126 | 37% | 0.371 | 64% | 0.643 | S | S | . | * | H | α-helix | trans | -73.4 | -37.3 | 177.2 | 56 | 0 | 0 | 0 | 0 | 112.4 | R29 M30 N35 Y36 S37 | R29-S33 PolarHBondContact O-N 3.37Å; R29-S33 PolarHBondContact O-OG 3.11Å; M30-S33 WeakPolarHBondContact CA-OG 3.4Å; M30-S33 PolarHBondContact O-N 2.75Å; M30-S33 PolarHBondContact O-OG 3.36Å; S33-N35 VanDerWaalsContact C-N 3.34Å; S33-N35 PolarHBondContact O-N 2.96Å; S33-Y36 PolarHBondContact O-N 2.9Å; S33-Y36 VanDerWaalsContact O-N 3.1Å; S33-S37 WeakPolarHBondContact O-CB 3.28Å; S33-S37 PolarHBondContact O-N 3.18Å |
| 34 | L | 52.8 | Low | 49.1 | Very low | 114 Ų | 114 | 123.4 Ų | 123.4 | 60% | 0.597 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -63 | -39.4 | 174.2 | -75.6 | 162.8 | 0 | 0 | 0 | 112.1 | M30 Y36 | M30-L34 HydrophobicContact CG-CD1 4.23Å; M30-L34 WeakPolarHBondContact O-CB 3.3Å; M30-L34 WeakPolarHBondContact O-CG 3.2Å; M30-L34 PolarHBondContact O-N 3.34Å; L34-Y36 PolarHBondContact O-N 3.18Å |
| 35 | N | 45.5 | Very low | 48.4 | Very low | 150 Ų | 150 | 127.8 Ų | 127.8 | 80% | 0.802 | 67% | 0.666 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.6 | -7.1 | 174.4 | -71.4 | -7.4 | 0 | 0 | 0 | 114.4 | K31 S33 | K31-N35 WeakPolarHBondContact O-CB 3.31Å; K31-N35 PolarHBondContact O-N 3.1Å; K31-N35 VanDerWaalsContact O-N 3.14Å; S33-N35 VanDerWaalsContact C-N 3.34Å; S33-N35 PolarHBondContact O-N 2.96Å |
| 36 | Y | 44.4 | Very low | 48 | Very low | 208 Ų | 208 | 131.8 Ų | 131.8 | 82% | 0.816 | 68% | 0.683 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -109.9 | -29.6 | 178 | -172.5 | -96.2 | 0 | 0 | 0 | 112.4 | R32 S33 L34 S38 | R32-Y36 WeakPolarHBondContact O-CB 3.32Å; R32-Y36 PolarHBondContact O-N 3.35Å; S33-Y36 PolarHBondContact O-N 2.9Å; S33-Y36 VanDerWaalsContact O-N 3.1Å; L34-Y36 PolarHBondContact O-N 3.18Å; Y36-S38 PolarHBondContact O-N 3.44Å |
| 37 | S | 36 | Very low | 47.2 | Very low | 103 Ų | 103 | 132.1 Ų | 132.1 | 72% | 0.72 | 69% | 0.689 | S | S | * | * | S | Bend | trans | -101.4 | 41.3 | -171.5 | -170.2 | 0 | 0 | 0 | 0 | 112.9 | S33 | S33-S37 WeakPolarHBondContact O-CB 3.28Å; S33-S37 PolarHBondContact O-N 3.18Å |
| 38 | S | 40 | Very low | 46.7 | Very low | 101 Ų | 101 | 137.1 Ų | 137.1 | 71% | 0.706 | 71% | 0.71 | S | S | * | * | S | Bend | trans | -133.2 | 14.5 | 178.8 | -167.9 | 0 | 0 | 0 | 0 | 113.9 | Y36 | Y36-S38 PolarHBondContact O-N 3.44Š|
| 39 | S | 42.2 | Very low | 46.4 | Very low | 115 Ų | 115 | 138.7 Ų | 138.7 | 80% | 0.804 | 72% | 0.724 | S | S | * | * | S | Bend | trans | -160.5 | 84 | 170.2 | -73.7 | 0 | 0 | 0 | 0 | 110.7 | ||
| 40 | D | 39.9 | Very low | 45.4 | Very low | 159 Ų | 159 | 138.4 Ų | 138.4 | 85% | 0.85 | 73% | 0.731 | S | S | * | * | trans | -156.3 | 108.1 | 146.8 | -157 | -114.7 | 0 | 0 | 0 | 108.7 | ||||
| 41 | S | 41.4 | Very low | 45.1 | Very low | 109 Ų | 109 | 141.4 Ų | 141.4 | 76% | 0.762 | 74% | 0.74 | S | S | * | * | trans | -155.2 | 104.6 | 172.5 | -65.9 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 42 | E | 43.6 | Very low | 44.2 | Very low | 180 Ų | 180 | 143.6 Ų | 143.6 | 84% | 0.841 | 76% | 0.757 | S | S | * | * | trans | 58.4 | 118.4 | 147.4 | 13.4 | -170.3 | 103.8 | 0 | 0 | 119 | ||||
| 43 | L | 43.5 | Very low | 43.9 | Very low | 177 Ų | 177 | 138.8 Ų | 138.8 | 93% | 0.927 | 75% | 0.752 | S | S | * | * | -151.2 | 119.3 | 117.8 | -77 | -166.3 | 0 | 0 | 0 | 109.6 | |||||
| 44 | D | 46 | Very low | 43.7 | Very low | 148 Ų | 148 | 140 Ų | 140 | 79% | 0.791 | 77% | 0.773 | S | S | * | * | trans | -75.2 | 139.7 | 166 | -126.3 | -97 | 0 | 0 | 0 | 108.9 | ||||
| 45 | D | 40.8 | Very low | 43.6 | Very low | 145 Ų | 145 | 142.2 Ų | 142.2 | 78% | 0.775 | 79% | 0.786 | S | S | * | * | trans | -139.1 | 116.2 | 165.9 | -165.8 | -118 | 0 | 0 | 0 | 109.8 | V47 | D45-V47 WeakPolarHBondContact OD1-CG2 3.11Š| ||
| 46 | N | 45.5 | Very low | 43.8 | Very low | 134 Ų | 134 | 144.3 Ų | 144.3 | 72% | 0.717 | 79% | 0.791 | S | S | * | * | trans | -108.3 | 115.1 | -172.2 | -154.8 | -66.5 | 0 | 0 | 0 | 107.8 | ||||
| 47 | V | 43.3 | Very low | 43.8 | Very low | 108 Ų | 108 | 141.1 Ų | 141.1 | 66% | 0.655 | 79% | 0.788 | S | S | * | * | trans | -121.8 | 94 | -179.3 | -177.2 | 0 | 0 | 0 | 0 | 110.5 | D45 V49 | D45-V47 WeakPolarHBondContact OD1-CG2 3.11Å; V47-V49 HydrophobicContact CG1-CG2 3.95Å | ||
| 48 | E | 49.4 | Very low | 44 | Very low | 182 Ų | 182 | 139.8 Ų | 139.8 | 85% | 0.85 | 79% | 0.791 | S | S | * | * | trans | -68.3 | 115.9 | 153.5 | -67.8 | -177.1 | 114.5 | 0 | 0 | 109.6 | ||||
| 49 | V | 46.8 | Very low | 44 | Very low | 117 Ų | 117 | 143.1 Ų | 143.1 | 71% | 0.709 | 80% | 0.795 | S | S | * | * | trans | -145.7 | 93.4 | 154.3 | 176.6 | 0 | 0 | 0 | 0 | 105.5 | V47 | V47-V49 HydrophobicContact CG1-CG2 3.95Š| ||
| 50 | E | 42.1 | Very low | 44.2 | Very low | 185 Ų | 185 | 141.4 Ų | 141.4 | 86% | 0.864 | 79% | 0.787 | S | S | * | * | 94.3 | 138.8 | 85.2 | -164 | 177.3 | -175.6 | 0 | 0 | 111.4 | |||||
| 51 | K | 48.9 | Very low | 44 | Very low | 181 Ų | 181 | 141 Ų | 141 | 79% | 0.787 | 79% | 0.785 | S | S | * | * | trans | -106.8 | 110.7 | -169.9 | 167.2 | -168.2 | 173.3 | -173.7 | 0 | 108 | ||||
| 52 | D | 38.2 | Very low | 44.3 | Very low | 159 Ų | 159 | 140.9 Ų | 140.9 | 85% | 0.85 | 79% | 0.785 | S | S | * | * | trans | -108.7 | 140.6 | 168.4 | -172 | 40.3 | 0 | 0 | 0 | 111.3 | ||||
| 53 | S | 45 | Very low | 45.1 | Very low | 86 Ų | 86 | 138.7 Ų | 138.7 | 60% | 0.601 | 79% | 0.786 | S | S | * | * | trans | -124 | 107.7 | -171.7 | -47.9 | 0 | 0 | 0 | 0 | 109 | ||||
| 54 | G | 42.8 | Very low | 44.9 | Very low | 79 Ų | 79 | 133.9 Ų | 133.9 | 81% | 0.814 | 78% | 0.779 | S | S | * | * | trans | -107.9 | 72.8 | -174.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 55 | D | 50.5 | Low | 44.5 | Very low | 161 Ų | 161 | 132.6 Ų | 132.6 | 86% | 0.861 | 78% | 0.782 | S | S | * | * | trans | -88.7 | 122.2 | 154.8 | -84 | -65.1 | 0 | 0 | 0 | 108.1 | ||||
| 56 | E | 50.3 | Low | 44.9 | Very low | 194 Ų | 194 | 133.8 Ų | 133.8 | 91% | 0.907 | 79% | 0.785 | S | S | * | * | trans | -156.8 | 139.1 | 154.5 | -100.5 | -94.1 | 76.8 | 0 | 0 | 109.3 | ||||
| 57 | N | 43.2 | Very low | 45 | Very low | 141 Ų | 141 | 132.8 Ų | 132.8 | 75% | 0.754 | 79% | 0.788 | S | S | * | * | trans | -105.5 | 130.9 | -168.8 | 167.2 | 52.6 | 0 | 0 | 0 | 110.4 | ||||
| 58 | G | 39.9 | Very low | 45.2 | Very low | 75 Ų | 75 | 131.9 Ų | 131.9 | 77% | 0.773 | 78% | 0.784 | S | S | * | * | trans | -137.4 | 110.8 | -175.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 59 | Q | 41.8 | Very low | 45 | Very low | 171 Ų | 171 | 128.1 Ų | 128.1 | 80% | 0.799 | 78% | 0.779 | S | S | * | * | trans | -81.3 | 151.5 | -171.9 | -173.8 | 92.5 | 16.4 | 0 | 0 | 113.9 | ||||
| 60 | A | 44.3 | Very low | 45.3 | Very low | 78 Ų | 78 | 127 Ų | 127 | 65% | 0.645 | 77% | 0.772 | S | S | * | * | trans | 70.7 | 149.7 | 155.3 | 0 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 61 | D | 36.1 | Very low | 46 | Very low | 151 Ų | 151 | 122.4 Ų | 122.4 | 81% | 0.807 | 76% | 0.757 | S | S | * | * | cis | -158 | 171.1 | 5.2 | -125.8 | -38.3 | 0 | 0 | 0 | 114.2 | ||||
| 62 | S | 48 | Very low | 46.5 | Very low | 107 Ų | 107 | 118 Ų | 118 | 75% | 0.748 | 75% | 0.745 | S | S | * | * | trans | 74.6 | 130.1 | 161.2 | -69 | 0 | 0 | 0 | 0 | 122.4 | ||||
| 63 | P | 61.4 | Low | 47.6 | Very low | 133 Ų | 133 | 115 Ų | 115 | 86% | 0.864 | 73% | 0.733 | S | S | * | * | trans | -98.2 | 138.6 | 170.6 | 36.6 | -30.6 | 0 | 0 | 0 | 113.2 | ||||
| 64 | G | 38.9 | Very low | 48.5 | Very low | 77 Ų | 77 | 115.8 Ų | 115.8 | 79% | 0.794 | 73% | 0.727 | S | S | * | * | trans | -170.2 | 128.7 | 175 | 0 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 65 | S | 38 | Very low | 49.5 | Very low | 121 Ų | 121 | 116.1 Ų | 116.1 | 85% | 0.846 | 71% | 0.713 | S | S | * | * | trans | 72.8 | 100.6 | 156.7 | -150.6 | 0 | 0 | 0 | 0 | 121.4 | ||||
| 66 | M | 47.8 | Very low | 50.3 | Low | 170 Ų | 170 | 113.3 Ų | 113.3 | 84% | 0.837 | 70% | 0.695 | S | S | * | * | trans | 6.3 | 113.7 | 140.1 | -53.2 | -58.9 | 173.8 | 0 | 0 | 120.6 | ||||
| 67 | S | 48.3 | Very low | 51 | Low | 112 Ų | 112 | 106.3 Ų | 106.3 | 78% | 0.783 | 67% | 0.67 | S | S | * | * | trans | 62.3 | 147.1 | 142 | -62.3 | 0 | 0 | 0 | 0 | 121.9 | ||||
| 68 | P | 47.9 | Very low | 52.1 | Low | 89 Ų | 89 | 106.9 Ų | 106.9 | 58% | 0.578 | 66% | 0.662 | S | S | * | * | cis | -128.3 | 94.8 | -21.4 | 35.7 | -16.3 | 0 | 0 | 0 | 112.1 | T70 | P68-T70 PolarHBondContact O-N 3.03Š| ||
| 69 | S | 44.9 | Very low | 53.5 | Low | 104 Ų | 104 | 111 Ų | 111 | 73% | 0.727 | 66% | 0.658 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.8 | 4.6 | -179.9 | -59.1 | 0 | 0 | 0 | 0 | 115.7 | T73 | S69-T73 PolarHBondContact O-OG1 3.25Š|
| 70 | T | 53.8 | Low | 54.7 | Low | 93 Ų | 93 | 111.7 Ų | 111.7 | 57% | 0.571 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -74.1 | -33 | -179.8 | 52.8 | 0 | 0 | 0 | 0 | 112.9 | P68 Q74 | P68-T70 PolarHBondContact O-N 3.03Å; T70-Q74 WeakPolarHBondContact O-CG 3.29Å; T70-Q74 PolarHBondContact O-N 3.06Å |
| 71 | T | 55.5 | Low | 55.9 | Low | 89 Ų | 89 | 117 Ų | 117 | 55% | 0.546 | 66% | 0.657 | S | S | . | * | H | α-helix | trans | -67.9 | -48.8 | -176.1 | -55.4 | 0 | 0 | 0 | 0 | 112.2 | T73 Q74 V75 | T71-T73 VanDerWaalsContact C-N 3.33Å; T71-T73 PolarHBondContact O-N 3.48Å; T71-Q74 PolarHBondContact O-N 2.94Å; T71-V75 WeakPolarHBondContact O-CG2 3.21Å; T71-V75 PolarHBondContact O-N 2.97Å |
| 72 | T | 59.1 | Low | 58 | Low | 89 Ų | 89 | 119.2 Ų | 119.2 | 55% | 0.546 | 65% | 0.654 | S | S | . | * | H | α-helix | trans | -59.3 | -44.2 | 177.6 | -62.6 | 0 | 0 | 0 | 0 | 111.4 | Q74 V75 Q76 | T72-Q74 PolarHBondContact O-N 3.46Å; T72-V75 PolarHBondContact O-N 3.25Å; T72-Q76 WeakPolarHBondContact O-CG 3.33Å; T72-Q76 PolarHBondContact O-N 3.46Å |
| 73 | T | 61.6 | Low | 59.7 | Low | 96 Ų | 96 | 115.9 Ų | 115.9 | 59% | 0.589 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -63 | -41.5 | 178 | -52.9 | 0 | 0 | 0 | 0 | 111.8 | S69 T71 Q76 A77 | S69-T73 PolarHBondContact O-OG1 3.25Å; T71-T73 VanDerWaalsContact C-N 3.33Å; T71-T73 PolarHBondContact O-N 3.48Å; T73-Q76 PolarHBondContact O-N 2.86Å; T73-A77 WeakPolarHBondContact O-CB 3.46Å; T73-A77 PolarHBondContact O-N 3.27Å |
| 74 | Q | 64 | Low | 60.8 | Low | 101 Ų | 101 | 113.7 Ų | 113.7 | 47% | 0.472 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -65.3 | -41.1 | 173.1 | -78.3 | -159.9 | 40.2 | 0 | 0 | 113.2 | T70 T71 T72 A77 R78 | T70-Q74 WeakPolarHBondContact O-CG 3.29Å; T70-Q74 PolarHBondContact O-N 3.06Å; T71-Q74 PolarHBondContact O-N 2.94Å; T72-Q74 PolarHBondContact O-N 3.46Å; Q74-A77 PolarHBondContact O-N 3.06Å; Q74-R78 WeakPolarHBondContact O-CB 3.49Å; Q74-R78 VanDerWaalsContact O-CG 3.25Å; Q74-R78 WeakPolarHBondContact O-CG 3.36Å; Q74-R78 PolarHBondContact O-N 3.3Å |
| 75 | V | 64.7 | Low | 63.2 | Low | 87 Ų | 87 | 115.6 Ų | 115.6 | 53% | 0.527 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -64.2 | -43 | 177.7 | 171.5 | 0 | 0 | 0 | 0 | 110.7 | T71 T72 R78 K79 | T71-V75 WeakPolarHBondContact O-CG2 3.21Å; T71-V75 PolarHBondContact O-N 2.97Å; T72-V75 PolarHBondContact O-N 3.25Å; V75-R78 PolarHBondContact O-N 2.93Å; V75-K79 WeakPolarHBondContact O-CB 3.06Å; V75-K79 PolarHBondContact O-N 3.42Å |
| 76 | Q | 66.8 | Low | 65.8 | Low | 102 Ų | 102 | 112.7 Ų | 112.7 | 48% | 0.477 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -64.4 | -41.5 | 173.7 | -69.4 | -169.9 | 19.8 | 0 | 0 | 112.2 | T72 T73 R78 K79 R80 | T72-Q76 WeakPolarHBondContact O-CG 3.33Å; T72-Q76 PolarHBondContact O-N 3.46Å; T73-Q76 PolarHBondContact O-N 2.86Å; Q76-R78 PolarHBondContact O-N 3.43Å; Q76-K79 PolarHBondContact O-N 3.44Å; Q76-R80 WeakPolarHBondContact O-CG 3.19Å; Q76-R80 PolarHBondContact O-N 2.87Å |
| 77 | A | 65.6 | Low | 68 | Low | 47 Ų | 47 | 110.8 Ų | 110.8 | 39% | 0.388 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -62.3 | -41.2 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | T73 Q74 R80 R81 | T73-A77 WeakPolarHBondContact O-CB 3.46Å; T73-A77 PolarHBondContact O-N 3.27Å; Q74-A77 PolarHBondContact O-N 3.06Å; A77-R80 PolarHBondContact O-N 2.91Å; A77-R81 WeakPolarHBondContact O-CG 3.2Å; A77-R81 PolarHBondContact O-N 2.85Å |
| 78 | R | 66.3 | Low | 70.2 | Confident | 152 Ų | 152 | 113.3 Ų | 113.3 | 57% | 0.574 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -63.5 | -40.8 | 172.9 | -68.9 | 170.9 | -164.8 | -164.6 | 6.9 | 111.3 | Q74 V75 Q76 R81 R82 | Q74-R78 WeakPolarHBondContact O-CB 3.49Å; Q74-R78 VanDerWaalsContact O-CG 3.25Å; Q74-R78 WeakPolarHBondContact O-CG 3.36Å; Q74-R78 PolarHBondContact O-N 3.3Å; V75-R78 PolarHBondContact O-N 2.93Å; Q76-R78 PolarHBondContact O-N 3.43Å; R78-R81 PolarHBondContact O-N 2.9Å; R78-R82 WeakPolarHBondContact O-CG 3.3Å; R78-R82 PolarHBondContact O-N 3.2Å |
| 79 | K | 68.9 | Low | 72.6 | Confident | 163 Ų | 163 | 115.6 Ų | 115.6 | 71% | 0.709 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -64.8 | -43.4 | 175.2 | -168.7 | 174.7 | -179.7 | 179.6 | 0 | 112.1 | V75 Q76 R82 G83 | V75-K79 WeakPolarHBondContact O-CB 3.06Å; V75-K79 PolarHBondContact O-N 3.42Å; Q76-K79 PolarHBondContact O-N 3.44Å; K79-R82 PolarHBondContact O-N 3.21Å; K79-G83 PolarHBondContact O-N 2.91Å |
| 80 | R | 67.1 | Low | 75 | Confident | 184 Ų | 184 | 117 Ų | 117 | 69% | 0.694 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -62.1 | -45.5 | 174.1 | -70.9 | -177.3 | -172 | -148.5 | 4.9 | 111.7 | Q76 A77 R82 G83 I84 | Q76-R80 WeakPolarHBondContact O-CG 3.19Å; Q76-R80 PolarHBondContact O-N 2.87Å; A77-R80 PolarHBondContact O-N 2.91Å; R80-R82 PolarHBondContact O-N 2.94Å; R80-G83 PolarHBondContact O-N 3.05Å; R80-G83 VanDerWaalsContact O-N 3.14Å; R80-I84 WeakPolarHBondContact O-CG1 3.23Å; R80-I84 PolarHBondContact O-N 3.29Å; R80-I84 VanDerWaalsContact O-N 3.07Å |
| 81 | R | 69.4 | Low | 77.1 | Confident | 191 Ų | 191 | 115.7 Ų | 115.7 | 72% | 0.721 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -60.3 | -43 | 174.9 | -75.3 | -175.4 | -180 | -141.7 | 1.4 | 112.7 | A77 R78 G83 I84 I85 | A77-R81 WeakPolarHBondContact O-CG 3.2Å; A77-R81 PolarHBondContact O-N 2.85Å; R78-R81 PolarHBondContact O-N 2.9Å; R81-G83 VanDerWaalsContact C-N 3.32Å; R81-G83 PolarHBondContact O-N 2.98Å; R81-I84 PolarHBondContact O-N 3.29Å; R81-I85 PolarHBondContact O-N 3.39Å |
