| 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 | 40.7 | Very low | 51.5 | Low | 248 Ų | 248 | 104.1 Ų | 104.1 | 100% | 1.222 | 55% | 0.545 | S | S | * | . | 0 | 127.7 | 0 | -69.2 | 161 | 166.7 | 0 | 0 | 108.3 | |||||
| 2 | K | 45.9 | Very low | 52 | Low | 153 Ų | 153 | 100.3 Ų | 100.3 | 67% | 0.665 | 53% | 0.525 | S | S | * | . | trans | -73.1 | 149.3 | 159.1 | -74.1 | -172.8 | 174 | -171.5 | 0 | 107.6 | ||||
| 3 | S | 47.5 | Very low | 52.4 | Low | 59 Ų | 59 | 100.2 Ų | 100.2 | 41% | 0.413 | 53% | 0.525 | S | S | . | . | trans | -72.8 | 143.6 | 173 | 65.4 | 0 | 0 | 0 | 0 | 110.1 | V5 N6 | S3-V5 PolarHBondContact O-N 3.03Å; S3-V5 VanDerWaalsContact O-N 3.13Å; S3-N6 PolarHBondContact O-N 2.76Å; S3-N6 VanDerWaalsContact O-N 3.08Å; S3-N6 PolarHBondContact OG-OD1 2.84Å | ||
| 4 | N | 51.7 | Low | 52.6 | Low | 132 Ų | 132 | 99.1 Ų | 99.1 | 71% | 0.706 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -62.9 | -21.5 | 178.9 | -62.4 | 3.9 | 0 | 0 | 0 | 112.2 | I7 L8 | N4-I7 PolarHBondContact O-N 3.37Å; N4-L8 PolarHBondContact O-N 3.08Å |
| 5 | V | 53.1 | Low | 52.5 | Low | 88 Ų | 88 | 95.4 Ų | 95.4 | 53% | 0.533 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -62.6 | -44.9 | 173.6 | -178.1 | 0 | 0 | 0 | 0 | 111.2 | S3 I7 L8 F9 | S3-V5 PolarHBondContact O-N 3.03Å; S3-V5 VanDerWaalsContact O-N 3.13Å; V5-I7 VanDerWaalsContact C-N 3.3Å; V5-I7 PolarHBondContact O-N 3.1Å; V5-L8 PolarHBondContact O-N 3.48Å; V5-F9 HydrophobicContact CG1-CD2 3.86Å; V5-F9 HydrophobicContact CG1-CE2 3.75Å; V5-F9 WeakPolarHBondContact O-CD2 3.25Å; V5-F9 PolarHBondContact O-N 3.1Å |
| 6 | N | 51.1 | Low | 52.4 | Low | 84 Ų | 84 | 97.8 Ų | 97.8 | 45% | 0.449 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -64.8 | -35.2 | 179.3 | -73 | 32.8 | 0 | 0 | 0 | 111.7 | S3 L8 F9 D10 | S3-N6 PolarHBondContact O-N 2.76Å; S3-N6 VanDerWaalsContact O-N 3.08Å; S3-N6 PolarHBondContact OG-OD1 2.84Å; N6-L8 VanDerWaalsContact C-N 3.27Å; N6-L8 PolarHBondContact O-N 3.5Å; N6-F9 PolarHBondContact O-N 2.9Å; N6-D10 VanDerWaalsContact O-CB 3.26Å; N6-D10 WeakPolarHBondContact O-CB 3.26Å; N6-D10 VanDerWaalsContact O-CG 3.23Å; N6-D10 PolarHBondContact O-N 3.02Å |
| 7 | I | 54.2 | Low | 52.2 | Low | 88 Ų | 88 | 97.9 Ų | 97.9 | 45% | 0.451 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -61.2 | -38 | 177.2 | -57.8 | 176 | 0 | 0 | 0 | 111 | N4 V5 G11 | N4-I7 PolarHBondContact O-N 3.37Å; V5-I7 VanDerWaalsContact C-N 3.3Å; V5-I7 PolarHBondContact O-N 3.1Å; I7-G11 PolarHBondContact O-N 3.36Å |