| 82 | R | 79.4 | Confident | 79.1 | Confident | 196 Ų | 196 | 120.6 Ų | 120.6 | 74% | 0.74 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -60 | -41.4 | 172.7 | -73.5 | 175.9 | 179.8 | -165.8 | -0.6 | 111.8 | R78 K79 R80 I84 I85 E86 | R78-R82 WeakPolarHBondContact O-CG 3.3Å; R78-R82 PolarHBondContact O-N 3.2Å; K79-R82 PolarHBondContact O-N 3.21Å; R80-R82 PolarHBondContact O-N 2.94Å; R82-I84 PolarHBondContact O-N 3.19Å; R82-I85 PolarHBondContact O-N 3.33Å; R82-E86 PolarHBondContact O-N 3.29Å |
| 83 | G | 84.8 | Confident | 80.8 | Confident | 37 Ų | 37 | 119.1 Ų | 119.1 | 38% | 0.381 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -59.8 | -40.2 | 175.5 | 0 | 0 | 0 | 0 | 0 | 114.1 | K79 R80 R81 E86 K87 | K79-G83 PolarHBondContact O-N 2.91Å; R80-G83 PolarHBondContact O-N 3.05Å; R80-G83 VanDerWaalsContact O-N 3.14Å; R81-G83 VanDerWaalsContact C-N 3.32Å; R81-G83 PolarHBondContact O-N 2.98Å; G83-E86 PolarHBondContact O-N 2.91Å; G83-K87 WeakPolarHBondContact O-CB 3.46Å; G83-K87 PolarHBondContact O-N 3.48Å |
| 84 | I | 84.9 | Confident | 82.5 | Confident | 88 Ų | 88 | 118.5 Ų | 118.5 | 45% | 0.451 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -66 | -43 | 177.5 | -64.2 | 165.4 | 0 | 0 | 0 | 111.4 | R80 R81 R82 K87 R88 | R80-I84 WeakPolarHBondContact O-CG1 3.23Å; R80-I84 PolarHBondContact O-N 3.29Å; R80-I84 VanDerWaalsContact O-N 3.07Å; R81-I84 PolarHBondContact O-N 3.29Å; R82-I84 PolarHBondContact O-N 3.19Å; I84-K87 PolarHBondContact O-N 2.96Å; I84-R88 WeakPolarHBondContact O-CG 3.46Å; I84-R88 PolarHBondContact O-N 2.88Å |
| 85 | I | 87.8 | Confident | 84 | Confident | 116 Ų | 116 | 119 Ų | 119 | 60% | 0.595 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -64 | -44.6 | 178 | -64.2 | 167.4 | 0 | 0 | 0 | 110.3 | R81 R82 R88 R89 | R81-I85 PolarHBondContact O-N 3.39Å; R82-I85 PolarHBondContact O-N 3.33Å; I85-R88 PolarHBondContact O-N 2.79Å; I85-R89 PolarHBondContact O-N 3.12Å |
| 86 | E | 93.5 | Very high | 85.5 | Confident | 60 Ų | 60 | 117.5 Ų | 117.5 | 28% | 0.28 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -70.8 | -29.5 | 178.6 | -179.6 | 53.3 | -156.6 | 0 | 0 | 113.1 | R82 G83 R89 R90 | R82-E86 PolarHBondContact O-N 3.29Å; G83-E86 PolarHBondContact O-N 2.91Å; E86-R89 IonicContact OE1-CZ 2.66Å; E86-R89 IonicContact OE1-NE 3.33Å; E86-R89 PolarHBondContact OE1-NE 3.33Å; E86-R89 IonicContact OE1-NH2 2.81Å; E86-R89 PolarHBondContact OE1-NH2 3.24Å; E86-R89 IonicContact OE2-CZ 3.32Å; E86-R89 IonicContact OE2-NE 2.73Å; E86-R89 PolarHBondContact OE2-NE 3.01Å; E86-R89 IonicContact OE2-NH2 3.17Å; E86-R89 PolarHBondContact OE2-NH2 2.92Å; E86-R90 WeakPolarHBondContact O-CG 3.43Å; E86-R90 PolarHBondContact O-N 3.44Å; E86-R90 VanDerWaalsContact O-N 3.12Å; E86-R90 PolarHBondContact O-NE 2.89Å; E86-R90 IonicContact OE1-NE 3.7Å |
| 87 | K | 93 | Very high | 86.9 | Confident | 130 Ų | 130 | 113.3 Ų | 113.3 | 57% | 0.565 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -61.2 | -55.4 | 168.5 | -173.7 | 179.6 | 174.9 | 179.7 | 0 | 109.8 | G83 I84 R89 R90 D91 | G83-K87 WeakPolarHBondContact O-CB 3.46Å; G83-K87 PolarHBondContact O-N 3.48Å; I84-K87 PolarHBondContact O-N 2.96Å; K87-R89 VanDerWaalsContact C-N 3.26Å; K87-R89 PolarHBondContact O-N 2.73Å; K87-R90 WeakPolarHBondContact O-CA 3.37Å; K87-R90 PolarHBondContact O-N 2.85Å; K87-D91 PolarHBondContact O-N 3.25Å |
| 88 | R | 95.3 | Very high | 88.2 | Confident | 166 Ų | 166 | 114.2 Ų | 114.2 | 63% | 0.626 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -56.4 | -35.5 | 177.4 | -69.3 | 174.9 | -179 | 164.5 | -0.6 | 113.3 | I84 I85 R92 | I84-R88 WeakPolarHBondContact O-CG 3.46Å; I84-R88 PolarHBondContact O-N 2.88Å; I85-R88 PolarHBondContact O-N 2.79Å; R88-R92 WeakPolarHBondContact O-CG 3.42Å; R88-R92 PolarHBondContact O-N 3.37Å; R88-R92 VanDerWaalsContact O-N 3.1Å |
| 89 | R | 97.3 | Very high | 89.6 | Confident | 137 Ų | 137 | 111.9 Ų | 111.9 | 52% | 0.517 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -63.6 | -46.8 | 173.8 | -169.6 | -178 | 72.9 | 119.8 | 2.7 | 111.5 | I85 E86 K87 R92 I93 | I85-R89 PolarHBondContact O-N 3.12Å; E86-R89 IonicContact OE1-CZ 2.66Å; E86-R89 IonicContact OE1-NE 3.33Å; E86-R89 PolarHBondContact OE1-NE 3.33Å; E86-R89 IonicContact OE1-NH2 2.81Å; E86-R89 PolarHBondContact OE1-NH2 3.24Å; E86-R89 IonicContact OE2-CZ 3.32Å; E86-R89 IonicContact OE2-NE 2.73Å; E86-R89 PolarHBondContact OE2-NE 3.01Å; E86-R89 IonicContact OE2-NH2 3.17Å; E86-R89 PolarHBondContact OE2-NH2 2.92Å; K87-R89 VanDerWaalsContact C-N 3.26Å; K87-R89 PolarHBondContact O-N 2.73Å; R89-R92 PolarHBondContact O-N 3.48Å; R89-I93 HydrophobicContact CG-CD1 4.25Å; R89-I93 WeakPolarHBondContact O-CG1 3.22Å; R89-I93 PolarHBondContact O-N 2.82Å; R89-I93 VanDerWaalsContact O-N 3.15Å |
| 90 | R | 97.1 | Very high | 90.9 | Very high | 133 Ų | 133 | 106.4 Ų | 106.4 | 50% | 0.502 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -65.7 | -41.4 | 178 | -73.5 | -179.5 | -75.2 | -177.4 | -2.4 | 112.1 | E86 K87 R92 I93 N94 | E86-R90 WeakPolarHBondContact O-CG 3.43Å; E86-R90 PolarHBondContact O-N 3.44Å; E86-R90 VanDerWaalsContact O-N 3.12Å; E86-R90 PolarHBondContact O-NE 2.89Å; E86-R90 IonicContact OE1-NE 3.7Å; K87-R90 WeakPolarHBondContact O-CA 3.37Å; K87-R90 PolarHBondContact O-N 2.85Å; R90-R92 PolarHBondContact O-N 2.83Å; R90-I93 PolarHBondContact O-N 3.36Å; R90-N94 VanDerWaalsContact O-CG 3.3Å; R90-N94 PolarHBondContact O-N 2.87Å; R90-N94 PolarHBondContact O-ND2 2.76Å |
| 91 | D | 96.4 | Very high | 92.1 | Very high | 66 Ų | 66 | 100.6 Ų | 100.6 | 35% | 0.353 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -59.3 | -46.7 | 176.3 | -56.3 | -25.2 | 0 | 0 | 0 | 110.8 | K87 I93 N94 N95 | K87-D91 PolarHBondContact O-N 3.25Å; D91-I93 PolarHBondContact O-N 3.01Å; D91-N94 PolarHBondContact O-N 2.8Å; D91-N95 VanDerWaalsContact O-CG 3.25Å; D91-N95 PolarHBondContact O-N 3.49Å; D91-N95 PolarHBondContact O-OD1 3.44Å |
| 92 | R | 97.2 | Very high | 93.3 | Very high | 191 Ų | 191 | 98.7 Ų | 98.7 | 72% | 0.721 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -58.7 | -42.2 | 174.5 | -74.4 | 177.8 | 66.7 | -137.3 | -2.7 | 113.3 | R88 R89 R90 S96 | R88-R92 WeakPolarHBondContact O-CG 3.42Å; R88-R92 PolarHBondContact O-N 3.37Å; R88-R92 VanDerWaalsContact O-N 3.1Å; R89-R92 PolarHBondContact O-N 3.48Å; R90-R92 PolarHBondContact O-N 2.83Å; R92-S96 PolarHBondContact O-N 3.36Å; R92-S96 VanDerWaalsContact O-N 3.11Å; R92-S96 PolarHBondContact O-OG 3.25Å |
| 93 | I | 95.9 | Very high | 93.9 | Very high | 58 Ų | 58 | 94 Ų | 94 | 30% | 0.297 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -64.5 | -44.4 | 177.2 | -69.3 | 165.4 | 0 | 0 | 0 | 110.4 | R89 R90 D91 S96 L97 | R89-I93 HydrophobicContact CG-CD1 4.25Å; R89-I93 WeakPolarHBondContact O-CG1 3.22Å; R89-I93 PolarHBondContact O-N 2.82Å; R89-I93 VanDerWaalsContact O-N 3.15Å; R90-I93 PolarHBondContact O-N 3.36Å; D91-I93 PolarHBondContact O-N 3.01Å; I93-S96 PolarHBondContact O-N 3.31Å; I93-S96 PolarHBondContact O-OG 3.44Å; I93-L97 HydrophobicContact CG2-CD1 4.15Å; I93-L97 WeakPolarHBondContact O-CG 3.25Å; I93-L97 PolarHBondContact O-N 3.11Å; I93-L97 VanDerWaalsContact O-N 3.1Å |
| 94 | N | 96.1 | Very high | 94.3 | Very high | 84 Ų | 84 | 92.4 Ų | 92.4 | 45% | 0.449 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -65.3 | -40.8 | 179.3 | -68.7 | -17.1 | 0 | 0 | 0 | 111.8 | R90 D91 S96 L97 S98 | R90-N94 VanDerWaalsContact O-CG 3.3Å; R90-N94 PolarHBondContact O-N 2.87Å; R90-N94 PolarHBondContact O-ND2 2.76Å; D91-N94 PolarHBondContact O-N 2.8Å; N94-S96 PolarHBondContact O-N 3.12Å; N94-L97 PolarHBondContact O-N 2.74Å; N94-S98 PolarHBondContact O-N 3.33Å; N94-S98 PolarHBondContact O-OG 2.99Å |
| 95 | N | 96.6 | Very high | 94.6 | Very high | 112 Ų | 112 | 91.9 Ų | 91.9 | 60% | 0.599 | 43% | 0.428 | S | S | * | . | H | α-helix | trans | -58.2 | -46.4 | 173.7 | -69.2 | 4.9 | 0 | 0 | 0 | 111.4 | D91 L97 S98 E99 | D91-N95 VanDerWaalsContact O-CG 3.25Å; D91-N95 PolarHBondContact O-N 3.49Å; D91-N95 PolarHBondContact O-OD1 3.44Å; N95-L97 VanDerWaalsContact C-N 3.3Å; N95-L97 PolarHBondContact O-N 2.85Å; N95-S98 PolarHBondContact O-N 2.79Å; N95-E99 PolarHBondContact O-N 3.36Å |
| 96 | S | 96.9 | Very high | 94.7 | Very high | 55 Ų | 55 | 88.6 Ų | 88.6 | 39% | 0.385 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -63.2 | -32.6 | 177.1 | 64 | 0 | 0 | 0 | 0 | 113.5 | R92 I93 N94 E99 L100 | R92-S96 PolarHBondContact O-N 3.36Å; R92-S96 VanDerWaalsContact O-N 3.11Å; R92-S96 PolarHBondContact O-OG 3.25Å; I93-S96 PolarHBondContact O-N 3.31Å; I93-S96 PolarHBondContact O-OG 3.44Å; N94-S96 PolarHBondContact O-N 3.12Å; S96-E99 PolarHBondContact O-N 2.66Å; S96-L100 VanDerWaalsContact O-CG 3.3Å; S96-L100 WeakPolarHBondContact O-CG 3.15Å; S96-L100 PolarHBondContact O-N 3.17Å |
| 97 | L | 94.8 | Very high | 94.6 | Very high | 14 Ų | 14 | 85.8 Ų | 85.8 | 7% | 0.073 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -71.6 | -39.2 | 175.6 | -70.2 | 163.4 | 0 | 0 | 0 | 112.4 | I93 N94 N95 E99 L100 R101 K118 I121 L122 | I93-L97 HydrophobicContact CG2-CD1 4.15Å; I93-L97 WeakPolarHBondContact O-CG 3.25Å; I93-L97 PolarHBondContact O-N 3.11Å; I93-L97 VanDerWaalsContact O-N 3.1Å; N94-L97 PolarHBondContact O-N 2.74Å; N95-L97 VanDerWaalsContact C-N 3.3Å; N95-L97 PolarHBondContact O-N 2.85Å; L97-E99 VanDerWaalsContact C-N 3.32Å; L97-L100 PolarHBondContact O-N 3.01Å; L97-R101 PolarHBondContact O-N 2.83Å; L97-K118 HydrophobicContact CD1-CD 3.65Å; L97-K118 HydrophobicContact CD1-CG 3.91Å; L97-K118 HydrophobicContact CD2-CG 4.19Å; L97-I121 HydrophobicContact CD2-CG2 4.49Å; L97-L122 HydrophobicContact CD2-CD2 4.07Å; L97-L122 HydrophobicContact CD2-CG 4.29Å |
| 98 | S | 93.9 | Very high | 94.5 | Very high | 66 Ų | 66 | 85.1 Ų | 85.1 | 46% | 0.462 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -64.8 | -38 | 173 | -63.4 | 0 | 0 | 0 | 0 | 111.6 | N94 N95 R101 R102 | N94-S98 PolarHBondContact O-N 3.33Å; N94-S98 PolarHBondContact O-OG 2.99Å; N95-S98 PolarHBondContact O-N 2.79Å; S98-R101 PolarHBondContact O-N 2.97Å; S98-R102 PolarHBondContact O-N 3.27Å |
| 99 | E | 95.6 | Very high | 94.1 | Very high | 103 Ų | 103 | 85 Ų | 85 | 48% | 0.481 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -65.5 | -44 | 173.6 | -175.3 | 168.2 | -153.8 | 0 | 0 | 112 | N95 S96 L97 R101 R102 L103 | N95-E99 PolarHBondContact O-N 3.36Å; S96-E99 PolarHBondContact O-N 2.66Å; L97-E99 VanDerWaalsContact C-N 3.32Å; E99-R101 PolarHBondContact O-N 2.97Å; E99-R102 PolarHBondContact O-N 3.38Å; E99-R102 VanDerWaalsContact O-N 3.08Å; E99-L103 HydrophobicContact CG-CD1 3.74Å; E99-L103 HydrophobicContact CG-CG 4.17Å; E99-L103 WeakPolarHBondContact O-CG 3.22Å; E99-L103 PolarHBondContact O-N 3.15Å |
| 100 | L | 96.2 | Very high | 93.4 | Very high | 48 Ų | 48 | 83 Ų | 83 | 25% | 0.251 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -58.9 | -41.8 | 175.1 | -75.1 | 177.1 | 0 | 0 | 0 | 112.8 | S96 L97 R102 L103 V104 I121 L122 T125 | S96-L100 VanDerWaalsContact O-CG 3.3Å; S96-L100 WeakPolarHBondContact O-CG 3.15Å; S96-L100 PolarHBondContact O-N 3.17Å; L97-L100 PolarHBondContact O-N 3.01Å; L100-R102 PolarHBondContact O-N 2.82Å; L100-L103 PolarHBondContact O-N 3.45Å; L100-V104 WeakPolarHBondContact O-CB 3.19Å; L100-V104 WeakPolarHBondContact O-CG2 3.38Å; L100-V104 PolarHBondContact O-N 3.29Å; L100-I121 HydrophobicContact CB-CG2 4Å; L100-L122 HydrophobicContact CD1-CD2 4.39Å; L100-T125 HydrophobicContact CD1-CG2 4.37Å; L100-T125 HydrophobicContact CD2-CG2 3.75Å |
| 101 | R | 92.3 | Very high | 92.3 | Very high | 62 Ų | 62 | 82 Ų | 82 | 23% | 0.234 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -55.5 | -39.7 | 173.7 | -76.1 | -175.8 | -178.7 | 132.1 | -7.8 | 112.3 | L97 S98 E99 A107 F108 L116 I121 | L97-R101 PolarHBondContact O-N 2.83Å; S98-R101 PolarHBondContact O-N 2.97Å; E99-R101 PolarHBondContact O-N 2.97Å; R101-A107 CarbonylContact O-C 3.51Å; R101-F108 VanDerWaalsContact O-CA 3.29Å; R101-F108 WeakPolarHBondContact O-CA 3.46Å; R101-F108 WeakPolarHBondContact O-CB 3.48Å; R101-F108 PolarHBondContact O-N 3.39Å; R101-F108 VanDerWaalsContact O-N 3.08Å; R101-L116 HydrophobicContact CG-CD1 4.39Å; R101-L116 PolarHBondContact NH2-O 2.9Å; R101-I121 HydrophobicContact CG-CD1 3.94Å; R101-I121 HydrophobicContact CG-CG1 3.87Å; R101-I121 HydrophobicContact CG-CG2 4.06Å; R101-I121 VanDerWaalsContact CZ-CD1 3.5Å |
| 102 | R | 93.4 | Very high | 91 | Very high | 151 Ų | 151 | 82.8 Ų | 82.8 | 57% | 0.57 | 43% | 0.426 | S | S | * | . | H | α-helix | trans | -78.7 | -28.5 | -179.1 | -167.1 | -175.6 | 63.6 | 78.3 | 3.8 | 113.4 | S98 E99 L100 | S98-R102 PolarHBondContact O-N 3.27Å; E99-R102 PolarHBondContact O-N 3.38Å; E99-R102 VanDerWaalsContact O-N 3.08Å; L100-R102 PolarHBondContact O-N 2.82Å |
| 103 | L | 93.1 | Very high | 89.2 | Confident | 96 Ų | 96 | 77.9 Ų | 77.9 | 50% | 0.503 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -89.2 | -26 | -176.9 | -69 | 179.6 | 0 | 0 | 0 | 114.1 | E99 L100 | E99-L103 HydrophobicContact CG-CD1 3.74Å; E99-L103 HydrophobicContact CG-CG 4.17Å; E99-L103 WeakPolarHBondContact O-CG 3.22Å; E99-L103 PolarHBondContact O-N 3.15Å; L100-L103 PolarHBondContact O-N 3.45Å |
| 104 | V | 92.6 | Very high | 88 | Confident | 4 Ų | 4 | 79.5 Ų | 79.5 | 2% | 0.024 | 44% | 0.443 | C | S | . | . | S | Bend | trans | -93.7 | 115.3 | -177.8 | 175.2 | 0 | 0 | 0 | 0 | 109.2 | L100 S106 A107 F108 M124 T125 H128 | L100-V104 WeakPolarHBondContact O-CB 3.19Å; L100-V104 WeakPolarHBondContact O-CG2 3.38Å; L100-V104 PolarHBondContact O-N 3.29Å; V104-S106 VanDerWaalsContact C-N 3.34Å; V104-S106 PolarHBondContact O-N 2.66Å; V104-A107 HydrophobicContact CB-CB 3.98Å; V104-A107 HydrophobicContact CG1-CB 4.06Å; V104-A107 PolarHBondContact O-N 3.49Å; V104-F108 PolarHBondContact O-N 3.44Å; V104-M124 HydrophobicContact CG1-CB 4.31Å; V104-T125 HydrophobicContact CG2-CG2 4.1Å; V104-H128 HydrophobicContact CG1-CB 3.92Å |
| 105 | P | 91 | Very high | 87.3 | Confident | 78 Ų | 78 | 84.9 Ų | 84.9 | 51% | 0.506 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -54.8 | -44 | -170.1 | -28.8 | 35.3 | 0 | 0 | 0 | 114.4 | A107 F108 E109 H128 | P105-A107 PolarHBondContact O-N 2.8Å; P105-F108 PolarHBondContact O-N 3.25Å; P105-E109 PolarHBondContact O-N 3Å; P105-H128 WeakPolarHBondContact CD-NE2 3.33Å |
| 106 | S | 90.3 | Very high | 86.7 | Confident | 47 Ų | 47 | 80.2 Ų | 80.2 | 33% | 0.329 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -68.1 | -34.4 | 179.2 | 53.3 | 0 | 0 | 0 | 0 | 112.8 | V104 K110 M124 | V104-S106 VanDerWaalsContact C-N 3.34Å; V104-S106 PolarHBondContact O-N 2.66Å; S106-K110 PolarHBondContact O-N 2.84Å; S106-M124 WeakPolarHBondContact O-CE 3.35Å |
| 107 | A | 90.8 | Very high | 86.4 | Confident | 0 Ų | 0 | 84.3 Ų | 84.3 | 0% | 0 | 45% | 0.45 | C | S | . | . | H | α-helix | trans | -74.9 | -31.9 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | R101 V104 P105 Q111 L116 M124 | R101-A107 CarbonylContact O-C 3.51Å; V104-A107 HydrophobicContact CB-CB 3.98Å; V104-A107 HydrophobicContact CG1-CB 4.06Å; V104-A107 PolarHBondContact O-N 3.49Å; P105-A107 PolarHBondContact O-N 2.8Å; A107-Q111 PolarHBondContact O-N 3.15Å; A107-L116 WeakPolarHBondContact O-CD1 3.21Å; A107-M124 HydrophobicContact CB-CB 4.42Å; A107-M124 HydrophobicContact CB-CE 4.34Å; A107-M124 HydrophobicContact CB-SD 4.05Å |
| 108 | F | 90.9 | Very high | 86.3 | Confident | 117 Ų | 117 | 88.9 Ų | 88.9 | 51% | 0.513 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -67.8 | -45.9 | 174 | 179.1 | -103.1 | 0 | 0 | 0 | 111.4 | R101 V104 P105 K110 Q111 | R101-F108 VanDerWaalsContact O-CA 3.29Å; R101-F108 WeakPolarHBondContact O-CA 3.46Å; R101-F108 WeakPolarHBondContact O-CB 3.48Å; R101-F108 PolarHBondContact O-N 3.39Å; R101-F108 VanDerWaalsContact O-N 3.08Å; V104-F108 PolarHBondContact O-N 3.44Å; P105-F108 PolarHBondContact O-N 3.25Å; F108-K110 VanDerWaalsContact C-N 3.3Å; F108-K110 PolarHBondContact O-N 2.82Å; F108-Q111 WeakPolarHBondContact O-CB 3.48Å; F108-Q111 PolarHBondContact O-N 2.84Å |
| 109 | E | 87.6 | Confident | 86.3 | Confident | 164 Ų | 164 | 89 Ų | 89 | 77% | 0.766 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -59.4 | -39.4 | 177.2 | -174.8 | 171 | -132.3 | 0 | 0 | 112.2 | P105 Q111 | P105-E109 PolarHBondContact O-N 3Å; E109-Q111 VanDerWaalsContact C-N 3.26Å; E109-Q111 PolarHBondContact O-N 2.8Å |
| 110 | K | 83.3 | Confident | 86.3 | Confident | 93 Ų | 93 | 87.1 Ų | 87.1 | 40% | 0.404 | 47% | 0.466 | S | S | . | . | G | 310 helix | trans | -74.2 | -6.2 | 174.1 | -69.7 | -163 | -178.5 | -167.4 | 0 | 114.9 | S106 F108 G112 S113 L116 E120 M124 | S106-K110 PolarHBondContact O-N 2.84Å; F108-K110 VanDerWaalsContact C-N 3.3Å; F108-K110 PolarHBondContact O-N 2.82Å; K110-G112 PolarHBondContact O-N 2.88Å; K110-G112 VanDerWaalsContact O-N 3.11Å; K110-S113 PolarHBondContact O-N 3.39Å; K110-L116 HydrophobicContact CB-CD1 4.08Å; K110-L116 HydrophobicContact CB-CD2 3.81Å; K110-L116 HydrophobicContact CB-CG 4.28Å; K110-L116 HydrophobicContact CD-CD2 3.82Å; K110-E120 IonicContact NZ-OE1 2.73Å; K110-E120 PolarHBondContact NZ-OE1 3.23Å; K110-M124 HydrophobicContact CD-CE 3.72Å; K110-M124 HydrophobicContact CD-SD 4.41Å; K110-M124 HydrophobicContact CG-CE 4.11Å |
| 111 | Q | 73.8 | Confident | 86.2 | Confident | 113 Ų | 113 | 84.9 Ų | 84.9 | 53% | 0.528 | 45% | 0.454 | S | S | . | . | G | 310 helix | trans | -61.9 | -23.4 | -176.4 | -167.6 | 176.8 | -62 | 0 | 0 | 113.1 | A107 F108 E109 | A107-Q111 PolarHBondContact O-N 3.15Å; F108-Q111 WeakPolarHBondContact O-CB 3.48Å; F108-Q111 PolarHBondContact O-N 2.84Å; E109-Q111 VanDerWaalsContact C-N 3.26Å; E109-Q111 PolarHBondContact O-N 2.8Å |
| 112 | G | 68.5 | Low | 86.4 | Confident | 83 Ų | 83 | 85.7 Ų | 85.7 | 86% | 0.856 | 46% | 0.463 | S | S | * | . | G | 310 helix | trans | -83.9 | -4.6 | 174.5 | 0 | 0 | 0 | 0 | 0 | 115.8 | K110 | K110-G112 PolarHBondContact O-N 2.88Å; K110-G112 VanDerWaalsContact O-N 3.11Å |
| 113 | S | 60.3 | Low | 86.5 | Confident | 88 Ų | 88 | 83.3 Ų | 83.3 | 62% | 0.615 | 46% | 0.458 | S | S | * | . | S | Bend | trans | -133.4 | 104.2 | -174.6 | -173.9 | 0 | 0 | 0 | 0 | 111.9 | K110 | K110-S113 PolarHBondContact O-N 3.39Š|
| 114 | A | 70 | Confident | 86.7 | Confident | 91 Ų | 91 | 79.8 Ų | 79.8 | 75% | 0.752 | 44% | 0.439 | S | S | * | . | S | Bend | trans | 59.9 | 160.6 | -178.7 | 0 | 0 | 0 | 0 | 0 | 115.9 | L116 | A114-L116 PolarHBondContact O-N 2.81Š|
| 115 | K | 82.6 | Confident | 86.8 | Confident | 198 Ų | 198 | 80.4 Ų | 80.4 | 86% | 0.861 | 44% | 0.443 | S | S | * | . | trans | -78.6 | 88 | -177.1 | -176.4 | 177.5 | 178.9 | 175.6 | 0 | 110.4 | E117 | K115-E117 PolarHBondContact O-N 3.38Š| ||
| 116 | L | 83.4 | Confident | 87.1 | Confident | 13 Ų | 13 | 79.9 Ų | 79.9 | 7% | 0.068 | 44% | 0.438 | C | S | . | . | trans | -40.3 | 123.8 | 177.1 | -73.2 | 176 | 0 | 0 | 0 | 112.9 | R101 A107 K110 A114 E120 I121 | R101-L116 HydrophobicContact CG-CD1 4.39Å; R101-L116 PolarHBondContact NH2-O 2.9Å; A107-L116 WeakPolarHBondContact O-CD1 3.21Å; K110-L116 HydrophobicContact CB-CD1 4.08Å; K110-L116 HydrophobicContact CB-CD2 3.81Å; K110-L116 HydrophobicContact CB-CG 4.28Å; K110-L116 HydrophobicContact CD-CD2 3.82Å; A114-L116 PolarHBondContact O-N 2.81Å; L116-E120 VanDerWaalsContact CD2-CD 3.49Å; L116-E120 HydrophobicContact CD2-CG 4.33Å; L116-E120 WeakPolarHBondContact CD2-OE2 3.19Å; L116-I121 HydrophobicContact CB-CG1 4.19Å | ||
| 117 | E | 91.2 | Very high | 87.3 | Confident | 141 Ų | 141 | 80.8 Ų | 80.8 | 66% | 0.659 | 44% | 0.44 | S | S | * | . | trans | -68.8 | 153.1 | 179.5 | -65.6 | -158.6 | 119.4 | 0 | 0 | 112 | K115 A119 E120 I121 | K115-E117 PolarHBondContact O-N 3.38Å; E117-A119 VanDerWaalsContact C-N 3.25Å; E117-A119 PolarHBondContact O-N 3.19Å; E117-E120 HydrophobicContact CB-CB 4.3Å; E117-E120 PolarHBondContact O-N 3.4Å; E117-E120 VanDerWaalsContact O-N 3.12Å; E117-I121 WeakPolarHBondContact O-CG1 3.24Å; E117-I121 PolarHBondContact O-N 2.87Å; E117-I121 VanDerWaalsContact O-N 3.11Å | ||
| 118 | K | 92.1 | Very high | 87.3 | Confident | 111 Ų | 111 | 82.9 Ų | 82.9 | 48% | 0.483 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -60.7 | -35 | 179.3 | 178.3 | 168.7 | 174 | 164.3 | 0 | 112.8 | L97 L122 | L97-K118 HydrophobicContact CD1-CD 3.65Å; L97-K118 HydrophobicContact CD1-CG 3.91Å; L97-K118 HydrophobicContact CD2-CG 4.19Å; K118-L122 HydrophobicContact CG-CD1 4.4Å; K118-L122 VanDerWaalsContact O-CG 3.32Å; K118-L122 WeakPolarHBondContact O-CG 3.38Å; K118-L122 PolarHBondContact O-N 2.86Å |
| 119 | A | 94.5 | Very high | 87.4 | Confident | 69 Ų | 69 | 81.3 Ų | 81.3 | 57% | 0.57 | 45% | 0.446 | S | S | * | . | H | α-helix | trans | -68 | -42.1 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | E117 L122 Q123 | E117-A119 VanDerWaalsContact C-N 3.25Å; E117-A119 PolarHBondContact O-N 3.19Å; A119-L122 PolarHBondContact O-N 2.93Å; A119-Q123 PolarHBondContact O-N 3.18Å |
| 120 | E | 94.5 | Very high | 87.5 | Confident | 62 Ų | 62 | 79.1 Ų | 79.1 | 29% | 0.29 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -62 | -47 | 179.7 | -167.3 | -179.3 | -174.5 | 0 | 0 | 111.8 | K110 L116 E117 L122 Q123 M124 | K110-E120 IonicContact NZ-OE1 2.73Å; K110-E120 PolarHBondContact NZ-OE1 3.23Å; L116-E120 VanDerWaalsContact CD2-CD 3.49Å; L116-E120 HydrophobicContact CD2-CG 4.33Å; L116-E120 WeakPolarHBondContact CD2-OE2 3.19Å; E117-E120 HydrophobicContact CB-CB 4.3Å; E117-E120 PolarHBondContact O-N 3.4Å; E117-E120 VanDerWaalsContact O-N 3.12Å; E120-L122 VanDerWaalsContact C-N 3.27Å; E120-L122 PolarHBondContact O-N 3.34Å; E120-Q123 PolarHBondContact O-N 3.46Å; E120-Q123 VanDerWaalsContact O-N 3.15Å; E120-M124 HydrophobicContact CG-CG 4.3Å; E120-M124 HydrophobicContact CG-SD 3.81Å; E120-M124 WeakPolarHBondContact O-CB 3.37Å; E120-M124 WeakPolarHBondContact O-CG 3.5Å; E120-M124 PolarHBondContact O-N 3.21Å |
| 121 | I | 93.9 | Very high | 87.7 | Confident | 2 Ų | 2 | 79.2 Ų | 79.2 | 1% | 0.01 | 44% | 0.437 | C | S | . | . | H | α-helix | trans | -55 | -45.2 | 176.3 | -55.9 | 159.2 | 0 | 0 | 0 | 111 | L97 L100 R101 L116 E117 T125 | L97-I121 HydrophobicContact CD2-CG2 4.49Å; L100-I121 HydrophobicContact CB-CG2 4Å; R101-I121 HydrophobicContact CG-CD1 3.94Å; R101-I121 HydrophobicContact CG-CG1 3.87Å; R101-I121 HydrophobicContact CG-CG2 4.06Å; R101-I121 VanDerWaalsContact CZ-CD1 3.5Å; L116-I121 HydrophobicContact CB-CG1 4.19Å; E117-I121 WeakPolarHBondContact O-CG1 3.24Å; E117-I121 PolarHBondContact O-N 2.87Å; E117-I121 VanDerWaalsContact O-N 3.11Å; I121-T125 WeakPolarHBondContact O-CB 3.46Å; I121-T125 PolarHBondContact O-N 2.76Å; I121-T125 PolarHBondContact O-OG1 3.49Å |
| 122 | L | 96.9 | Very high | 88.3 | Confident | 79 Ų | 79 | 76.6 Ų | 76.6 | 41% | 0.414 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -67.3 | -41.7 | -179.4 | -68 | 172.2 | 0 | 0 | 0 | 111.2 | L97 L100 K118 A119 E120 T125 V126 | L97-L122 HydrophobicContact CD2-CD2 4.07Å; L97-L122 HydrophobicContact CD2-CG 4.29Å; L100-L122 HydrophobicContact CD1-CD2 4.39Å; K118-L122 HydrophobicContact CG-CD1 4.4Å; K118-L122 VanDerWaalsContact O-CG 3.32Å; K118-L122 WeakPolarHBondContact O-CG 3.38Å; K118-L122 PolarHBondContact O-N 2.86Å; A119-L122 PolarHBondContact O-N 2.93Å; E120-L122 VanDerWaalsContact C-N 3.27Å; E120-L122 PolarHBondContact O-N 3.34Å; L122-T125 WeakPolarHBondContact O-CB 3.39Å; L122-T125 PolarHBondContact O-N 3.43Å; L122-V126 WeakPolarHBondContact O-CG2 3.18Å; L122-V126 PolarHBondContact O-N 2.99Å |
| 123 | Q | 96.1 | Very high | 89 | Confident | 101 Ų | 101 | 80 Ų | 80 | 47% | 0.472 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -62 | -50.2 | 176.4 | -173.8 | 58.7 | 48.5 | 0 | 0 | 111.5 | A119 E120 T125 V126 D127 | A119-Q123 PolarHBondContact O-N 3.18Å; E120-Q123 PolarHBondContact O-N 3.46Å; E120-Q123 VanDerWaalsContact O-N 3.15Å; Q123-T125 VanDerWaalsContact C-N 3.26Å; Q123-T125 PolarHBondContact O-N 2.77Å; Q123-V126 PolarHBondContact O-N 3.1Å; Q123-V126 VanDerWaalsContact O-N 3.1Å; Q123-D127 VanDerWaalsContact NE2-CG 3.29Å; Q123-D127 PolarHBondContact NE2-OD1 2.79Å; Q123-D127 PolarHBondContact NE2-OD2 3.42Å; Q123-D127 PolarHBondContact O-N 3.1Å |
| 124 | M | 95.8 | Very high | 90 | Very high | 22 Ų | 22 | 80.2 Ų | 80.2 | 11% | 0.108 | 43% | 0.426 | C | S | . | . | H | α-helix | trans | -59.8 | -37.4 | 177.2 | -63.7 | 172.6 | 95.4 | 0 | 0 | 111.9 | V104 S106 A107 K110 E120 H128 | V104-M124 HydrophobicContact CG1-CB 4.31Å; S106-M124 WeakPolarHBondContact O-CE 3.35Å; A107-M124 HydrophobicContact CB-CB 4.42Å; A107-M124 HydrophobicContact CB-CE 4.34Å; A107-M124 HydrophobicContact CB-SD 4.05Å; K110-M124 HydrophobicContact CD-CE 3.72Å; K110-M124 HydrophobicContact CD-SD 4.41Å; K110-M124 HydrophobicContact CG-CE 4.11Å; E120-M124 HydrophobicContact CG-CG 4.3Å; E120-M124 HydrophobicContact CG-SD 3.81Å; E120-M124 WeakPolarHBondContact O-CB 3.37Å; E120-M124 WeakPolarHBondContact O-CG 3.5Å; E120-M124 PolarHBondContact O-N 3.21Å; M124-H128 VanDerWaalsContact O-CB 3.3Å; M124-H128 WeakPolarHBondContact O-CB 3.3Å; M124-H128 PolarHBondContact O-N 2.9Å |
| 125 | T | 96.3 | Very high | 90 | Very high | 17 Ų | 17 | 78.8 Ų | 78.8 | 10% | 0.104 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -63.6 | -47.7 | 173.5 | -55.7 | 0 | 0 | 0 | 0 | 111.4 | L100 V104 I121 L122 Q123 D127 H128 L129 | L100-T125 HydrophobicContact CD1-CG2 4.37Å; L100-T125 HydrophobicContact CD2-CG2 3.75Å; V104-T125 HydrophobicContact CG2-CG2 4.1Å; I121-T125 WeakPolarHBondContact O-CB 3.46Å; I121-T125 PolarHBondContact O-N 2.76Å; I121-T125 PolarHBondContact O-OG1 3.49Å; L122-T125 WeakPolarHBondContact O-CB 3.39Å; L122-T125 PolarHBondContact O-N 3.43Å; Q123-T125 VanDerWaalsContact C-N 3.26Å; Q123-T125 PolarHBondContact O-N 2.77Å; T125-D127 PolarHBondContact O-N 3.29Å; T125-H128 PolarHBondContact O-N 3.21Å; T125-L129 HydrophobicContact CG2-CD1 4.27Å; T125-L129 WeakPolarHBondContact O-CG 3.35Å; T125-L129 PolarHBondContact O-N 2.91Å |
| 126 | V | 96.2 | Very high | 89.3 | Confident | 66 Ų | 66 | 71.6 Ų | 71.6 | 40% | 0.4 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -63 | -41.9 | 179.9 | 166 | 0 | 0 | 0 | 0 | 111.2 | L122 Q123 L129 K130 | L122-V126 WeakPolarHBondContact O-CG2 3.18Å; L122-V126 PolarHBondContact O-N 2.99Å; Q123-V126 PolarHBondContact O-N 3.1Å; Q123-V126 VanDerWaalsContact O-N 3.1Å; V126-L129 PolarHBondContact O-N 3.31Å; V126-K130 HydrophobicContact CG1-CD 4.4Å; V126-K130 WeakPolarHBondContact O-CG 3.28Å; V126-K130 PolarHBondContact O-N 2.69Å |
| 127 | D | 94.3 | Very high | 88.3 | Confident | 67 Ų | 67 | 73.2 Ų | 73.2 | 36% | 0.358 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -72.3 | -34 | 179.8 | -64.2 | -31.8 | 0 | 0 | 0 | 112.1 | Q123 T125 K130 M131 | Q123-D127 VanDerWaalsContact NE2-CG 3.29Å; Q123-D127 PolarHBondContact NE2-OD1 2.79Å; Q123-D127 PolarHBondContact NE2-OD2 3.42Å; Q123-D127 PolarHBondContact O-N 3.1Å; T125-D127 PolarHBondContact O-N 3.29Å; D127-K130 PolarHBondContact O-N 2.93Å; D127-K130 IonicContact OD1-NZ 3.7Å; D127-K130 PolarHBondContact OD1-NZ 2.9Å; D127-M131 WeakPolarHBondContact O-CB 3.31Å; D127-M131 PolarHBondContact O-N 2.93Å |
| 128 | H | 91.3 | Very high | 86.6 | Confident | 43 Ų | 43 | 71.9 Ų | 71.9 | 20% | 0.199 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -61.8 | -43.1 | 168.4 | -176.6 | -111.4 | 0 | 0 | 0 | 112 | V104 P105 M124 T125 M131 L132 | V104-H128 HydrophobicContact CG1-CB 3.92Å; P105-H128 WeakPolarHBondContact CD-NE2 3.33Å; M124-H128 VanDerWaalsContact O-CB 3.3Å; M124-H128 WeakPolarHBondContact O-CB 3.3Å; M124-H128 PolarHBondContact O-N 2.9Å; T125-H128 PolarHBondContact O-N 3.21Å; H128-M131 WeakPolarHBondContact CD2-CE 3.3Å; H128-M131 PolarHBondContact O-N 3.34Å; H128-L132 WeakPolarHBondContact O-CG 3.35Å; H128-L132 PolarHBondContact O-N 2.82Å |
| 129 | L | 92.4 | Very high | 84.9 | Confident | 84 Ų | 84 | 69.1 Ų | 69.1 | 44% | 0.44 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -63.7 | -44.6 | 174.4 | -70.2 | 172.4 | 0 | 0 | 0 | 111.8 | T125 V126 M131 L132 H133 | T125-L129 HydrophobicContact CG2-CD1 4.27Å; T125-L129 WeakPolarHBondContact O-CG 3.35Å; T125-L129 PolarHBondContact O-N 2.91Å; V126-L129 PolarHBondContact O-N 3.31Å; L129-M131 VanDerWaalsContact C-N 3.31Å; L129-M131 PolarHBondContact O-N 3.47Å; L129-L132 PolarHBondContact O-N 2.88Å; L129-H133 PolarHBondContact O-CD2 3.38Å; L129-H133 VanDerWaalsContact O-CD2 3.23Å; L129-H133 PolarHBondContact O-N 2.86Å |