| 8 | L | 51.5 | Low | 51.6 | Low | 61 Ų | 61 | 96.9 Ų | 96.9 | 32% | 0.319 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -71 | -41.5 | 179.2 | -155.7 | 160.6 | 0 | 0 | 0 | 111.5 | N4 V5 N6 L12 L71 | N4-L8 PolarHBondContact O-N 3.08Å; V5-L8 PolarHBondContact O-N 3.48Å; N6-L8 VanDerWaalsContact C-N 3.27Å; N6-L8 PolarHBondContact O-N 3.5Å; L8-L12 HydrophobicContact CD2-CD1 3.72Å; L8-L12 HydrophobicContact CD2-CG 4.32Å; L8-L12 WeakPolarHBondContact O-CG 3.48Å; L8-L12 PolarHBondContact O-N 3.08Å; L8-L71 HydrophobicContact CD1-CD1 4.21Å |
| 9 | F | 57.1 | Low | 50.9 | Low | 126 Ų | 126 | 97.3 Ų | 97.3 | 55% | 0.553 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -72 | -40.1 | 175.3 | -77 | -71.7 | 0 | 0 | 0 | 113.6 | V5 N6 G11 L12 N13 | V5-F9 HydrophobicContact CG1-CD2 3.86Å; V5-F9 HydrophobicContact CG1-CE2 3.75Å; V5-F9 WeakPolarHBondContact O-CD2 3.25Å; V5-F9 PolarHBondContact O-N 3.1Å; N6-F9 PolarHBondContact O-N 2.9Å; F9-G11 VanDerWaalsContact C-N 3.31Å; F9-G11 PolarHBondContact O-N 2.9Å; F9-L12 PolarHBondContact O-N 3.42Å; F9-N13 WeakPolarHBondContact O-CB 3.35Å; F9-N13 PolarHBondContact O-N 3.32Å |
| 10 | D | 56.1 | Low | 50.3 | Low | 83 Ų | 83 | 100.5 Ų | 100.5 | 44% | 0.444 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -62.4 | -40.5 | 173.2 | -72.1 | -18 | 0 | 0 | 0 | 110.2 | N6 N13 S14 | N6-D10 VanDerWaalsContact O-CB 3.26Å; N6-D10 WeakPolarHBondContact O-CB 3.26Å; N6-D10 VanDerWaalsContact O-CG 3.23Å; N6-D10 PolarHBondContact O-N 3.02Å; D10-N13 PolarHBondContact O-N 3.48Å; D10-S14 WeakPolarHBondContact O-CB 3.31Å; D10-S14 PolarHBondContact O-N 3.47Å |
| 11 | G | 57.4 | Low | 49.7 | Very low | 23 Ų | 23 | 103.7 Ų | 103.7 | 24% | 0.237 | 56% | 0.563 | C | S | . | * | H | α-helix | trans | -63.6 | -44.5 | 174.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | I7 F9 S14 L15 | I7-G11 PolarHBondContact O-N 3.36Å; F9-G11 VanDerWaalsContact C-N 3.31Å; F9-G11 PolarHBondContact O-N 2.9Å; G11-S14 PolarHBondContact O-N 3.35Å; G11-L15 WeakPolarHBondContact O-CB 3.29Å; G11-L15 PolarHBondContact O-N 2.84Å |
| 12 | L | 57.3 | Low | 49.4 | Very low | 59 Ų | 59 | 101.7 Ų | 101.7 | 31% | 0.309 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -63.3 | -44.4 | 173.7 | -79.6 | 169.6 | 0 | 0 | 0 | 112.1 | L8 F9 S14 L15 L16 L72 | L8-L12 HydrophobicContact CD2-CD1 3.72Å; L8-L12 HydrophobicContact CD2-CG 4.32Å; L8-L12 WeakPolarHBondContact O-CG 3.48Å; L8-L12 PolarHBondContact O-N 3.08Å; F9-L12 PolarHBondContact O-N 3.42Å; L12-S14 VanDerWaalsContact C-N 3.33Å; L12-S14 PolarHBondContact O-N 2.89Å; L12-L15 PolarHBondContact O-N 3.36Å; L12-L16 WeakPolarHBondContact O-CB 3.31Å; L12-L16 VanDerWaalsContact O-CG 3.3Å; L12-L16 WeakPolarHBondContact O-CG 3.22Å; L12-L16 PolarHBondContact O-N 3.45Å; L12-L72 HydrophobicContact CD2-CD1 3.7Å |