| 130 | K | 90.9 | Very high | 82.9 | Confident | 118 Ų | 118 | 75.8 Ų | 75.8 | 51% | 0.513 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -57.8 | -43.5 | 174.1 | -72.5 | 173.3 | -168.6 | 156 | 0 | 111.8 | V126 D127 H133 A134 | V126-K130 HydrophobicContact CG1-CD 4.4Å; V126-K130 WeakPolarHBondContact O-CG 3.28Å; V126-K130 PolarHBondContact O-N 2.69Å; D127-K130 PolarHBondContact O-N 2.93Å; D127-K130 IonicContact OD1-NZ 3.7Å; D127-K130 PolarHBondContact OD1-NZ 2.9Å; K130-H133 PolarHBondContact O-N 3.34Å; K130-A134 WeakPolarHBondContact O-CB 3.39Å; K130-A134 PolarHBondContact O-N 3.46Å |
| 131 | M | 86.9 | Confident | 81.1 | Confident | 95 Ų | 95 | 77.8 Ų | 77.8 | 47% | 0.468 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -60.9 | -45.9 | 175.5 | 175.2 | -80.4 | -69.1 | 0 | 0 | 111.2 | D127 H128 L129 H133 A134 S135 | D127-M131 WeakPolarHBondContact O-CB 3.31Å; D127-M131 PolarHBondContact O-N 2.93Å; H128-M131 WeakPolarHBondContact CD2-CE 3.3Å; H128-M131 PolarHBondContact O-N 3.34Å; L129-M131 VanDerWaalsContact C-N 3.31Å; L129-M131 PolarHBondContact O-N 3.47Å; M131-H133 VanDerWaalsContact C-N 3.35Å; M131-H133 PolarHBondContact O-N 2.87Å; M131-A134 PolarHBondContact O-N 2.84Å; M131-S135 VanDerWaalsContact O-CB 3.23Å; M131-S135 WeakPolarHBondContact O-CB 3.39Å; M131-S135 PolarHBondContact O-N 3.15Å |
| 132 | L | 85.4 | Confident | 79.8 | Confident | 58 Ų | 58 | 83.4 Ų | 83.4 | 30% | 0.304 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -61 | -41.8 | 175.4 | -71.1 | 174.4 | 0 | 0 | 0 | 112.2 | H128 L129 G136 G137 | H128-L132 WeakPolarHBondContact O-CG 3.35Å; H128-L132 PolarHBondContact O-N 2.82Å; L129-L132 PolarHBondContact O-N 2.88Å; L132-G136 PolarHBondContact O-N 3.39Å; L132-G136 VanDerWaalsContact O-N 3.12Å; L132-G137 PolarHBondContact O-N 2.73Å |
| 133 | H | 83.6 | Confident | 78.7 | Confident | 154 Ų | 154 | 82.6 Ų | 82.6 | 71% | 0.713 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -66.8 | -44.3 | 176.4 | -84.8 | -83.1 | 0 | 0 | 0 | 112.5 | L129 K130 M131 S135 G136 | L129-H133 PolarHBondContact O-CD2 3.38Å; L129-H133 VanDerWaalsContact O-CD2 3.23Å; L129-H133 PolarHBondContact O-N 2.86Å; K130-H133 PolarHBondContact O-N 3.34Å; M131-H133 VanDerWaalsContact C-N 3.35Å; M131-H133 PolarHBondContact O-N 2.87Å; H133-S135 VanDerWaalsContact C-N 3.33Å; H133-S135 PolarHBondContact O-N 3.27Å; H133-G136 WeakPolarHBondContact O-CA 3.34Å; H133-G136 PolarHBondContact O-N 2.83Å |
| 134 | A | 80.9 | Confident | 77.5 | Confident | 93 Ų | 93 | 83.8 Ų | 83.8 | 77% | 0.769 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -65.6 | -35.3 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | K130 M131 G136 | K130-A134 WeakPolarHBondContact O-CB 3.39Å; K130-A134 PolarHBondContact O-N 3.46Å; M131-A134 PolarHBondContact O-N 2.84Å; A134-G136 PolarHBondContact O-N 2.93Å |
| 135 | S | 71.9 | Confident | 76.6 | Confident | 61 Ų | 61 | 84.9 Ų | 84.9 | 43% | 0.427 | 48% | 0.477 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -74.7 | -6.7 | 172.4 | -159.7 | 0 | 0 | 0 | 0 | 112.8 | M131 H133 K138 | M131-S135 VanDerWaalsContact O-CB 3.23Å; M131-S135 WeakPolarHBondContact O-CB 3.39Å; M131-S135 PolarHBondContact O-N 3.15Å; H133-S135 VanDerWaalsContact C-N 3.33Å; H133-S135 PolarHBondContact O-N 3.27Å; S135-K138 WeakPolarHBondContact O-CD 3.4Å; S135-K138 WeakPolarHBondContact O-CE 3.42Å; S135-K138 WeakPolarHBondContact O-CG 3.24Å; S135-K138 PolarHBondContact O-NZ 3.49Å |
| 136 | G | 66.3 | Low | 75.8 | Confident | 47 Ų | 47 | 88 Ų | 88 | 49% | 0.485 | 49% | 0.492 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 84.9 | 30.2 | 173.9 | 0 | 0 | 0 | 0 | 0 | 114.9 | L132 H133 A134 K138 | L132-G136 PolarHBondContact O-N 3.39Å; L132-G136 VanDerWaalsContact O-N 3.12Å; H133-G136 WeakPolarHBondContact O-CA 3.34Å; H133-G136 PolarHBondContact O-N 2.83Å; A134-G136 PolarHBondContact O-N 2.93Å; G136-K138 PolarHBondContact O-N 3.28Å |
| 137 | G | 62.2 | Low | 74.9 | Confident | 47 Ų | 47 | 87.4 Ų | 87.4 | 49% | 0.485 | 49% | 0.494 | S | S | . | . | S | Bend | trans | 68.4 | 16.1 | -180 | 0 | 0 | 0 | 0 | 0 | 114.2 | L132 G139 | L132-G137 PolarHBondContact O-N 2.73Å; G137-G139 VanDerWaalsContact C-N 3.3Å; G137-G139 PolarHBondContact O-N 2.88Å; G137-G139 VanDerWaalsContact O-N 3.11Å |
| 138 | K | 57.2 | Low | 74.3 | Confident | 114 Ų | 114 | 87.6 Ų | 87.6 | 50% | 0.496 | 49% | 0.492 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -73.8 | -2.2 | -159.8 | -71.6 | 177.6 | -161.5 | 153.9 | 0 | 116.8 | S135 G136 Y140 F141 E142 | S135-K138 WeakPolarHBondContact O-CD 3.4Å; S135-K138 WeakPolarHBondContact O-CE 3.42Å; S135-K138 WeakPolarHBondContact O-CG 3.24Å; S135-K138 PolarHBondContact O-NZ 3.49Å; G136-K138 PolarHBondContact O-N 3.28Å; K138-Y140 PolarHBondContact O-N 3.01Å; K138-F141 HydrophobicContact CB-CB 4.23Å; K138-F141 HydrophobicContact CG-CB 4.25Å; K138-F141 CarbonylContact O-C 3.5Å; K138-F141 WeakPolarHBondContact O-CA 3.32Å; K138-F141 PolarHBondContact O-N 3.3Å; K138-E142 WeakPolarHBondContact O-CB 3.22Å; K138-E142 PolarHBondContact O-N 2.99Å |
| 139 | G | 55.3 | Low | 73.8 | Confident | 52 Ų | 52 | 89.8 Ų | 89.8 | 54% | 0.536 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -53.8 | -30.2 | 179.3 | 0 | 0 | 0 | 0 | 0 | 114.5 | G137 | G137-G139 VanDerWaalsContact C-N 3.3Å; G137-G139 PolarHBondContact O-N 2.88Å; G137-G139 VanDerWaalsContact O-N 3.11Å |
| 140 | Y | 52.8 | Low | 73.3 | Confident | 210 Ų | 210 | 92 Ų | 92 | 82% | 0.824 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -87.1 | -32.1 | 170.7 | -77.2 | -87.8 | 0 | 0 | 0 | 113.9 | K138 E142 | K138-Y140 PolarHBondContact O-N 3.01Å; Y140-E142 VanDerWaalsContact C-N 3.34Å |
| 141 | F | 56.9 | Low | 72.9 | Confident | 104 Ų | 104 | 94.4 Ų | 94.4 | 46% | 0.456 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -70.2 | -29.7 | 175.1 | -87.2 | -71.4 | 0 | 0 | 0 | 113.2 | K138 H144 A145 H201 | K138-F141 HydrophobicContact CB-CB 4.23Å; K138-F141 HydrophobicContact CG-CB 4.25Å; K138-F141 CarbonylContact O-C 3.5Å; K138-F141 WeakPolarHBondContact O-CA 3.32Å; K138-F141 PolarHBondContact O-N 3.3Å; F141-H144 CarbonylContact O-C 3.59Å; F141-H144 PolarHBondContact O-N 3.21Å; F141-H144 VanDerWaalsContact O-N 3.15Å; F141-A145 WeakPolarHBondContact O-CB 3.24Å; F141-A145 PolarHBondContact O-N 3.45Å; F141-H201 AromaticContact CD1-CE1 3.61Å; F141-H201 AromaticContact CE1-CE1 3.2Å; F141-H201 WeakPolarHBondContact CE1-CE1 3.49Å; F141-H201 AromaticContact CE1-NE2 3.3Å; F141-H201 VanDerWaalsContact CE1-NE2 3.3Å; F141-H201 WeakPolarHBondContact CE1-NE2 3.42Å; F141-H201 AromaticContact CZ-NE2 3.64Å |
| 142 | E | 66.6 | Low | 72.7 | Confident | 119 Ų | 119 | 91.6 Ų | 91.6 | 56% | 0.556 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -66.1 | -40.7 | 179 | -170.8 | 165.3 | -179.8 | 0 | 0 | 110.8 | K138 Y140 H144 A145 L146 | K138-E142 WeakPolarHBondContact O-CB 3.22Å; K138-E142 PolarHBondContact O-N 2.99Å; Y140-E142 VanDerWaalsContact C-N 3.34Å; E142-H144 VanDerWaalsContact C-N 3.29Å; E142-H144 PolarHBondContact O-N 3.35Å; E142-A145 PolarHBondContact O-N 2.68Å; E142-L146 HydrophobicContact CG-CD1 4.07Å; E142-L146 HydrophobicContact CG-CG 4.47Å; E142-L146 VanDerWaalsContact O-CB 3.25Å; E142-L146 WeakPolarHBondContact O-CB 3.27Å; E142-L146 WeakPolarHBondContact O-CD1 3.32Å; E142-L146 WeakPolarHBondContact O-CG 3.12Å; E142-L146 PolarHBondContact O-N 2.97Å |
| 143 | A | 72.4 | Confident | 72.7 | Confident | 63 Ų | 63 | 91.7 Ų | 91.7 | 52% | 0.521 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -60.5 | -36.8 | 170.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | A147 | A143-A147 VanDerWaalsContact O-CB 3.22Å; A143-A147 WeakPolarHBondContact O-CB 3.37Å; A143-A147 PolarHBondContact O-N 3.35Å |
| 144 | H | 71.4 | Confident | 72.7 | Confident | 126 Ų | 126 | 85.8 Ų | 85.8 | 58% | 0.583 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -75.4 | -38.4 | 177 | -176.2 | -90.8 | 0 | 0 | 0 | 112.7 | F141 E142 A147 K148 | F141-H144 CarbonylContact O-C 3.59Å; F141-H144 PolarHBondContact O-N 3.21Å; F141-H144 VanDerWaalsContact O-N 3.15Å; E142-H144 VanDerWaalsContact C-N 3.29Å; E142-H144 PolarHBondContact O-N 3.35Å; H144-A147 PolarHBondContact O-N 3.14Å; H144-K148 PolarHBondContact O-N 3.27Å |
| 145 | A | 77.5 | Confident | 72.9 | Confident | 45 Ų | 45 | 83.6 Ų | 83.6 | 37% | 0.372 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -62.9 | -52.4 | 173.7 | 0 | 0 | 0 | 0 | 0 | 110.5 | F141 E142 A147 K148 D149 | F141-A145 WeakPolarHBondContact O-CB 3.24Å; F141-A145 PolarHBondContact O-N 3.45Å; E142-A145 PolarHBondContact O-N 2.68Å; A145-A147 VanDerWaalsContact C-N 3.28Å; A145-A147 PolarHBondContact O-N 3.06Å; A145-K148 WeakPolarHBondContact O-CA 3.39Å; A145-K148 WeakPolarHBondContact O-CB 3.4Å; A145-K148 PolarHBondContact O-N 2.86Å; A145-D149 VanDerWaalsContact O-CG 3.3Å; A145-D149 PolarHBondContact O-N 3.31Å |
| 146 | L | 78.9 | Confident | 73.7 | Confident | 81 Ų | 81 | 88.6 Ų | 88.6 | 42% | 0.424 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -55.1 | -42 | 173.1 | -70.7 | 168.2 | 0 | 0 | 0 | 111.6 | E142 K148 D149 Y150 | E142-L146 HydrophobicContact CG-CD1 4.07Å; E142-L146 HydrophobicContact CG-CG 4.47Å; E142-L146 VanDerWaalsContact O-CB 3.25Å; E142-L146 WeakPolarHBondContact O-CB 3.27Å; E142-L146 WeakPolarHBondContact O-CD1 3.32Å; E142-L146 WeakPolarHBondContact O-CG 3.12Å; E142-L146 PolarHBondContact O-N 2.97Å; L146-K148 VanDerWaalsContact C-N 3.34Å; L146-K148 PolarHBondContact O-N 2.96Å; L146-D149 PolarHBondContact O-N 2.78Å; L146-Y150 HydrophobicContact CB-CD2 4.41Å; L146-Y150 HydrophobicContact CB-CE2 4.41Å; L146-Y150 WeakPolarHBondContact O-CB 3.22Å; L146-Y150 WeakPolarHBondContact O-CD2 3.49Å; L146-Y150 PolarHBondContact O-N 3Å |
| 147 | A | 77.9 | Confident | 74.6 | Confident | 54 Ų | 54 | 92 Ų | 92 | 45% | 0.446 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -65.6 | -32.6 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.5 | A143 H144 A145 R151 | A143-A147 VanDerWaalsContact O-CB 3.22Å; A143-A147 WeakPolarHBondContact O-CB 3.37Å; A143-A147 PolarHBondContact O-N 3.35Å; H144-A147 PolarHBondContact O-N 3.14Å; A145-A147 VanDerWaalsContact C-N 3.28Å; A145-A147 PolarHBondContact O-N 3.06Å; A147-R151 WeakPolarHBondContact O-CB 3.46Å; A147-R151 PolarHBondContact O-N 3.34Å |
| 148 | K | 80.8 | Confident | 75.8 | Confident | 72 Ų | 72 | 91.8 Ų | 91.8 | 31% | 0.313 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -67.1 | -43.6 | 170.5 | 176.6 | 176.7 | 166.9 | 170.1 | 0 | 110.6 | H144 A145 L146 R151 S152 E194 T197 | H144-K148 PolarHBondContact O-N 3.27Å; A145-K148 WeakPolarHBondContact O-CA 3.39Å; A145-K148 WeakPolarHBondContact O-CB 3.4Å; A145-K148 PolarHBondContact O-N 2.86Å; L146-K148 VanDerWaalsContact C-N 3.34Å; L146-K148 PolarHBondContact O-N 2.96Å; K148-R151 WeakPolarHBondContact O-CB 3.42Å; K148-R151 PolarHBondContact O-N 3.49Å; K148-S152 PolarHBondContact O-N 3.11Å; K148-E194 PolarHBondContact NZ-O 3.32Å; K148-T197 VanDerWaalsContact CE-OG1 3.25Å; K148-T197 WeakPolarHBondContact CE-OG1 3.45Å; K148-T197 PolarHBondContact NZ-OG1 3.28Å |
| 149 | D | 81.3 | Confident | 77.3 | Confident | 88 Ų | 88 | 88 Ų | 88 | 47% | 0.471 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -69.4 | -45.1 | -178.1 | -61.7 | -22.5 | 0 | 0 | 0 | 112.2 | A145 L146 R151 S152 L153 | A145-D149 VanDerWaalsContact O-CG 3.3Å; A145-D149 PolarHBondContact O-N 3.31Å; L146-D149 PolarHBondContact O-N 2.78Å; D149-R151 PolarHBondContact O-N 3.12Å; D149-S152 PolarHBondContact O-N 3.08Å; D149-S152 PolarHBondContact O-OG 2.93Å; D149-L153 VanDerWaalsContact O-CB 3.3Å; D149-L153 WeakPolarHBondContact O-CB 3.43Å; D149-L153 PolarHBondContact O-N 3.37Å |
| 150 | Y | 81.8 | Confident | 78.8 | Confident | 131 Ų | 131 | 88.2 Ų | 88.2 | 51% | 0.514 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -60 | -34.8 | 172.3 | -80.7 | -63.8 | 0 | 0 | 0 | 112.3 | L146 G154 | L146-Y150 HydrophobicContact CB-CD2 4.41Å; L146-Y150 HydrophobicContact CB-CE2 4.41Å; L146-Y150 WeakPolarHBondContact O-CB 3.22Å; L146-Y150 WeakPolarHBondContact O-CD2 3.49Å; L146-Y150 PolarHBondContact O-N 3Å; Y150-G154 PolarHBondContact O-N 2.65Å |
| 151 | R | 81.9 | Confident | 80.6 | Confident | 168 Ų | 168 | 82.3 Ų | 82.3 | 63% | 0.634 | 42% | 0.424 | S | S | * | . | H | α-helix | trans | -72.2 | -34.9 | 176.3 | 172.9 | 179.3 | -87.3 | 165.8 | -3.4 | 112.8 | A147 K148 D149 F155 | A147-R151 WeakPolarHBondContact O-CB 3.46Å; A147-R151 PolarHBondContact O-N 3.34Å; K148-R151 WeakPolarHBondContact O-CB 3.42Å; K148-R151 PolarHBondContact O-N 3.49Å; D149-R151 PolarHBondContact O-N 3.12Å; R151-F155 PolarHBondContact O-N 3.27Å |
| 152 | S | 84.3 | Confident | 82 | Confident | 37 Ų | 37 | 79.1 Ų | 79.1 | 26% | 0.259 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -73.2 | -41.1 | 173.9 | 66.2 | 0 | 0 | 0 | 0 | 111 | K148 D149 F155 R156 | K148-S152 PolarHBondContact O-N 3.11Å; D149-S152 PolarHBondContact O-N 3.08Å; D149-S152 PolarHBondContact O-OG 2.93Å; S152-F155 PolarHBondContact O-N 3.35Å; S152-R156 PolarHBondContact O-N 3.4Å |
| 153 | L | 84.6 | Confident | 83 | Confident | 59 Ų | 59 | 74.2 Ų | 74.2 | 31% | 0.309 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -57.9 | -54.3 | 175.6 | -179.2 | 62 | 0 | 0 | 0 | 111.9 | D149 F155 R156 E157 | D149-L153 VanDerWaalsContact O-CB 3.3Å; D149-L153 WeakPolarHBondContact O-CB 3.43Å; D149-L153 PolarHBondContact O-N 3.37Å; L153-F155 VanDerWaalsContact C-N 3.26Å; L153-F155 PolarHBondContact O-N 2.96Å; L153-R156 VanDerWaalsContact CD1-NH2 3.27Å; L153-R156 WeakPolarHBondContact O-CB 3.38Å; L153-R156 PolarHBondContact O-N 3.06Å; L153-E157 WeakPolarHBondContact O-CG 3.48Å; L153-E157 PolarHBondContact O-N 3.37Å |
| 154 | G | 83.7 | Confident | 83.7 | Confident | 31 Ų | 31 | 76.1 Ų | 76.1 | 32% | 0.32 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -63.7 | -29.1 | 179.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | Y150 C158 | Y150-G154 PolarHBondContact O-N 2.65Å; G154-C158 VanDerWaalsContact O-CB 3.31Å; G154-C158 WeakPolarHBondContact O-CB 3.27Å; G154-C158 PolarHBondContact O-N 3.08Å |
| 155 | F | 85.9 | Confident | 84.4 | Confident | 46 Ų | 46 | 75.3 Ų | 75.3 | 20% | 0.202 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -68.9 | -42.3 | 171.6 | -172.4 | -83 | 0 | 0 | 0 | 111.7 | R151 S152 L153 C158 L159 L186 Y189 A190 | R151-F155 PolarHBondContact O-N 3.27Å; S152-F155 PolarHBondContact O-N 3.35Å; L153-F155 VanDerWaalsContact C-N 3.26Å; L153-F155 PolarHBondContact O-N 2.96Å; F155-C158 PolarHBondContact O-N 3.49Å; F155-L159 HydrophobicContact CE1-CD1 4.32Å; F155-L159 WeakPolarHBondContact O-CB 3.33Å; F155-L159 PolarHBondContact O-N 3.41Å; F155-L186 HydrophobicContact CE1-CB 4.49Å; F155-L186 WeakPolarHBondContact CE1-O 3.3Å; F155-L186 HydrophobicContact CZ-CB 4.34Å; F155-L186 HydrophobicContact CZ-CD2 4.05Å; F155-Y189 HydrophobicContact CE2-CD1 4Å; F155-Y189 HydrophobicContact CE2-CE1 4.29Å; F155-Y189 AromaticContact CZ-CD1 3.84Å; F155-Y189 HydrophobicContact CZ-CD1 3.84Å; F155-A190 HydrophobicContact CD1-CB 3.76Å; F155-A190 HydrophobicContact CE1-CB 3.68Å |
| 156 | R | 86.9 | Confident | 84.7 | Confident | 166 Ų | 166 | 73.8 Ų | 73.8 | 63% | 0.626 | 37% | 0.365 | S | S | * | . | H | α-helix | trans | -64.1 | -40.4 | 176.7 | -177.2 | 171.9 | 64.3 | -157.3 | 1.5 | 111.9 | S152 L153 L159 A160 | S152-R156 PolarHBondContact O-N 3.4Å; L153-R156 VanDerWaalsContact CD1-NH2 3.27Å; L153-R156 WeakPolarHBondContact O-CB 3.38Å; L153-R156 PolarHBondContact O-N 3.06Å; R156-L159 PolarHBondContact O-N 3.3Å; R156-A160 WeakPolarHBondContact O-CB 3.24Å; R156-A160 PolarHBondContact O-N 3.35Å |
| 157 | E | 86.9 | Confident | 85.1 | Confident | 118 Ų | 118 | 72.2 Ų | 72.2 | 55% | 0.551 | 36% | 0.36 | S | S | * | . | H | α-helix | trans | -61.9 | -47.4 | 172.7 | -70.1 | 172.5 | 164.6 | 0 | 0 | 111.3 | L153 L159 A160 E161 | L153-E157 WeakPolarHBondContact O-CG 3.48Å; L153-E157 PolarHBondContact O-N 3.37Å; E157-L159 VanDerWaalsContact C-N 3.33Å; E157-L159 PolarHBondContact O-N 3.24Å; E157-A160 PolarHBondContact O-N 3.1Å; E157-E161 WeakPolarHBondContact O-CB 3.46Å; E157-E161 PolarHBondContact O-N 2.87Å |
| 158 | C | 87.1 | Confident | 85.3 | Confident | 44 Ų | 44 | 75.1 Ų | 75.1 | 30% | 0.297 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -60.7 | -38.7 | 176.1 | -177 | 0 | 0 | 0 | 0 | 112.9 | G154 F155 T162 | G154-C158 VanDerWaalsContact O-CB 3.31Å; G154-C158 WeakPolarHBondContact O-CB 3.27Å; G154-C158 PolarHBondContact O-N 3.08Å; F155-C158 PolarHBondContact O-N 3.49Å; C158-T162 WeakPolarHBondContact O-CB 3.1Å; C158-T162 PolarHBondContact O-N 3.35Å; C158-T162 PolarHBondContact O-OG1 3.1Å |
| 159 | L | 88.7 | Confident | 85.1 | Confident | 33 Ų | 33 | 76.4 Ų | 76.4 | 17% | 0.173 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -64.8 | -48 | 174.5 | -176.8 | 164 | 0 | 0 | 0 | 111.3 | F155 R156 E157 E161 T162 A163 V183 L186 | F155-L159 HydrophobicContact CE1-CD1 4.32Å; F155-L159 WeakPolarHBondContact O-CB 3.33Å; F155-L159 PolarHBondContact O-N 3.41Å; R156-L159 PolarHBondContact O-N 3.3Å; E157-L159 VanDerWaalsContact C-N 3.33Å; E157-L159 PolarHBondContact O-N 3.24Å; L159-E161 VanDerWaalsContact C-N 3.33Å; L159-E161 PolarHBondContact O-N 2.94Å; L159-T162 WeakPolarHBondContact O-CB 3.29Å; L159-T162 PolarHBondContact O-N 3.17Å; L159-A163 PolarHBondContact O-N 2.94Å; L159-V183 HydrophobicContact CD2-CG1 4.12Å; L159-L186 HydrophobicContact CD1-CB 3.77Å; L159-L186 HydrophobicContact CG-CB 4.06Å |
| 160 | A | 86.9 | Confident | 85 | Confident | 57 Ų | 57 | 76.8 Ų | 76.8 | 47% | 0.471 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -60.5 | -43 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | R156 E157 A163 R164 | R156-A160 WeakPolarHBondContact O-CB 3.24Å; R156-A160 PolarHBondContact O-N 3.35Å; E157-A160 PolarHBondContact O-N 3.1Å; A160-A163 PolarHBondContact O-N 3.31Å; A160-R164 WeakPolarHBondContact O-CB 3.19Å; A160-R164 PolarHBondContact O-N 3.48Å |
| 161 | E | 90 | Very high | 85.1 | Confident | 86 Ų | 86 | 73.1 Ų | 73.1 | 40% | 0.402 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -67.8 | -36.5 | 176.8 | -176.5 | 55.3 | -158.8 | 0 | 0 | 112.2 | E157 L159 A163 R164 Y165 | E157-E161 WeakPolarHBondContact O-CB 3.46Å; E157-E161 PolarHBondContact O-N 2.87Å; L159-E161 VanDerWaalsContact C-N 3.33Å; L159-E161 PolarHBondContact O-N 2.94Å; E161-A163 VanDerWaalsContact C-N 3.34Å; E161-A163 PolarHBondContact O-N 3.47Å; E161-R164 VanDerWaalsContact CD-NE 3.35Å; E161-R164 PolarHBondContact O-N 2.94Å; E161-R164 IonicContact OE1-CZ 2.82Å; E161-R164 IonicContact OE1-NE 3.86Å; E161-R164 PolarHBondContact OE1-NE 3.48Å; E161-R164 IonicContact OE1-NH2 3.5Å; E161-R164 PolarHBondContact OE1-NH2 3.26Å; E161-R164 WeakPolarHBondContact OE2-CD 3.37Å; E161-R164 IonicContact OE2-CZ 3.4Å; E161-R164 IonicContact OE2-NE 3.33Å; E161-R164 PolarHBondContact OE2-NE 3.46Å; E161-R164 IonicContact OE2-NH2 3.46Å; E161-Y165 VanDerWaalsContact O-CB 3.32Å; E161-Y165 WeakPolarHBondContact O-CB 3.36Å; E161-Y165 PolarHBondContact O-N 3.23Å |
| 162 | T | 85.9 | Confident | 85.1 | Confident | 38 Ų | 38 | 68.8 Ų | 68.8 | 23% | 0.233 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -60.8 | -44.1 | 171.5 | -60.2 | 0 | 0 | 0 | 0 | 111 | C158 L159 L166 L182 L186 | C158-T162 WeakPolarHBondContact O-CB 3.1Å; C158-T162 PolarHBondContact O-N 3.35Å; C158-T162 PolarHBondContact O-OG1 3.1Å; L159-T162 WeakPolarHBondContact O-CB 3.29Å; L159-T162 PolarHBondContact O-N 3.17Å; T162-L166 HydrophobicContact CG2-CD1 4.25Å; T162-L166 WeakPolarHBondContact O-CG 3.39Å; T162-L166 PolarHBondContact O-N 3Å; T162-L166 VanDerWaalsContact O-N 3.12Å; T162-L182 HydrophobicContact CG2-CD2 3.93Å; T162-L186 HydrophobicContact CG2-CD1 4.22Å |
| 163 | A | 88.3 | Confident | 85.1 | Confident | 16 Ų | 16 | 72.6 Ų | 72.6 | 13% | 0.132 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -65.9 | -36.9 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112 | L159 A160 E161 S167 R179 V183 | L159-A163 PolarHBondContact O-N 2.94Å; A160-A163 PolarHBondContact O-N 3.31Å; E161-A163 VanDerWaalsContact C-N 3.34Å; E161-A163 PolarHBondContact O-N 3.47Å; A163-S167 PolarHBondContact O-N 2.97Å; A163-R179 VanDerWaalsContact O-CZ 3.23Å; A163-R179 PolarHBondContact O-NH1 3.33Å; A163-R179 PolarHBondContact O-NH2 3.12Å; A163-V183 HydrophobicContact CB-CG2 3.9Å |
| 164 | R | 87.8 | Confident | 85.1 | Confident | 103 Ų | 103 | 74.2 Ų | 74.2 | 39% | 0.389 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -66.4 | -49.7 | 175.9 | -165.8 | -163.5 | 69.8 | 76.5 | 3.6 | 111.5 | A160 E161 L166 S167 I168 | A160-R164 WeakPolarHBondContact O-CB 3.19Å; A160-R164 PolarHBondContact O-N 3.48Å; E161-R164 VanDerWaalsContact CD-NE 3.35Å; E161-R164 PolarHBondContact O-N 2.94Å; E161-R164 IonicContact OE1-CZ 2.82Å; E161-R164 IonicContact OE1-NE 3.86Å; E161-R164 PolarHBondContact OE1-NE 3.48Å; E161-R164 IonicContact OE1-NH2 3.5Å; E161-R164 PolarHBondContact OE1-NH2 3.26Å; E161-R164 WeakPolarHBondContact OE2-CD 3.37Å; E161-R164 IonicContact OE2-CZ 3.4Å; E161-R164 IonicContact OE2-NE 3.33Å; E161-R164 PolarHBondContact OE2-NE 3.46Å; E161-R164 IonicContact OE2-NH2 3.46Å; R164-L166 PolarHBondContact O-N 3.38Å; R164-S167 PolarHBondContact O-N 2.98Å; R164-S167 VanDerWaalsContact O-N 3.1Å; R164-I168 HydrophobicContact CG-CD1 3.72Å; R164-I168 HydrophobicContact CG-CG1 4.33Å; R164-I168 PolarHBondContact O-N 2.9Å |
| 165 | Y | 84.8 | Confident | 85.4 | Confident | 108 Ų | 108 | 78.1 Ų | 78.1 | 42% | 0.424 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -55.8 | -49.1 | 179.2 | -179.4 | -91.8 | 0 | 0 | 0 | 111.8 | E161 S167 I168 I169 E170 | E161-Y165 VanDerWaalsContact O-CB 3.32Å; E161-Y165 WeakPolarHBondContact O-CB 3.36Å; E161-Y165 PolarHBondContact O-N 3.23Å; Y165-S167 PolarHBondContact O-N 3.11Å; Y165-I168 PolarHBondContact O-N 3.28Å; Y165-I169 HydrophobicContact CD2-CB 3.88Å; Y165-I169 HydrophobicContact CD2-CG1 3.64Å; Y165-I169 HydrophobicContact CD2-CG2 4.28Å; Y165-I169 HydrophobicContact CE2-CB 3.81Å; Y165-I169 HydrophobicContact CE2-CG1 3.9Å; Y165-I169 HydrophobicContact CE2-CG2 3.68Å; Y165-I169 HydrophobicContact CG-CB 4.33Å; Y165-I169 HydrophobicContact CG-CG1 4.32Å; Y165-I169 WeakPolarHBondContact O-CB 3.44Å; Y165-I169 PolarHBondContact O-N 2.81Å; Y165-E170 HydrophobicContact CD1-CG 4.11Å; Y165-E170 HydrophobicContact CE1-CG 3.66Å; Y165-E170 PolarHBondContact O-N 3.46Å |
| 166 | L | 84.5 | Confident | 85.7 | Confident | 14 Ų | 14 | 77.8 Ų | 77.8 | 7% | 0.073 | 41% | 0.413 | C | S | . | . | H | α-helix | trans | -61.4 | -30.8 | 178.6 | -71.6 | 171.4 | 0 | 0 | 0 | 112.9 | T162 R164 E170 R172 L178 R179 L182 | T162-L166 HydrophobicContact CG2-CD1 4.25Å; T162-L166 WeakPolarHBondContact O-CG 3.39Å; T162-L166 PolarHBondContact O-N 3Å; T162-L166 VanDerWaalsContact O-N 3.12Å; R164-L166 PolarHBondContact O-N 3.38Å; L166-E170 HydrophobicContact CD2-CG 4.35Å; L166-R172 WeakPolarHBondContact O-CA 3.45Å; L166-R172 VanDerWaalsContact O-CB 3.24Å; L166-R172 WeakPolarHBondContact O-CB 3.47Å; L166-R172 PolarHBondContact O-N 2.8Å; L166-L178 HydrophobicContact CD2-CD2 4.4Å; L166-R179 HydrophobicContact CB-CG 4.44Å; L166-R179 VanDerWaalsContact CB-NH1 3.35Å; L166-R179 HydrophobicContact CD1-CB 4.39Å; L166-R179 HydrophobicContact CD1-CG 4.26Å; L166-L182 HydrophobicContact CD1-CD2 4.18Å |
| 167 | S | 86.8 | Confident | 85.8 | Confident | 47 Ų | 47 | 73.5 Ų | 73.5 | 33% | 0.329 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -82.2 | -46.7 | 177.1 | -84.5 | 0 | 0 | 0 | 0 | 112.9 | A163 R164 Y165 G171 R179 | A163-S167 PolarHBondContact O-N 2.97Å; R164-S167 PolarHBondContact O-N 2.98Å; R164-S167 VanDerWaalsContact O-N 3.1Å; Y165-S167 PolarHBondContact O-N 3.11Å; S167-G171 WeakPolarHBondContact O-CA 3.45Å; S167-R179 VanDerWaalsContact N-NH1 3.12Å; S167-R179 PolarHBondContact OG-NH1 2.97Å; S167-R179 PolarHBondContact OG-NH2 3.39Å; S167-R179 VanDerWaalsContact OG-NH2 3.1Å |
| 168 | I | 83 | Confident | 85.6 | Confident | 115 Ų | 115 | 70.5 Ų | 70.5 | 59% | 0.59 | 40% | 0.396 | S | S | * | . | H | α-helix | trans | -91.7 | -35.6 | -166.1 | -58.8 | -174.3 | 0 | 0 | 0 | 112.1 | R164 Y165 | R164-I168 HydrophobicContact CG-CD1 3.72Å; R164-I168 HydrophobicContact CG-CG1 4.33Å; R164-I168 PolarHBondContact O-N 2.9Å; Y165-I168 PolarHBondContact O-N 3.28Å |
| 169 | I | 76.5 | Confident | 85.6 | Confident | 99 Ų | 99 | 70.1 Ų | 70.1 | 51% | 0.508 | 39% | 0.388 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -95.7 | -47.5 | -175.7 | -52 | -57.3 | 0 | 0 | 0 | 110.9 | Y165 G171 | Y165-I169 HydrophobicContact CD2-CB 3.88Å; Y165-I169 HydrophobicContact CD2-CG1 3.64Å; Y165-I169 HydrophobicContact CD2-CG2 4.28Å; Y165-I169 HydrophobicContact CE2-CB 3.81Å; Y165-I169 HydrophobicContact CE2-CG1 3.9Å; Y165-I169 HydrophobicContact CE2-CG2 3.68Å; Y165-I169 HydrophobicContact CG-CB 4.33Å; Y165-I169 HydrophobicContact CG-CG1 4.32Å; Y165-I169 WeakPolarHBondContact O-CB 3.44Å; Y165-I169 PolarHBondContact O-N 2.81Å; I169-G171 VanDerWaalsContact C-N 3.32Å |
| 170 | E | 78 | Confident | 85.7 | Confident | 97 Ų | 97 | 72.3 Ų | 72.3 | 45% | 0.453 | 40% | 0.403 | S | S | . | . | S | Bend | trans | -84.2 | -6.7 | 179.2 | -67.3 | -77.4 | 128.5 | 0 | 0 | 113.2 | Y165 L166 R172 | Y165-E170 HydrophobicContact CD1-CG 4.11Å; Y165-E170 HydrophobicContact CE1-CG 3.66Å; Y165-E170 PolarHBondContact O-N 3.46Å; L166-E170 HydrophobicContact CD2-CG 4.35Å; E170-R172 HydrophobicContact CB-CG 4.04Å; E170-R172 PolarHBondContact O-N 3.22Å; E170-R172 IonicContact OE2-NE 3.81Å |
| 171 | G | 84.8 | Confident | 86 | Confident | 54 Ų | 54 | 77.4 Ų | 77.4 | 56% | 0.557 | 41% | 0.41 | S | S | * | . | trans | 61.6 | 21.2 | -179.4 | 0 | 0 | 0 | 0 | 0 | 114.7 | S167 I169 D173 | S167-G171 WeakPolarHBondContact O-CA 3.45Å; I169-G171 VanDerWaalsContact C-N 3.32Å; G171-D173 PolarHBondContact O-N 2.9Å | ||
| 172 | R | 82.6 | Confident | 85.9 | Confident | 77 Ų | 77 | 76.3 Ų | 76.3 | 29% | 0.291 | 41% | 0.406 | S | S | . | . | trans | -82.8 | 119.5 | -177.1 | -63.1 | 166.2 | 171.7 | -82.5 | -11.6 | 110.7 | L166 E170 D176 | L166-R172 WeakPolarHBondContact O-CA 3.45Å; L166-R172 VanDerWaalsContact O-CB 3.24Å; L166-R172 WeakPolarHBondContact O-CB 3.47Å; L166-R172 PolarHBondContact O-N 2.8Å; E170-R172 HydrophobicContact CB-CG 4.04Å; E170-R172 PolarHBondContact O-N 3.22Å; E170-R172 IonicContact OE2-NE 3.81Å; R172-D176 HydrophobicContact CB-CB 4.06Å; R172-D176 WeakPolarHBondContact CD-OD2 3.13Å; R172-D176 IonicContact CZ-OD2 3.83Å; R172-D176 IonicContact NH1-OD1 2.65Å; R172-D176 IonicContact NH1-OD2 2.69Å; R172-D176 PolarHBondContact NH1-OD2 3.02Å | ||
| 173 | D | 84.3 | Confident | 86.1 | Confident | 116 Ų | 116 | 76.2 Ų | 76.2 | 62% | 0.62 | 41% | 0.406 | S | S | * | . | trans | -54.8 | 157.4 | 174.7 | -66.4 | -47.2 | 0 | 0 | 0 | 112.8 | G171 T175 D176 R179 | G171-D173 PolarHBondContact O-N 2.9Å; D173-T175 PolarHBondContact O-N 2.72Å; D173-T175 VanDerWaalsContact O-N 3.08Å; D173-D176 WeakPolarHBondContact O-CB 3.38Å; D173-D176 PolarHBondContact O-N 3.3Å; D173-R179 WeakPolarHBondContact O-CD 3.42Å | ||
| 174 | S | 83.4 | Confident | 86.3 | Confident | 93 Ų | 93 | 78.4 Ų | 78.4 | 65% | 0.65 | 42% | 0.42 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.7 | -20.7 | 176 | 54.6 | 0 | 0 | 0 | 0 | 113.7 | V180 | S174-V180 VanDerWaalsContact O-CG2 3.25Å; S174-V180 WeakPolarHBondContact O-CG2 3.37Å |
| 175 | T | 89.5 | Confident | 86.5 | Confident | 114 Ų | 114 | 79.4 Ų | 79.4 | 70% | 0.699 | 43% | 0.429 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -88.7 | -8 | 178.2 | 53.6 | 0 | 0 | 0 | 0 | 114.2 | D173 S177 | D173-T175 PolarHBondContact O-N 2.72Å; D173-T175 VanDerWaalsContact O-N 3.08Å; T175-S177 PolarHBondContact O-N 3.44Å |
| 176 | D | 92.1 | Very high | 86.8 | Confident | 38 Ų | 38 | 76 Ų | 76 | 20% | 0.203 | 42% | 0.418 | C | S | . | . | trans | -59.7 | 123.3 | -179 | 170.6 | 44.1 | 0 | 0 | 0 | 111.5 | R172 D173 L178 R179 V180 | R172-D176 HydrophobicContact CB-CB 4.06Å; R172-D176 WeakPolarHBondContact CD-OD2 3.13Å; R172-D176 IonicContact CZ-OD2 3.83Å; R172-D176 IonicContact NH1-OD1 2.65Å; R172-D176 IonicContact NH1-OD2 2.69Å; R172-D176 PolarHBondContact NH1-OD2 3.02Å; D173-D176 WeakPolarHBondContact O-CB 3.38Å; D173-D176 PolarHBondContact O-N 3.3Å; D176-L178 PolarHBondContact O-N 3.36Å; D176-L178 VanDerWaalsContact O-N 3.15Å; D176-L178 PolarHBondContact OD1-N 3.26Å; D176-R179 HydrophobicContact CB-CB 3.93Å; D176-R179 WeakPolarHBondContact O-CB 3.49Å; D176-R179 PolarHBondContact O-N 3.33Å; D176-R179 VanDerWaalsContact O-N 3.13Å; D176-R179 PolarHBondContact OD2-N 2.73Å; D176-V180 WeakPolarHBondContact O-CG2 3.44Å; D176-V180 PolarHBondContact O-N 3.19Å | ||