| 13 | N | 58.3 | Low | 49.1 | Very low | 98 Ų | 98 | 100.3 Ų | 100.3 | 52% | 0.524 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -63.1 | -37.7 | 175.3 | -85.9 | -20.6 | 0 | 0 | 0 | 111.9 | F9 D10 T17 | F9-N13 WeakPolarHBondContact O-CB 3.35Å; F9-N13 PolarHBondContact O-N 3.32Å; D10-N13 PolarHBondContact O-N 3.48Å; N13-T17 WeakPolarHBondContact O-CA 3.34Å; N13-T17 WeakPolarHBondContact O-CB 3.36Å; N13-T17 PolarHBondContact O-N 3.31Å; N13-T17 PolarHBondContact O-OG1 3.27Å |
| 14 | S | 54.6 | Low | 48.7 | Very low | 86 Ų | 86 | 103.3 Ų | 103.3 | 60% | 0.601 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -68.4 | -37.7 | 174.9 | -173.3 | 0 | 0 | 0 | 0 | 112.6 | D10 G11 L12 | D10-S14 WeakPolarHBondContact O-CB 3.31Å; D10-S14 PolarHBondContact O-N 3.47Å; G11-S14 PolarHBondContact O-N 3.35Å; L12-S14 VanDerWaalsContact C-N 3.33Å; L12-S14 PolarHBondContact O-N 2.89Å |
| 15 | L | 50.7 | Low | 48 | Very low | 43 Ų | 43 | 103.3 Ų | 103.3 | 23% | 0.225 | 57% | 0.567 | C | S | . | * | H | α-helix | trans | -66.4 | -36.9 | 175.4 | -94.6 | 162.9 | 0 | 0 | 0 | 113.4 | G11 L12 L72 L151 R155 | G11-L15 WeakPolarHBondContact O-CB 3.29Å; G11-L15 PolarHBondContact O-N 2.84Å; L12-L15 PolarHBondContact O-N 3.36Å; L15-L72 HydrophobicContact CD1-CD1 4.01Å; L15-L72 HydrophobicContact CD1-CD2 3.83Å; L15-L151 HydrophobicContact CD2-CD2 3.6Å; L15-R155 PolarHBondContact O-NH2 3.49Å |
| 16 | L | 51.5 | Low | 47.2 | Very low | 134 Ų | 134 | 108.4 Ų | 108.4 | 70% | 0.702 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -82.7 | -53.2 | 179.1 | -69.1 | 166.9 | 0 | 0 | 0 | 111.5 | L12 C18 | L12-L16 WeakPolarHBondContact O-CB 3.31Å; L12-L16 VanDerWaalsContact O-CG 3.3Å; L12-L16 WeakPolarHBondContact O-CG 3.22Å; L12-L16 PolarHBondContact O-N 3.45Å; L16-C18 VanDerWaalsContact C-N 3.33Å; L16-C18 PolarHBondContact O-N 3.28Å; L16-C18 VanDerWaalsContact O-N 3.07Å |
| 17 | T | 48.3 | Very low | 46.6 | Very low | 99 Ų | 99 | 109.7 Ų | 109.7 | 61% | 0.607 | 60% | 0.595 | S | S | * | * | S | Bend | trans | -85.6 | 75.6 | 178.7 | -48.1 | 0 | 0 | 0 | 0 | 109.7 | N13 S19 | N13-T17 WeakPolarHBondContact O-CA 3.34Å; N13-T17 WeakPolarHBondContact O-CB 3.36Å; N13-T17 PolarHBondContact O-N 3.31Å; N13-T17 PolarHBondContact O-OG1 3.27Å; T17-S19 PolarHBondContact O-N 3.39Å |
| 18 | C | 42.7 | Very low | 46 | Very low | 80 Ų | 80 | 111.3 Ų | 111.3 | 54% | 0.541 | 61% | 0.611 | S | S | . | * | trans | -71.2 | 66.3 | -175.5 | -159.1 | 0 | 0 | 0 | 0 | 112.7 | L16 M20 R155 | L16-C18 VanDerWaalsContact C-N 3.33Å; L16-C18 PolarHBondContact O-N 3.28Å; L16-C18 VanDerWaalsContact O-N 3.07Å; C18-M20 PolarHBondContact O-N 3.41Å; C18-R155 PolarHBondContact SG-NH2 3.4Å | ||
| 19 | S | 37.5 | Very low | 45.4 | Very low | 105 Ų | 105 | 114.5 Ų | 114.5 | 73% | 0.734 | 64% | 0.638 | S | S | * | * | trans | -66.3 | 99.8 | 172.3 | -171.2 | 0 | 0 | 0 | 0 | 109.3 | T17 E21 | T17-S19 PolarHBondContact O-N 3.39Å; S19-E21 PolarHBondContact O-N 3.23Å | ||
| 20 | M | 38.3 | Very low | 44.5 | Very low | 161 Ų | 161 | 113 Ų | 113 | 79% | 0.793 | 64% | 0.643 | S | S | * | * | trans | -77.6 | 72.8 | 178.8 | -173.2 | 179.7 | 172.9 | 0 | 0 | 109.9 | C18 R22 | C18-M20 PolarHBondContact O-N 3.41Å; M20-R22 PolarHBondContact O-N 3.45Å | ||
| 21 | E | 38.1 | Very low | 43.8 | Very low | 168 Ų | 168 | 116.6 Ų | 116.6 | 79% | 0.785 | 66% | 0.661 | S | S | * | * | trans | -63 | 108.3 | 172.6 | -172.5 | 163 | -141.8 | 0 | 0 | 109.2 | S19 T23 | S19-E21 PolarHBondContact O-N 3.23Å; E21-T23 PolarHBondContact O-N 3.36Å | ||
| 22 | R | 34.6 | Very low | 43.1 | Very low | 205 Ų | 205 | 121.2 Ų | 121.2 | 77% | 0.774 | 69% | 0.69 | S | S | * | * | trans | -70.3 | 96.1 | 177.2 | -80.9 | -179 | 170.8 | 167 | -3.6 | 109.1 | M20 T24 | M20-R22 PolarHBondContact O-N 3.45Å; R22-T24 HydrophobicContact CB-CG2 4.46Å; R22-T24 PolarHBondContact O-N 2.85Å | ||
| 23 | T | 40.7 | Very low | 42.2 | Very low | 124 Ų | 124 | 123.4 Ų | 123.4 | 76% | 0.761 | 71% | 0.71 | S | S | * | * | trans | -64.2 | 83.6 | 158.6 | 46.6 | 0 | 0 | 0 | 0 | 109.1 | E21 T25 | E21-T23 PolarHBondContact O-N 3.36Å; T23-T25 PolarHBondContact O-N 3.13Å | ||
| 24 | T | 37.2 | Very low | 41.4 | Very low | 122 Ų | 122 | 125.7 Ų | 125.7 | 75% | 0.748 | 73% | 0.728 | S | S | * | * | trans | -66.4 | 96.5 | 175.1 | 34.9 | 0 | 0 | 0 | 0 | 109.4 | R22 K26 | R22-T24 HydrophobicContact CB-CG2 4.46Å; R22-T24 PolarHBondContact O-N 2.85Å; T24-K26 PolarHBondContact O-N 2.96Å | ||
| 25 | T | 38.3 | Very low | 40.7 | Very low | 133 Ų | 133 | 128.9 Ų | 128.9 | 82% | 0.816 | 74% | 0.737 | S | S | * | * | trans | -58.5 | 97.8 | 177.5 | 49.7 | 0 | 0 | 0 | 0 | 110.5 | T23 | T23-T25 PolarHBondContact O-N 3.13Š| ||
| 26 | K | 35.7 | Very low | 40.4 | Very low | 195 Ų | 195 | 133.5 Ų | 133.5 | 85% | 0.848 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -66.7 | 120 | 173.4 | -158.2 | 175.1 | -173.3 | -179.5 | 0 | 107.6 | T24 | T24-K26 PolarHBondContact O-N 2.96Š|
| 27 | P | 38.2 | Very low | 39.9 | Very low | 110 Ų | 110 | 132.8 Ų | 132.8 | 71% | 0.714 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -68.5 | 147.5 | -174.3 | 27.7 | -34.7 | 0 | 0 | 0 | 111 | S29 | P27-S29 PolarHBondContact O-N 3.2Š|