| 177 | S | 89.1 | Confident | 87.2 | Confident | 76 Ų | 76 | 78.1 Ų | 78.1 | 53% | 0.531 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -60.3 | -29.3 | -175.2 | 70.1 | 0 | 0 | 0 | 0 | 113.5 | T175 R181 | T175-S177 PolarHBondContact O-N 3.44Å; S177-R181 WeakPolarHBondContact O-CB 3.36Å; S177-R181 PolarHBondContact O-N 3.15Å |
| 178 | L | 84.6 | Confident | 87.5 | Confident | 56 Ų | 56 | 80.1 Ų | 80.1 | 29% | 0.293 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -75.2 | -47.1 | 176.1 | 177.4 | 142.7 | 0 | 0 | 0 | 110.9 | L166 D176 R181 L182 | L166-L178 HydrophobicContact CD2-CD2 4.4Å; D176-L178 PolarHBondContact O-N 3.36Å; D176-L178 VanDerWaalsContact O-N 3.15Å; D176-L178 PolarHBondContact OD1-N 3.26Å; L178-R181 PolarHBondContact O-N 3.11Å; L178-L182 WeakPolarHBondContact O-CB 3.39Å; L178-L182 PolarHBondContact O-N 3.47Å |
| 179 | R | 85.7 | Confident | 87.6 | Confident | 36 Ų | 36 | 80.1 Ų | 80.1 | 14% | 0.136 | 43% | 0.434 | C | S | . | . | H | α-helix | trans | -53.5 | -55.8 | 173 | 180 | -164.9 | 179.1 | 71.2 | 8.6 | 111.9 | A163 L166 S167 D173 D176 R181 L182 V183 | A163-R179 VanDerWaalsContact O-CZ 3.23Å; A163-R179 PolarHBondContact O-NH1 3.33Å; A163-R179 PolarHBondContact O-NH2 3.12Å; L166-R179 HydrophobicContact CB-CG 4.44Å; L166-R179 VanDerWaalsContact CB-NH1 3.35Å; L166-R179 HydrophobicContact CD1-CB 4.39Å; L166-R179 HydrophobicContact CD1-CG 4.26Å; S167-R179 VanDerWaalsContact N-NH1 3.12Å; S167-R179 PolarHBondContact OG-NH1 2.97Å; S167-R179 PolarHBondContact OG-NH2 3.39Å; S167-R179 VanDerWaalsContact OG-NH2 3.1Å; D173-R179 WeakPolarHBondContact O-CD 3.42Å; D176-R179 HydrophobicContact CB-CB 3.93Å; D176-R179 WeakPolarHBondContact O-CB 3.49Å; D176-R179 PolarHBondContact O-N 3.33Å; D176-R179 VanDerWaalsContact O-N 3.13Å; D176-R179 PolarHBondContact OD2-N 2.73Å; R179-R181 VanDerWaalsContact C-N 3.33Å; R179-R181 PolarHBondContact O-N 3.46Å; R179-L182 PolarHBondContact O-N 2.73Å; R179-V183 WeakPolarHBondContact O-CG2 3.34Å; R179-V183 PolarHBondContact O-N 3.1Å |
| 180 | V | 92.1 | Very high | 88.1 | Confident | 78 Ų | 78 | 76.5 Ų | 76.5 | 47% | 0.473 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -59.1 | -45.6 | -177.5 | 174.4 | 0 | 0 | 0 | 0 | 110.7 | S174 D176 S184 | S174-V180 VanDerWaalsContact O-CG2 3.25Å; S174-V180 WeakPolarHBondContact O-CG2 3.37Å; D176-V180 WeakPolarHBondContact O-CG2 3.44Å; D176-V180 PolarHBondContact O-N 3.19Å; V180-S184 WeakPolarHBondContact O-CB 3.48Å; V180-S184 PolarHBondContact O-N 2.89Å |
| 181 | R | 92.6 | Very high | 88.5 | Confident | 164 Ų | 164 | 75 Ų | 75 | 62% | 0.619 | 42% | 0.419 | S | S | * | . | H | α-helix | trans | -64.6 | -43.2 | 179.5 | -172.1 | 179.9 | -62.7 | 140.9 | 4.4 | 112.4 | S177 L178 R179 H185 | S177-R181 WeakPolarHBondContact O-CB 3.36Å; S177-R181 PolarHBondContact O-N 3.15Å; L178-R181 PolarHBondContact O-N 3.11Å; R179-R181 VanDerWaalsContact C-N 3.33Å; R179-R181 PolarHBondContact O-N 3.46Å; R181-H185 WeakPolarHBondContact O-CB 3.39Å; R181-H185 PolarHBondContact O-N 2.95Å |
| 182 | L | 87.4 | Confident | 88.4 | Confident | 63 Ų | 63 | 78 Ų | 78 | 33% | 0.33 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -68.8 | -49.1 | -178.9 | -177.4 | 61.7 | 0 | 0 | 0 | 111.8 | T162 L166 L178 R179 S184 H185 L186 | T162-L182 HydrophobicContact CG2-CD2 3.93Å; L166-L182 HydrophobicContact CD1-CD2 4.18Å; L178-L182 WeakPolarHBondContact O-CB 3.39Å; L178-L182 PolarHBondContact O-N 3.47Å; R179-L182 PolarHBondContact O-N 2.73Å; L182-S184 PolarHBondContact O-N 3.49Å; L182-H185 PolarHBondContact O-N 3.49Å; L182-L186 HydrophobicContact CD1-CD1 4.14Å; L182-L186 HydrophobicContact CD1-CG 4.23Å; L182-L186 HydrophobicContact CG-CD1 4.05Å; L182-L186 WeakPolarHBondContact O-CG 3.45Å; L182-L186 PolarHBondContact O-N 3.22Å |
| 183 | V | 90.3 | Very high | 88.1 | Confident | 37 Ų | 37 | 78.4 Ų | 78.4 | 22% | 0.224 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -63.7 | -42.3 | -179.6 | 175.9 | 0 | 0 | 0 | 0 | 110.8 | L159 A163 R179 L186 S187 | L159-V183 HydrophobicContact CD2-CG1 4.12Å; A163-V183 HydrophobicContact CB-CG2 3.9Å; R179-V183 WeakPolarHBondContact O-CG2 3.34Å; R179-V183 PolarHBondContact O-N 3.1Å; V183-L186 PolarHBondContact O-N 3.2Å; V183-S187 WeakPolarHBondContact O-CB 3.25Å; V183-S187 PolarHBondContact O-N 3.45Å |
| 184 | S | 93.4 | Very high | 87.4 | Confident | 61 Ų | 61 | 77.9 Ų | 77.9 | 43% | 0.427 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -62.4 | -43.9 | 174.1 | -179 | 0 | 0 | 0 | 0 | 112.2 | V180 L182 S187 N188 | V180-S184 WeakPolarHBondContact O-CB 3.48Å; V180-S184 PolarHBondContact O-N 2.89Å; L182-S184 PolarHBondContact O-N 3.49Å; S184-S187 PolarHBondContact O-N 3.03Å; S184-N188 PolarHBondContact O-N 3.39Å; S184-N188 PolarHBondContact O-ND2 3.47Å; S184-N188 PolarHBondContact OG-ND2 3.25Å |
| 185 | H | 91.9 | Very high | 86.5 | Confident | 124 Ų | 124 | 78.6 Ų | 78.6 | 57% | 0.574 | 42% | 0.415 | S | S | * | . | H | α-helix | trans | -62.1 | -46.4 | 177.6 | 179.1 | 65.6 | 0 | 0 | 0 | 112.3 | R181 L182 S187 N188 Y189 | R181-H185 WeakPolarHBondContact O-CB 3.39Å; R181-H185 PolarHBondContact O-N 2.95Å; L182-H185 PolarHBondContact O-N 3.49Å; H185-S187 VanDerWaalsContact C-N 3.34Å; H185-S187 PolarHBondContact O-N 3.35Å; H185-N188 PolarHBondContact O-N 2.86Å; H185-Y189 WeakPolarHBondContact O-CB 3.44Å; H185-Y189 PolarHBondContact O-N 2.82Å |
| 186 | L | 91 | Very high | 85 | Confident | 37 Ų | 37 | 79.4 Ų | 79.4 | 19% | 0.194 | 41% | 0.41 | C | S | . | . | H | α-helix | trans | -63.4 | -39.3 | 177.4 | -67.5 | 172.4 | 0 | 0 | 0 | 111.9 | F155 L159 T162 L182 V183 Y189 A190 | F155-L186 HydrophobicContact CE1-CB 4.49Å; F155-L186 WeakPolarHBondContact CE1-O 3.3Å; F155-L186 HydrophobicContact CZ-CB 4.34Å; F155-L186 HydrophobicContact CZ-CD2 4.05Å; L159-L186 HydrophobicContact CD1-CB 3.77Å; L159-L186 HydrophobicContact CG-CB 4.06Å; T162-L186 HydrophobicContact CG2-CD1 4.22Å; L182-L186 HydrophobicContact CD1-CD1 4.14Å; L182-L186 HydrophobicContact CD1-CG 4.23Å; L182-L186 HydrophobicContact CG-CD1 4.05Å; L182-L186 WeakPolarHBondContact O-CG 3.45Å; L182-L186 PolarHBondContact O-N 3.22Å; V183-L186 PolarHBondContact O-N 3.2Å; L186-Y189 PolarHBondContact O-N 3.18Å; L186-A190 PolarHBondContact O-N 2.87Å |
| 187 | S | 91.9 | Very high | 83.3 | Confident | 59 Ų | 59 | 80.9 Ų | 80.9 | 41% | 0.413 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -63 | -49.9 | 177.2 | -173.9 | 0 | 0 | 0 | 0 | 111.7 | V183 S184 H185 Y189 A190 S191 | V183-S187 WeakPolarHBondContact O-CB 3.25Å; V183-S187 PolarHBondContact O-N 3.45Å; S184-S187 PolarHBondContact O-N 3.03Å; H185-S187 VanDerWaalsContact C-N 3.34Å; H185-S187 PolarHBondContact O-N 3.35Å; S187-Y189 VanDerWaalsContact C-N 3.29Å; S187-Y189 PolarHBondContact O-N 3.34Å; S187-A190 WeakPolarHBondContact O-CB 3.48Å; S187-A190 PolarHBondContact O-N 3.05Å; S187-S191 PolarHBondContact O-N 2.97Å; S187-S191 PolarHBondContact O-OG 3.47Å |
| 188 | N | 92.4 | Very high | 81.6 | Confident | 89 Ų | 89 | 79.1 Ų | 79.1 | 48% | 0.476 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -61.5 | -37 | 175.7 | -76.2 | -70 | 0 | 0 | 0 | 112.3 | S184 H185 S191 Q192 | S184-N188 PolarHBondContact O-N 3.39Å; S184-N188 PolarHBondContact O-ND2 3.47Å; S184-N188 PolarHBondContact OG-ND2 3.25Å; H185-N188 PolarHBondContact O-N 2.86Å; N188-S191 PolarHBondContact O-N 3.07Å; N188-Q192 WeakPolarHBondContact O-CG 3.4Å; N188-Q192 PolarHBondContact O-N 3.47Å |
| 189 | Y | 87.1 | Confident | 79.8 | Confident | 114 Ų | 114 | 82.7 Ų | 82.7 | 45% | 0.447 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -67.4 | -37.2 | 176.7 | -175.3 | -105.9 | 0 | 0 | 0 | 112.7 | F155 H185 L186 S187 R193 | F155-Y189 HydrophobicContact CE2-CD1 4Å; F155-Y189 HydrophobicContact CE2-CE1 4.29Å; F155-Y189 AromaticContact CZ-CD1 3.84Å; F155-Y189 HydrophobicContact CZ-CD1 3.84Å; H185-Y189 WeakPolarHBondContact O-CB 3.44Å; H185-Y189 PolarHBondContact O-N 2.82Å; L186-Y189 PolarHBondContact O-N 3.18Å; S187-Y189 VanDerWaalsContact C-N 3.29Å; S187-Y189 PolarHBondContact O-N 3.34Å; Y189-R193 VanDerWaalsContact CE1-CD 3.46Å; Y189-R193 HydrophobicContact CE1-CG 4.34Å; Y189-R193 WeakPolarHBondContact O-CG 3.42Å; Y189-R193 PolarHBondContact O-N 2.93Å |
| 190 | A | 85.9 | Confident | 77.7 | Confident | 24 Ų | 24 | 87.7 Ų | 87.7 | 20% | 0.198 | 46% | 0.458 | C | S | . | . | H | α-helix | trans | -58.2 | -54 | 171.4 | 0 | 0 | 0 | 0 | 0 | 110.7 | F155 L186 S187 Q192 R193 E194 | F155-A190 HydrophobicContact CD1-CB 3.76Å; F155-A190 HydrophobicContact CE1-CB 3.68Å; L186-A190 PolarHBondContact O-N 2.87Å; S187-A190 WeakPolarHBondContact O-CB 3.48Å; S187-A190 PolarHBondContact O-N 3.05Å; A190-Q192 VanDerWaalsContact C-N 3.34Å; A190-Q192 PolarHBondContact O-N 3.43Å; A190-R193 PolarHBondContact O-N 3.38Å; A190-R193 VanDerWaalsContact O-N 3.11Å; A190-E194 PolarHBondContact O-N 3.39Å |
| 191 | S | 86.6 | Confident | 75.6 | Confident | 64 Ų | 64 | 89 Ų | 89 | 45% | 0.448 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -59.2 | -40.6 | -178.1 | -52.8 | 0 | 0 | 0 | 0 | 112.8 | S187 N188 R193 E194 | S187-S191 PolarHBondContact O-N 2.97Å; S187-S191 PolarHBondContact O-OG 3.47Å; N188-S191 PolarHBondContact O-N 3.07Å; S191-R193 PolarHBondContact O-N 3.3Å; S191-E194 PolarHBondContact O-N 3.14Å |
| 192 | Q | 83.4 | Confident | 73.2 | Confident | 117 Ų | 117 | 89.4 Ų | 89.4 | 55% | 0.547 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -65.5 | -34.3 | 177.1 | -74.8 | -176.3 | 21.7 | 0 | 0 | 113.3 | N188 A190 V195 H196 | N188-Q192 WeakPolarHBondContact O-CG 3.4Å; N188-Q192 PolarHBondContact O-N 3.47Å; A190-Q192 VanDerWaalsContact C-N 3.34Å; A190-Q192 PolarHBondContact O-N 3.43Å; Q192-V195 PolarHBondContact O-N 3.2Å; Q192-H196 PolarHBondContact O-N 2.93Å; Q192-H196 PolarHBondContact O-ND1 3.5Å |
| 193 | R | 75.7 | Confident | 71.1 | Confident | 87 Ų | 87 | 89.7 Ų | 89.7 | 33% | 0.328 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -71.9 | -30.1 | -179 | -73.4 | -177 | 73.2 | -140.8 | 9.9 | 113.4 | Y189 A190 S191 V195 T197 | Y189-R193 VanDerWaalsContact CE1-CD 3.46Å; Y189-R193 HydrophobicContact CE1-CG 4.34Å; Y189-R193 WeakPolarHBondContact O-CG 3.42Å; Y189-R193 PolarHBondContact O-N 2.93Å; A190-R193 PolarHBondContact O-N 3.38Å; A190-R193 VanDerWaalsContact O-N 3.11Å; S191-R193 PolarHBondContact O-N 3.3Å; R193-V195 VanDerWaalsContact C-N 3.28Å; R193-V195 PolarHBondContact O-N 2.99Å; R193-T197 WeakPolarHBondContact O-CG2 3.32Å; R193-T197 PolarHBondContact O-N 3.25Å; R193-T197 PolarHBondContact O-OG1 2.93Å |
| 194 | E | 69.4 | Low | 68.8 | Low | 104 Ų | 104 | 98.8 Ų | 98.8 | 49% | 0.486 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -64.6 | -35.9 | 177.4 | -70.1 | 176.8 | -179.8 | 0 | 0 | 111.6 | K148 A190 S191 T197 | K148-E194 PolarHBondContact NZ-O 3.32Å; A190-E194 PolarHBondContact O-N 3.39Å; S191-E194 PolarHBondContact O-N 3.14Å; E194-T197 PolarHBondContact O-OG1 2.9Å |
| 195 | V | 64.6 | Low | 66.3 | Low | 109 Ų | 109 | 97.9 Ų | 97.9 | 66% | 0.661 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -73.9 | -52.1 | 178 | -178.1 | 0 | 0 | 0 | 0 | 112.5 | Q192 R193 T197 G198 | Q192-V195 PolarHBondContact O-N 3.2Å; R193-V195 VanDerWaalsContact C-N 3.28Å; R193-V195 PolarHBondContact O-N 2.99Å; V195-T197 PolarHBondContact O-N 3.47Å; V195-G198 PolarHBondContact O-N 3.48Å |
| 196 | H | 56.8 | Low | 63.9 | Low | 130 Ų | 130 | 96.7 Ų | 96.7 | 60% | 0.602 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -63 | -28.3 | -174 | -73.6 | 83.9 | 0 | 0 | 0 | 113.5 | Q192 G198 | Q192-H196 PolarHBondContact O-N 2.93Å; Q192-H196 PolarHBondContact O-ND1 3.5Å; H196-G198 PolarHBondContact O-N 2.91Å |
| 197 | T | 57 | Low | 61.7 | Low | 69 Ų | 69 | 99.3 Ų | 99.3 | 42% | 0.423 | 54% | 0.54 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -77.5 | -1.9 | 177.7 | 51.7 | 0 | 0 | 0 | 0 | 114.2 | K148 R193 E194 V195 | K148-T197 VanDerWaalsContact CE-OG1 3.25Å; K148-T197 WeakPolarHBondContact CE-OG1 3.45Å; K148-T197 PolarHBondContact NZ-OG1 3.28Å; R193-T197 WeakPolarHBondContact O-CG2 3.32Å; R193-T197 PolarHBondContact O-N 3.25Å; R193-T197 PolarHBondContact O-OG1 2.93Å; E194-T197 PolarHBondContact O-OG1 2.9Å; V195-T197 PolarHBondContact O-N 3.47Å |
| 198 | G | 53.8 | Low | 59.7 | Low | 39 Ų | 39 | 106 Ų | 106 | 40% | 0.402 | 56% | 0.558 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -81.9 | -28.2 | 171.7 | 0 | 0 | 0 | 0 | 0 | 114.1 | V195 H196 | V195-G198 PolarHBondContact O-N 3.48Å; H196-G198 PolarHBondContact O-N 2.91Å |
| 199 | L | 47 | Very low | 57.3 | Low | 132 Ų | 132 | 104.4 Ų | 104.4 | 69% | 0.691 | 56% | 0.563 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.5 | -36.5 | -170 | -167.9 | 61.7 | 0 | 0 | 0 | 113.4 | H201 F202 | L199-H201 PolarHBondContact O-N 3.41Å; L199-F202 PolarHBondContact O-N 3.24Å |
| 200 | E | 41.6 | Very low | 54.9 | Low | 140 Ų | 140 | 105.9 Ų | 105.9 | 65% | 0.654 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -57.4 | -21.3 | 177.5 | -65.2 | -66.1 | 110 | 0 | 0 | 113.6 | A203 | E200-A203 PolarHBondContact O-N 2.89Å |
| 201 | H | 47.1 | Very low | 52.5 | Low | 106 Ų | 106 | 109.1 Ų | 109.1 | 49% | 0.491 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -70.7 | -32.4 | -178.8 | -153.7 | 125.1 | 0 | 0 | 0 | 112.7 | F141 L199 A203 | F141-H201 AromaticContact CD1-CE1 3.61Å; F141-H201 AromaticContact CE1-CE1 3.2Å; F141-H201 WeakPolarHBondContact CE1-CE1 3.49Å; F141-H201 AromaticContact CE1-NE2 3.3Å; F141-H201 VanDerWaalsContact CE1-NE2 3.3Å; F141-H201 WeakPolarHBondContact CE1-NE2 3.42Å; F141-H201 AromaticContact CZ-NE2 3.64Å; L199-H201 PolarHBondContact O-N 3.41Å; H201-A203 VanDerWaalsContact C-N 3.29Å; H201-A203 PolarHBondContact O-N 3.48Å |
| 202 | F | 43.6 | Very low | 50.2 | Low | 172 Ų | 172 | 112 Ų | 112 | 75% | 0.754 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -73.8 | -20.2 | 179.6 | -74.9 | -81.2 | 0 | 0 | 0 | 113 | L199 | L199-F202 PolarHBondContact O-N 3.24Å |
| 203 | A | 43.1 | Very low | 47.9 | Very low | 69 Ų | 69 | 111.5 Ų | 111.5 | 57% | 0.57 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -77.7 | -32.6 | -175.1 | 0 | 0 | 0 | 0 | 0 | 114.1 | E200 H201 | E200-A203 PolarHBondContact O-N 2.89Å; H201-A203 VanDerWaalsContact C-N 3.29Å; H201-A203 PolarHBondContact O-N 3.48Å |
| 204 | W | 41.1 | Very low | 46.2 | Very low | 228 Ų | 228 | 113 Ų | 113 | 86% | 0.864 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -93.3 | -10.1 | -175.3 | -87.7 | 72 | 0 | 0 | 0 | 115 | ||
| 205 | G | 42.1 | Very low | 44.8 | Very low | 43 Ų | 43 | 115.7 Ų | 115.7 | 44% | 0.443 | 68% | 0.675 | S | S | . | * | S | Bend | trans | -79.8 | -14.2 | 175.4 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||
| 206 | S | 40.6 | Very low | 43.9 | Very low | 99 Ų | 99 | 115.4 Ų | 115.4 | 69% | 0.692 | 68% | 0.675 | S | S | * | * | trans | -106.4 | 40.5 | -168.1 | -169 | 0 | 0 | 0 | 0 | 114 | ||||
| 207 | A | 45.1 | Very low | 43.1 | Very low | 91 Ų | 91 | 118.5 Ų | 118.5 | 75% | 0.752 | 69% | 0.69 | S | S | * | * | S | Bend | trans | -105.4 | -0.4 | 179.7 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||
| 208 | Y | 50.4 | Low | 41.9 | Very low | 200 Ų | 200 | 123.4 Ų | 123.4 | 78% | 0.784 | 71% | 0.707 | S | S | * | * | S | Bend | trans | -136.2 | 57.8 | -177.9 | 41.9 | -95.4 | 0 | 0 | 0 | 111.9 | ||
| 209 | G | 42.2 | Very low | 40.9 | Very low | 56 Ų | 56 | 128.2 Ų | 128.2 | 58% | 0.577 | 72% | 0.723 | S | S | * | * | S | Bend | trans | -168.7 | 113.3 | 175.2 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||
| 210 | T | 36.7 | Very low | 40.1 | Very low | 145 Ų | 145 | 129.2 Ų | 129.2 | 89% | 0.89 | 73% | 0.728 | S | S | * | * | trans | 69.9 | 111.6 | 165 | -14 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 211 | A | 33.7 | Very low | 39.6 | Very low | 92 Ų | 92 | 128.7 Ų | 128.7 | 76% | 0.76 | 73% | 0.73 | S | S | * | * | P | Polyproline II helix | trans | -70.9 | 134.6 | 165.5 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||
| 212 | P | 39.4 | Very low | 38.9 | Very low | 123 Ų | 123 | 131.9 Ų | 131.9 | 80% | 0.799 | 75% | 0.745 | S | S | * | * | P | Polyproline II helix | trans | -72.8 | 125.6 | 166 | -12.7 | 28.6 | 0 | 0 | 0 | 110 | ||
| 213 | S | 35.9 | Very low | 38.4 | Very low | 107 Ų | 107 | 132.4 Ų | 132.4 | 75% | 0.748 | 75% | 0.749 | S | S | * | * | P | Polyproline II helix | trans | -69.6 | 131.1 | 172.1 | -179.9 | 0 | 0 | 0 | 0 | 110.9 | ||
| 214 | P | 39.5 | Very low | 38.9 | Very low | 120 Ų | 120 | 133.2 Ų | 133.2 | 78% | 0.779 | 75% | 0.749 | S | S | * | * | P | Polyproline II helix | trans | -88.9 | 119.3 | 168.7 | 32.8 | -28.7 | 0 | 0 | 0 | 110.7 | ||
| 215 | L | 39.5 | Very low | 38.5 | Very low | 160 Ų | 160 | 131.2 Ų | 131.2 | 84% | 0.838 | 75% | 0.749 | S | S | * | * | P | Polyproline II helix | trans | -91.7 | 152.7 | 161.4 | -85.3 | 173.9 | 0 | 0 | 0 | 110.6 | ||
| 216 | P | 45.2 | Very low | 38 | Very low | 103 Ų | 103 | 132.2 Ų | 132.2 | 67% | 0.669 | 76% | 0.759 | S | S | * | * | P | Polyproline II helix | trans | -92.2 | 147.7 | -156.7 | 35.2 | -35.7 | 0 | 0 | 0 | 113.5 | ||
| 217 | H | 40.4 | Very low | 37.7 | Very low | 195 Ų | 195 | 139.7 Ų | 139.7 | 90% | 0.903 | 77% | 0.772 | S | S | * | * | trans | -118.3 | 122.9 | 156.3 | -88.6 | -72.2 | 0 | 0 | 0 | 111.1 | ||||
| 218 | H | 31.6 | Very low | 37.2 | Very low | 171 Ų | 171 | 141.6 Ų | 141.6 | 79% | 0.792 | 78% | 0.775 | S | S | * | * | trans | -82.8 | 142.7 | 176.3 | -124.9 | -119.8 | 0 | 0 | 0 | 110.2 | ||||
| 219 | L | 32.4 | Very low | 36.9 | Very low | 140 Ų | 140 | 138.1 Ų | 138.1 | 73% | 0.733 | 78% | 0.776 | S | S | * | * | trans | 138.2 | 116.9 | 136.5 | -70.1 | -173.5 | 0 | 0 | 0 | 114.5 | ||||
| 220 | L | 30.3 | Very low | 36.6 | Very low | 153 Ų | 153 | 139.5 Ų | 139.5 | 80% | 0.801 | 78% | 0.782 | S | S | * | * | trans | 31.7 | 133.4 | 139.8 | -60.2 | 170.2 | 0 | 0 | 0 | 118.8 | ||||
| 221 | L | 32 | Very low | 37 | Very low | 130 Ų | 130 | 138.4 Ų | 138.4 | 68% | 0.681 | 78% | 0.778 | S | S | * | * | -171.9 | 141.2 | 68.1 | -160.3 | 66.7 | 0 | 0 | 0 | 114.4 | |||||
| 222 | Q | 31.8 | Very low | 37.1 | Very low | 173 Ų | 173 | 145.1 Ų | 145.1 | 81% | 0.808 | 78% | 0.783 | S | S | * | * | trans | 64.6 | 130.7 | 150.8 | -75.4 | 164 | 34.4 | 0 | 0 | 125.1 | ||||
| 223 | H | 34.6 | Very low | 36.8 | Very low | 183 Ų | 183 | 146 Ų | 146 | 85% | 0.847 | 79% | 0.787 | S | S | * | * | trans | -73.9 | -175.1 | 165.3 | -108.6 | 53.3 | 0 | 0 | 0 | 112.3 | ||||
| 224 | P | 52.1 | Low | 36.6 | Very low | 86 Ų | 86 | 148.5 Ų | 148.5 | 56% | 0.558 | 79% | 0.791 | S | S | * | * | cis | -142.1 | 175.5 | -41.3 | 38.8 | -21.8 | 0 | 0 | 0 | 114.4 | ||||
| 225 | Q | 33.3 | Very low | 36.4 | Very low | 185 Ų | 185 | 148.4 Ų | 148.4 | 86% | 0.864 | 79% | 0.794 | S | S | * | * | trans | -176.6 | 150.1 | 136.8 | -72.4 | -36.4 | -43.6 | 0 | 0 | 107.4 | ||||
| 226 | G | 31.9 | Very low | 36.5 | Very low | 64 Ų | 64 | 146.3 Ų | 146.3 | 66% | 0.66 | 79% | 0.792 | S | S | * | * | cis | 173.4 | 147 | -8.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 227 | R | 34.2 | Very low | 37 | Very low | 257 Ų | 257 | 146.9 Ų | 146.9 | 97% | 0.97 | 80% | 0.796 | S | S | * | * | trans | 64 | 124.7 | 163.9 | -77.8 | -178.5 | 170.6 | 172.2 | -2.8 | 123.1 | ||||
| 228 | T | 33.3 | Very low | 37.8 | Very low | 131 Ų | 131 | 142.8 Ų | 142.8 | 80% | 0.804 | 79% | 0.787 | S | S | * | * | trans | -70.5 | 167.3 | 154.5 | 48.8 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 229 | P | 44.2 | Very low | 38.2 | Very low | 127 Ų | 127 | 139.2 Ų | 139.2 | 83% | 0.825 | 78% | 0.781 | S | S | * | * | -148.7 | 178.8 | 51.4 | 40.6 | -17.8 | 0 | 0 | 0 | 119.3 | |||||
| 230 | A | 36.1 | Very low | 38.3 | Very low | 85 Ų | 85 | 137.9 Ų | 137.9 | 70% | 0.702 | 78% | 0.783 | S | S | * | * | trans | -94.2 | 165.7 | 174.2 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 231 | P | 45.7 | Very low | 38.3 | Very low | 122 Ų | 122 | 135.8 Ų | 135.8 | 79% | 0.792 | 78% | 0.78 | S | S | * | * | -136.4 | 152.7 | 102 | 19.6 | 1.5 | 0 | 0 | 0 | 112.6 | |||||
| 232 | R | 35 | Very low | 38.3 | Very low | 233 Ų | 233 | 134.8 Ų | 134.8 | 88% | 0.879 | 79% | 0.785 | S | S | * | * | 79 | 87.1 | 51 | -67 | -178.6 | 176.1 | -95.2 | 1.1 | 116.6 | |||||
| 233 | T | 33.5 | Very low | 38.4 | Very low | 141 Ų | 141 | 132.2 Ų | 132.2 | 87% | 0.865 | 79% | 0.786 | S | S | * | * | trans | -158.5 | 132.7 | 136.2 | 46.5 | 0 | 0 | 0 | 0 | 106.3 | ||||
| 234 | N | 32.7 | Very low | 38.3 | Very low | 159 Ų | 159 | 129.2 Ų | 129.2 | 85% | 0.85 | 79% | 0.785 | S | S | * | * | cis | 100.5 | 75.1 | 14 | -155.3 | 89.2 | 0 | 0 | 0 | 116.5 | ||||
| 235 | S | 34.9 | Very low | 37.6 | Very low | 118 Ų | 118 | 130.2 Ų | 130.2 | 83% | 0.825 | 79% | 0.794 | S | S | * | * | trans | -159.8 | 103.3 | 149.8 | 44.5 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 236 | S | 40.7 | Very low | 37.8 | Very low | 116 Ų | 116 | 126.9 Ų | 126.9 | 81% | 0.811 | 79% | 0.791 | S | S | * | * | trans | -93.2 | -170.7 | 150.8 | -49.9 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 237 | P | 57.2 | Low | 37.7 | Very low | 115 Ų | 115 | 129.9 Ų | 129.9 | 75% | 0.747 | 80% | 0.802 | S | S | * | * | cis | -143.2 | -142.2 | 9.9 | 46.7 | -25 | 0 | 0 | 0 | 111.3 | ||||
| 238 | P | 56.6 | Low | 37.8 | Very low | 109 Ų | 109 | 122.9 Ų | 122.9 | 71% | 0.708 | 79% | 0.793 | S | S | * | * | cis | -116.6 | -169.8 | -32.3 | 33.1 | -12 | 0 | 0 | 0 | 110.1 | ||||
| 239 | S | 39.4 | Very low | 37.8 | Very low | 96 Ų | 96 | 122.1 Ų | 122.1 | 67% | 0.671 | 79% | 0.793 | S | S | * | * | cis | -159.5 | 150.3 | 20.3 | -39.4 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 240 | S | 35.2 | Very low | 37.2 | Very low | 112 Ų | 112 | 121.2 Ų | 121.2 | 78% | 0.783 | 79% | 0.789 | S | S | * | * | trans | 29.6 | 143.8 | 140.2 | 57.8 | 0 | 0 | 0 | 0 | 121.9 | ||||
| 241 | C | 29.2 | Very low | 37 | Very low | 109 Ų | 109 | 123.3 Ų | 123.3 | 74% | 0.736 | 80% | 0.799 | S | S | * | * | cis | -156.4 | 146.8 | 17.5 | 37.4 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 242 | S | 33.5 | Very low | 36.7 | Very low | 110 Ų | 110 | 120.8 Ų | 120.8 | 77% | 0.769 | 80% | 0.795 | S | S | * | * | 49 | 134.1 | 90.4 | -42.3 | 0 | 0 | 0 | 0 | 114.5 | |||||
| 243 | S | 33 | Very low | 36.6 | Very low | 119 Ų | 119 | 118.7 Ų | 118.7 | 83% | 0.832 | 80% | 0.795 | S | S | * | * | cis | -162.4 | 177.4 | 13.9 | 20.8 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 244 | S | 33.2 | Very low | 36.6 | Very low | 119 Ų | 119 | 115.6 Ų | 115.6 | 83% | 0.832 | 78% | 0.784 | S | S | * | * | trans | -66 | 170.1 | -170.2 | 46.9 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 245 | S | 37.2 | Very low | 36.7 | Very low | 107 Ų | 107 | 114.3 Ų | 114.3 | 75% | 0.748 | 79% | 0.787 | S | S | * | * | trans | -76 | 166.5 | -174.2 | 49.8 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 246 | S | 36.5 | Very low | 36.5 | Very low | 115 Ų | 115 | 112 Ų | 112 | 80% | 0.804 | 78% | 0.783 | S | S | * | * | trans | 105.7 | 122.6 | 138 | 76.8 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 247 | S | 31.2 | Very low | 36.2 | Very low | 127 Ų | 127 | 111.4 Ų | 111.4 | 89% | 0.888 | 78% | 0.784 | S | S | * | * | trans | -162.9 | 154.7 | 139 | 46.8 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 248 | S | 35.3 | Very low | 35 | Very low | 110 Ų | 110 | 110.7 Ų | 110.7 | 77% | 0.769 | 78% | 0.782 | S | S | * | * | trans | -127.7 | -178.6 | -162.7 | 53.6 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 249 | S | 32.8 | Very low | 34 | Very low | 115 Ų | 115 | 116 Ų | 116 | 80% | 0.804 | 79% | 0.788 | S | S | * | * | trans | 74.2 | 152.6 | 174.8 | 86.7 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 250 | S | 31.9 | Very low | 33.7 | Very low | 108 Ų | 108 | 118.6 Ų | 118.6 | 76% | 0.755 | 79% | 0.793 | S | S | * | * | cis | -157.2 | 155.3 | -2 | 44.4 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 251 | S | 32.8 | Very low | 33.5 | Very low | 129 Ų | 129 | 117.4 Ų | 117.4 | 90% | 0.902 | 79% | 0.785 | S | S | * | * | trans | -170.3 | 123.5 | 152.1 | 44.1 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 252 | G | 39.1 | Very low | 33.6 | Very low | 69 Ų | 69 | 120.1 Ų | 120.1 | 71% | 0.711 | 79% | 0.789 | S | S | * | * | trans | 176.3 | 56.3 | -174.5 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 253 | E | 32.2 | Very low | 33.7 | Very low | 190 Ų | 190 | 122.6 Ų | 122.6 | 89% | 0.888 | 79% | 0.792 | S | S | * | * | trans | -150.6 | 150.7 | 172.2 | -58.9 | -69.4 | 152.6 | 0 | 0 | 107 | ||||
| 254 | A | 33.4 | Very low | 33.7 | Very low | 76 Ų | 76 | 122.2 Ų | 122.2 | 63% | 0.628 | 79% | 0.79 | S | S | * | * | cis | -168.4 | 159.8 | -25.8 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 255 | S | 35 | Very low | 34.3 | Very low | 132 Ų | 132 | 121.8 Ų | 121.8 | 92% | 0.923 | 78% | 0.784 | S | S | * | * | trans | 68.7 | 143.3 | 160.9 | -54.4 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 256 | G | 30.2 | Very low | 34 | Very low | 70 Ų | 70 | 122.3 Ų | 122.3 | 72% | 0.722 | 78% | 0.783 | S | S | * | * | cis | 171 | 175.7 | -7.4 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 257 | A | 34.8 | Very low | 33.6 | Very low | 103 Ų | 103 | 125 Ų | 125 | 85% | 0.851 | 78% | 0.783 | S | S | * | * | trans | 66.6 | 140.1 | 166.5 | 0 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 258 | S | 32.9 | Very low | 33.5 | Very low | 99 Ų | 99 | 122.9 Ų | 122.9 | 69% | 0.692 | 77% | 0.768 | S | S | * | * | cis | -149.3 | 138.8 | 5.5 | -92.4 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 259 | R | 34.3 | Very low | 33.3 | Very low | 222 Ų | 222 | 125.1 Ų | 125.1 | 84% | 0.838 | 77% | 0.771 | S | S | * | * | 54.4 | 135.9 | 105 | -57.9 | -173.6 | 173.3 | -107.9 | -1 | 115.1 | |||||
| 260 | L | 33.2 | Very low | 33.3 | Very low | 150 Ų | 150 | 130.8 Ų | 130.8 | 79% | 0.785 | 78% | 0.775 | S | S | * | * | cis | -149 | 171.6 | 37.5 | -68.7 | 163.1 | 0 | 0 | 0 | 109.2 | ||||
| 261 | S | 31.9 | Very low | 33.5 | Very low | 86 Ų | 86 | 131.8 Ų | 131.8 | 60% | 0.601 | 78% | 0.776 | S | S | * | * | cis | -173 | 157.5 | -16.8 | -99.1 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 262 | M | 32 | Very low | 34.7 | Very low | 167 Ų | 167 | 131 Ų | 131 | 82% | 0.823 | 77% | 0.767 | S | S | * | * | trans | 47.1 | 137.9 | 139.2 | -57.7 | -67.5 | -176.9 | 0 | 0 | 120.8 | ||||
| 263 | L | 35.9 | Very low | 35.2 | Very low | 161 Ų | 161 | 132.6 Ų | 132.6 | 84% | 0.843 | 77% | 0.765 | S | S | * | * | cis | -148.3 | 159.1 | 27.7 | -71 | 166.1 | 0 | 0 | 0 | 112.7 | ||||
| 264 | S | 33 | Very low | 35.2 | Very low | 111 Ų | 111 | 131.2 Ų | 131.2 | 78% | 0.776 | 76% | 0.764 | S | S | * | * | trans | -104.8 | -179.9 | 159.5 | -36.3 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 265 | P | 44.8 | Very low | 35.2 | Very low | 111 Ų | 111 | 131.3 Ų | 131.3 | 72% | 0.721 | 77% | 0.772 | S | S | * | * | -157.7 | -167.5 | 57.2 | 43.5 | -19.8 | 0 | 0 | 0 | 118.2 | |||||
| 266 | T | 31.3 | Very low | 35.2 | Very low | 117 Ų | 117 | 130.1 Ų | 130.1 | 72% | 0.718 | 76% | 0.764 | S | S | * | * | trans | 69.1 | 112.1 | 159.2 | 49.9 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 267 | E | 28.7 | Very low | 35.4 | Very low | 173 Ų | 173 | 135.6 Ų | 135.6 | 81% | 0.808 | 78% | 0.776 | S | S | * | * | 77.6 | 149.7 | 87.2 | -81.2 | -138.3 | 93.7 | 0 | 0 | 114.5 | |||||
| 268 | S | 28.9 | Very low | 35.3 | Very low | 82 Ų | 82 | 135 Ų | 135 | 57% | 0.573 | 77% | 0.771 | S | S | * | * | cis | -165.1 | 154.4 | -19.3 | -108.1 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 269 | L | 31.1 | Very low | 35.3 | Very low | 157 Ų | 157 | 138.3 Ų | 138.3 | 82% | 0.822 | 78% | 0.78 | S | S | * | * | trans | 12.1 | 130.3 | 154.4 | -70.9 | 152.3 | 0 | 0 | 0 | 120.9 | ||||
| 270 | R | 31.7 | Very low | 35.2 | Very low | 234 Ų | 234 | 132.5 Ų | 132.5 | 88% | 0.883 | 77% | 0.773 | S | S | * | * | 163 | 167.3 | 98.1 | -158.2 | 160.5 | -173.8 | 114.6 | -0.5 | 112.7 | |||||
| 271 | V | 35.4 | Very low | 35.3 | Very low | 129 Ų | 129 | 132.5 Ų | 132.5 | 78% | 0.782 | 77% | 0.773 | S | S | * | * | trans | -114.9 | -159.3 | -164.7 | -155.1 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 272 | P | 59.1 | Low | 36.1 | Very low | 111 Ų | 111 | 134.3 Ų | 134.3 | 72% | 0.721 | 78% | 0.783 | S | S | * | * | -93.8 | -160.8 | -126.5 | 42.5 | -22.7 | 0 | 0 | 0 | 113.6 | |||||
| 273 | P | 49.9 | Very low | 36.4 | Very low | 104 Ų | 104 | 131.6 Ų | 131.6 | 68% | 0.675 | 78% | 0.775 | S | S | * | * | cis | -150.9 | -167.1 | 14.1 | 46.8 | -24.7 | 0 | 0 | 0 | 119.8 | ||||
| 274 | N | 32.2 | Very low | 37.1 | Very low | 160 Ų | 160 | 129.8 Ų | 129.8 | 86% | 0.856 | 77% | 0.773 | S | S | * | * | trans | 81.9 | 139.4 | 152.5 | -75.5 | 0.9 | 0 | 0 | 0 | 122.2 | ||||
| 275 | G | 33 | Very low | 37.2 | Very low | 78 Ų | 78 | 130.1 Ų | 130.1 | 80% | 0.804 | 77% | 0.771 | S | S | * | * | trans | 175.4 | 88.9 | 171.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 276 | S | 34.4 | Very low | 36.7 | Very low | 107 Ų | 107 | 129.9 Ų | 129.9 | 75% | 0.748 | 77% | 0.772 | S | S | * | * | trans | -92.8 | 153.1 | -177.2 | -34.5 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 277 | L | 36 | Very low | 36.8 | Very low | 186 Ų | 186 | 133.2 Ų | 133.2 | 97% | 0.974 | 78% | 0.776 | S | S | * | * | trans | -158.1 | 161.2 | 141.4 | -84.7 | -161.7 | 0 | 0 | 0 | 110.9 | ||||
| 278 | A | 32.5 | Very low | 37.1 | Very low | 90 Ų | 90 | 132 Ų | 132 | 74% | 0.744 | 78% | 0.775 | S | S | * | * | trans | -142.5 | 163.7 | -165.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 279 | L | 32.2 | Very low | 37.3 | Very low | 169 Ų | 169 | 133.3 Ų | 133.3 | 89% | 0.885 | 78% | 0.784 | S | S | * | * | trans | 177.6 | 146.4 | 155.8 | -120.6 | 71.2 | 0 | 0 | 0 | 106.3 | ||||
| 280 | S | 32 | Very low | 38.3 | Very low | 99 Ų | 99 | 131.7 Ų | 131.7 | 69% | 0.692 | 78% | 0.783 | S | S | * | * | cis | 174.5 | 139.5 | -18.3 | 47.8 | 0 | 0 | 0 | 0 | 105.5 | ||||
| 281 | L | 35.2 | Very low | 39.5 | Very low | 150 Ų | 150 | 125.7 Ų | 125.7 | 79% | 0.785 | 77% | 0.774 | S | S | * | * | trans | -75.5 | 166.4 | 179.2 | -122.2 | 87.3 | 0 | 0 | 0 | 112.2 | V283 | L281-V283 HydrophobicContact CD2-CG2 3.98Š| ||
| 282 | P | 48.3 | Very low | 39.5 | Very low | 125 Ų | 125 | 127.9 Ų | 127.9 | 81% | 0.812 | 78% | 0.781 | S | S | * | * | -149.2 | 167.2 | 82.6 | 37.3 | -17.3 | 0 | 0 | 0 | 118.1 | |||||
| 283 | V | 39.5 | Very low | 38.6 | Very low | 109 Ų | 109 | 128.7 Ų | 128.7 | 66% | 0.661 | 78% | 0.783 | S | S | * | * | trans | -106.2 | 155.2 | 172.9 | 166.7 | 0 | 0 | 0 | 0 | 109.6 | L281 | L281-V283 HydrophobicContact CD2-CG2 3.98Š| ||
| 284 | P | 49.4 | Very low | 37.7 | Very low | 123 Ų | 123 | 128.9 Ų | 128.9 | 80% | 0.799 | 79% | 0.787 | S | S | * | * | trans | -132.9 | -178.6 | 140 | 27.6 | -9.1 | 0 | 0 | 0 | 114.2 | ||||
| 285 | T | 35 | Very low | 37.8 | Very low | 118 Ų | 118 | 126 Ų | 126 | 72% | 0.724 | 78% | 0.779 | S | S | * | * | trans | -122.5 | 144.8 | -140.9 | 52.9 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 286 | S | 34.4 | Very low | 37.9 | Very low | 106 Ų | 106 | 129.7 Ų | 129.7 | 74% | 0.741 | 78% | 0.78 | S | S | * | * | trans | 73.3 | 131.9 | 136.7 | -64.3 | 0 | 0 | 0 | 0 | 124 | ||||
| 287 | K | 34.3 | Very low | 37.8 | Very low | 187 Ų | 187 | 129.6 Ų | 129.6 | 81% | 0.813 | 78% | 0.779 | S | S | * | * | 110 | 126.6 | 122.3 | -100.1 | -178.5 | -178.6 | -178.5 | 0 | 121.6 | |||||
| 288 | L | 34.2 | Very low | 37.7 | Very low | 148 Ų | 148 | 126.4 Ų | 126.4 | 78% | 0.775 | 77% | 0.772 | S | S | * | * | trans | 96.6 | 110.4 | 144.5 | -65.3 | 167.3 | 0 | 0 | 0 | 122.9 | ||||
| 289 | S | 34.4 | Very low | 37.7 | Very low | 110 Ų | 110 | 130.4 Ų | 130.4 | 77% | 0.769 | 78% | 0.78 | S | S | * | * | trans | 71.9 | 141.8 | 140.9 | 43.1 | 0 | 0 | 0 | 0 | 124 | ||||
| 290 | P | 51.7 | Low | 37.9 | Very low | 122 Ų | 122 | 128.3 Ų | 128.3 | 79% | 0.792 | 78% | 0.78 | S | S | * | * | trans | -103 | -160.8 | 169.9 | 46.3 | -38.3 | 0 | 0 | 0 | 110.8 | ||||
| 291 | P | 55.6 | Low | 37.9 | Very low | 108 Ų | 108 | 127.5 Ų | 127.5 | 70% | 0.701 | 78% | 0.779 | S | S | * | * | cis | -128 | 172.7 | -14.5 | 41.2 | -27.1 | 0 | 0 | 0 | 114.1 | ||||
| 292 | L | 36 | Very low | 37.8 | Very low | 176 Ų | 176 | 130.6 Ų | 130.6 | 92% | 0.921 | 79% | 0.786 | S | S | * | * | trans | -147.4 | 157 | 152.5 | -84.8 | -171.4 | 0 | 0 | 0 | 112.8 | ||||
| 293 | V | 40.8 | Very low | 37.6 | Very low | 127 Ų | 127 | 130 Ų | 130 | 77% | 0.77 | 78% | 0.782 | S | S | * | * | trans | -107.5 | 175.7 | -170.8 | -69.1 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 294 | S | 30.8 | Very low | 37.4 | Very low | 109 Ų | 109 | 132.4 Ų | 132.4 | 76% | 0.762 | 79% | 0.791 | S | S | * | * | trans | 84.7 | 150 | 168.5 | -51.3 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 295 | S | 33.3 | Very low | 36.6 | Very low | 98 Ų | 98 | 132.3 Ų | 132.3 | 69% | 0.685 | 79% | 0.793 | S | S | * | * | cis | -171 | 144.4 | -29.3 | -106.7 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 296 | L | 35.6 | Very low | 36.9 | Very low | 157 Ų | 157 | 136 Ų | 136 | 82% | 0.822 | 80% | 0.8 | S | S | * | * | trans | 61.7 | 138.4 | 144.7 | -64 | 172.1 | 0 | 0 | 0 | 122.4 | ||||
| 297 | S | 32.3 | Very low | 36.9 | Very low | 105 Ų | 105 | 134.2 Ų | 134.2 | 73% | 0.734 | 80% | 0.797 | S | S | * | * | trans | 69.9 | 105 | 141.9 | -61.2 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 298 | S | 33.5 | Very low | 37 | Very low | 118 Ų | 118 | 130 Ų | 130 | 83% | 0.825 | 80% | 0.797 | S | S | * | * | -168.8 | 168.6 | 122.9 | -86.9 | 0 | 0 | 0 | 0 | 111.8 | |||||
| 299 | L | 33.9 | Very low | 37.1 | Very low | 175 Ų | 175 | 132.4 Ų | 132.4 | 92% | 0.916 | 80% | 0.802 | S | S | * | * | trans | 83.1 | 61.3 | 176.6 | -51.3 | 178 | 0 | 0 | 0 | 117.2 | ||||
| 300 | S | 35.3 | Very low | 37.5 | Very low | 125 Ų | 125 | 132.7 Ų | 132.7 | 87% | 0.874 | 80% | 0.801 | S | S | * | * | trans | -108.9 | 109.6 | 145 | 59.9 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 301 | A | 31.9 | Very low | 36.6 | Very low | 81 Ų | 81 | 135.1 Ų | 135.1 | 67% | 0.669 | 81% | 0.806 | S | S | * | * | trans | -149.9 | 88.4 | 178.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 302 | F | 34.5 | Very low | 35.7 | Very low | 215 Ų | 215 | 137.7 Ų | 137.7 | 94% | 0.943 | 81% | 0.813 | S | S | * | * | trans | -150.5 | 126 | 151.6 | -82.1 | -64.4 | 0 | 0 | 0 | 109.1 | ||||
| 303 | P | 42.8 | Very low | 35.4 | Very low | 112 Ų | 112 | 134.3 Ų | 134.3 | 73% | 0.727 | 80% | 0.804 | S | S | * | * | trans | -93.4 | 132.8 | -178.4 | 34.5 | -31.2 | 0 | 0 | 0 | 111.6 | ||||
| 304 | L | 36.6 | Very low | 35.5 | Very low | 160 Ų | 160 | 133.9 Ų | 133.9 | 84% | 0.838 | 80% | 0.803 | S | S | * | * | trans | -130.3 | 100.4 | 157.8 | -74 | 178.6 | 0 | 0 | 0 | 108.7 | F306 | L304-F306 PolarHBondContact O-N 3Š| ||
| 305 | S | 32 | Very low | 35.8 | Very low | 121 Ų | 121 | 135.3 Ų | 135.3 | 85% | 0.846 | 81% | 0.808 | S | S | * | * | trans | -70.4 | 115.9 | 175.7 | -57.1 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 306 | F | 41.7 | Very low | 35.9 | Very low | 197 Ų | 197 | 135.3 Ų | 135.3 | 86% | 0.864 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -90.1 | 121.2 | 160.9 | -82.8 | -85.7 | 0 | 0 | 0 | 109.1 | L304 | L304-F306 PolarHBondContact O-N 3Š|
| 307 | G | 34 | Very low | 36.1 | Very low | 67 Ų | 67 | 135.7 Ų | 135.7 | 69% | 0.691 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -65.8 | 145.1 | -176.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||
| 308 | A | 35.1 | Very low | 36.1 | Very low | 98 Ų | 98 | 134.3 Ų | 134.3 | 81% | 0.81 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -71.2 | 145.8 | 173.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||
| 309 | F | 37.2 | Very low | 36.1 | Very low | 200 Ų | 200 | 134.7 Ų | 134.7 | 88% | 0.877 | 82% | 0.815 | S | S | * | * | trans | -107.8 | 143.4 | 157.7 | -72.7 | -75 | 0 | 0 | 0 | 109.1 | ||||
| 310 | P | 43.5 | Very low | 36.2 | Very low | 115 Ų | 115 | 133.3 Ų | 133.3 | 75% | 0.747 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -80.9 | 149.9 | -158.5 | 30.3 | -36.2 | 0 | 0 | 0 | 115 | ||
| 311 | L | 31.7 | Very low | 36.3 | Very low | 174 Ų | 174 | 132.9 Ų | 132.9 | 91% | 0.911 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -56.5 | 132.8 | 162 | -89.7 | 151.6 | 0 | 0 | 0 | 111.4 | ||
| 312 | I | 37.3 | Very low | 37.3 | Very low | 162 Ų | 162 | 134.8 Ų | 134.8 | 83% | 0.831 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -102.9 | 123.8 | 158.4 | -67.1 | 171 | 0 | 0 | 0 | 107 | ||
| 313 | S | 30.5 | Very low | 37.1 | Very low | 105 Ų | 105 | 131.3 Ų | 131.3 | 73% | 0.734 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -96.4 | 141.8 | -177.4 | -158.1 | 0 | 0 | 0 | 0 | 111.1 | ||
| 314 | P | 42.4 | Very low | 37.1 | Very low | 117 Ų | 117 | 130.8 Ų | 130.8 | 76% | 0.76 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -102.3 | 123.6 | -177 | 35.6 | -29.4 | 0 | 0 | 0 | 113.5 | ||
| 315 | T | 36 | Very low | 36.9 | Very low | 139 Ų | 139 | 130.1 Ų | 130.1 | 85% | 0.853 | 81% | 0.814 | S | S | * | * | trans | -153.2 | 116.4 | 161.4 | -51.6 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 316 | A | 35.9 | Very low | 37.5 | Very low | 99 Ų | 99 | 133.5 Ų | 133.5 | 82% | 0.818 | 82% | 0.819 | S | S | * | * | trans | -175.7 | 145.7 | 138.1 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 317 | I | 39.2 | Very low | 37.2 | Very low | 164 Ų | 164 | 130 Ų | 130 | 84% | 0.841 | 82% | 0.819 | S | S | * | * | trans | -100.3 | 145.1 | -171.6 | -70 | 161.5 | 0 | 0 | 0 | 110.8 | T319 | I317-T319 HydrophobicContact CG2-CG2 4.36Š| ||
| 318 | G | 32.5 | Very low | 37.4 | Very low | 77 Ų | 77 | 136.2 Ų | 136.2 | 79% | 0.794 | 83% | 0.827 | S | S | * | * | trans | -153.9 | 109.3 | 167.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 319 | T | 33.3 | Very low | 38 | Very low | 126 Ų | 126 | 137.7 Ų | 137.7 | 77% | 0.773 | 83% | 0.828 | S | S | * | * | trans | -96.3 | 122.9 | -174.8 | 46.4 | 0 | 0 | 0 | 0 | 113 | I317 | I317-T319 HydrophobicContact CG2-CG2 4.36Š| ||
| 320 | V | 36.3 | Very low | 38.1 | Very low | 145 Ų | 145 | 138 Ų | 138 | 88% | 0.879 | 83% | 0.825 | S | S | * | * | trans | -149.7 | 149.6 | 151.5 | -75.9 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 321 | S | 38.9 | Very low | 38.5 | Very low | 117 Ų | 117 | 143.3 Ų | 143.3 | 82% | 0.818 | 83% | 0.83 | S | S | * | * | trans | -134.4 | 175.9 | 179.4 | -59.8 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 322 | P | 51.4 | Low | 39.3 | Very low | 120 Ų | 120 | 138.4 Ų | 138.4 | 78% | 0.779 | 81% | 0.809 | S | S | * | * | -128.5 | 153.9 | -51 | 35.7 | -22.6 | 0 | 0 | 0 | 111.6 | |||||
| 323 | T | 31.4 | Very low | 39.6 | Very low | 143 Ų | 143 | 142.7 Ų | 142.7 | 88% | 0.877 | 82% | 0.815 | S | S | * | * | trans | -142.3 | 136.4 | 161.6 | -50.2 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 324 | S | 42.3 | Very low | 39.9 | Very low | 101 Ų | 101 | 140.8 Ų | 140.8 | 71% | 0.706 | 81% | 0.812 | S | S | * | * | trans | -69.1 | 140.4 | 179.2 | 52.2 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 325 | T | 33.1 | Very low | 40.3 | Very low | 145 Ų | 145 | 143.2 Ų | 143.2 | 89% | 0.89 | 82% | 0.815 | S | S | * | * | trans | -170.3 | 149.2 | 131.7 | 16.1 | 0 | 0 | 0 | 0 | 112 | ||||
| 326 | M | 44.7 | Very low | 41.1 | Very low | 193 Ų | 193 | 145.5 Ų | 145.5 | 95% | 0.951 | 82% | 0.816 | S | S | * | * | trans | -71.5 | 133.6 | -179.8 | -80.2 | -92.6 | 150.4 | 0 | 0 | 112.9 | ||||
| 327 | S | 33.5 | Very low | 41.5 | Very low | 123 Ų | 123 | 148.3 Ų | 148.3 | 86% | 0.86 | 82% | 0.816 | S | S | * | * | trans | -153.4 | 156.8 | 158.3 | 55.4 | 0 | 0 | 0 | 0 | 113 | ||||
| 328 | K | 39.9 | Very low | 41.8 | Very low | 198 Ų | 198 | 143.9 Ų | 143.9 | 86% | 0.861 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -87.9 | 160.4 | -161.3 | -74.3 | 159.9 | 169 | 165.1 | 0 | 113.9 | ||
| 329 | P | 47.3 | Very low | 42.2 | Very low | 129 Ų | 129 | 144.5 Ų | 144.5 | 84% | 0.838 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -63 | 138.7 | 169.9 | -19.1 | 32.1 | 0 | 0 | 0 | 112.9 | ||
| 330 | Y | 38.8 | Very low | 42.4 | Very low | 205 Ų | 205 | 152.2 Ų | 152.2 | 80% | 0.804 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -71.4 | 129.8 | -179.9 | 176.3 | -97.1 | 0 | 0 | 0 | 112.6 | P332 | Y330-P332 HydrophobicContact CE1-CB 4.03Å; Y330-P332 HydrophobicContact CE1-CG 4.28Å |
| 331 | R | 52.4 | Low | 42.7 | Very low | 227 Ų | 227 | 152.6 Ų | 152.6 | 86% | 0.857 | 83% | 0.829 | S | S | * | * | trans | -106 | 124.9 | 160.2 | -85.9 | -165.2 | -175.9 | -87.5 | 4.2 | 109 | ||||
| 332 | P | 49 | Very low | 42.9 | Very low | 72 Ų | 72 | 154.5 Ų | 154.5 | 47% | 0.468 | 83% | 0.83 | S | S | . | * | trans | -73.1 | 166.1 | 155.3 | 32.2 | -30.4 | 0 | 0 | 0 | 109.7 | Y330 | Y330-P332 HydrophobicContact CE1-CB 4.03Å; Y330-P332 HydrophobicContact CE1-CG 4.28Å | ||
| 333 | W | 42.3 | Very low | 42.5 | Very low | 251 Ų | 251 | 156.4 Ų | 156.4 | 95% | 0.951 | 83% | 0.833 | S | S | * | * | trans | 75.3 | 67 | -176.1 | -48.7 | 92.1 | 0 | 0 | 0 | 115.6 | ||||
| 334 | G | 38.3 | Very low | 43.1 | Very low | 65 Ų | 65 | 157.2 Ų | 157.2 | 67% | 0.67 | 83% | 0.83 | S | S | * | * | trans | -126 | 108.3 | 153.4 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 335 | M | 50.8 | Low | 43.2 | Very low | 169 Ų | 169 | 160.7 Ų | 160.7 | 83% | 0.833 | 84% | 0.838 | S | S | * | * | trans | -102.4 | 97.2 | 167.2 | -84 | 178.2 | 65.2 | 0 | 0 | 107.9 | I337 | M335-I337 PolarHBondContact O-N 3.01Š| ||
| 336 | E | 51 | Low | 43.8 | Very low | 186 Ų | 186 | 161.7 Ų | 161.7 | 87% | 0.869 | 83% | 0.834 | S | S | * | * | trans | -66.5 | 110.9 | 167 | -59.9 | -71.7 | 126.6 | 0 | 0 | 108.1 | G338 | E336-G338 PolarHBondContact O-N 2.93Š| ||
| 337 | I | 45.8 | Very low | 43.8 | Very low | 159 Ų | 159 | 159.5 Ų | 159.5 | 82% | 0.815 | 83% | 0.826 | S | S | * | * | trans | -92 | 97 | 167 | -64.3 | 172.3 | 0 | 0 | 0 | 106.3 | M335 | M335-I337 PolarHBondContact O-N 3.01Š| ||
| 338 | G | 45 | Very low | 44.6 | Very low | 71 Ų | 71 | 162.3 Ų | 162.3 | 73% | 0.732 | 82% | 0.823 | S | S | * | * | trans | -67.7 | 131 | 172.7 | 0 | 0 | 0 | 0 | 0 | 110.6 | E336 | E336-G338 PolarHBondContact O-N 2.93Š| ||
| 339 | A | 40.7 | Very low | 45 | Very low | 90 Ų | 90 | 159.3 Ų | 159.3 | 74% | 0.744 | 82% | 0.82 | S | S | * | * | trans | -90.1 | 121.9 | 167.6 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 340 | F | 38.2 | Very low | 44.7 | Very low | 288 Ų | 288 | 162.1 Ų | 162.1 | 100% | 1.263 | 82% | 0.819 | S | S | * | * | trans | -153.6 | 0 | 154 | -89.9 | -69.1 | 0 | 0 | 0 | 108.2 |
Retrieved 340 of 340 residues in 96.5 ms
(Link to these results)