| 28 | P | 41.2 | Very low | 40 | Very low | 122 Ų | 122 | 133.8 Ų | 133.8 | 79% | 0.792 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -68.6 | 124.2 | 175.4 | 28.7 | -33.4 | 0 | 0 | 0 | 110.1 | S30 | P28-S30 PolarHBondContact O-N 3.11Š|
| 29 | S | 39.6 | Very low | 39.9 | Very low | 128 Ų | 128 | 135.3 Ų | 135.3 | 90% | 0.895 | 79% | 0.79 | S | S | * | * | trans | -74.4 | 103.4 | 176.2 | 52.8 | 0 | 0 | 0 | 0 | 110.6 | P27 | P27-S29 PolarHBondContact O-N 3.2Š| ||
| 30 | S | 39.3 | Very low | 40.1 | Very low | 94 Ų | 94 | 135.1 Ų | 135.1 | 66% | 0.657 | 79% | 0.789 | S | S | * | * | trans | -107.5 | 133.7 | -179.9 | 59 | 0 | 0 | 0 | 0 | 112.7 | P28 | P28-S30 PolarHBondContact O-N 3.11Š| ||
| 31 | I | 41.5 | Very low | 40.3 | Very low | 159 Ų | 159 | 132.5 Ų | 132.5 | 82% | 0.815 | 79% | 0.787 | S | S | * | * | trans | 68.5 | 104.7 | 157.4 | -51.8 | 152.7 | 0 | 0 | 0 | 116.2 | ||||
| 32 | S | 40.9 | Very low | 40.5 | Very low | 121 Ų | 121 | 129.2 Ų | 129.2 | 85% | 0.846 | 78% | 0.782 | S | S | * | * | -158.7 | 130.6 | 126.4 | -84.4 | 0 | 0 | 0 | 0 | 111.2 | |||||
| 33 | S | 39.3 | Very low | 40.7 | Very low | 104 Ų | 104 | 124.8 Ų | 124.8 | 73% | 0.727 | 78% | 0.783 | S | S | * | * | trans | -63.3 | 143.7 | -173.4 | 50.5 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 34 | T | 41.1 | Very low | 40.7 | Very low | 147 Ų | 147 | 124.7 Ų | 124.7 | 90% | 0.902 | 79% | 0.787 | S | S | * | * | trans | -152.2 | 150.8 | 131.5 | 3.4 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 35 | L | 40.7 | Very low | 40.7 | Very low | 152 Ų | 152 | 124.9 Ų | 124.9 | 80% | 0.796 | 79% | 0.793 | S | S | * | * | trans | -101.8 | 141.3 | -176.5 | -56.7 | 87.7 | 0 | 0 | 0 | 110.9 | ||||
| 36 | T | 43.7 | Very low | 40.9 | Very low | 140 Ų | 140 | 123.2 Ų | 123.2 | 86% | 0.859 | 79% | 0.793 | S | S | * | * | 165.6 | 126.6 | 125.5 | 34.1 | 0 | 0 | 0 | 0 | 112.5 | |||||
| 37 | P | 41.7 | Very low | 40.8 | Very low | 120 Ų | 120 | 119.4 Ų | 119.4 | 78% | 0.779 | 80% | 0.798 | S | S | * | * | trans | -114.5 | -172.2 | 163.6 | 41 | -31.4 | 0 | 0 | 0 | 110.9 | ||||
| 38 | P | 50.1 | Low | 41 | Very low | 120 Ų | 120 | 118.6 Ų | 118.6 | 78% | 0.779 | 80% | 0.801 | S | S | * | * | cis | -129.8 | 160.4 | -37.8 | 32.1 | -16.3 | 0 | 0 | 0 | 113.3 | ||||
| 39 | S | 41.3 | Very low | 40.8 | Very low | 111 Ų | 111 | 117.7 Ų | 117.7 | 78% | 0.776 | 80% | 0.804 | S | S | * | * | trans | -157.4 | 126.7 | 156.2 | 49.5 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 40 | S | 40.6 | Very low | 40.9 | Very low | 102 Ų | 102 | 116.2 Ų | 116.2 | 71% | 0.713 | 80% | 0.799 | S | S | * | * | trans | 47.1 | 118 | 144.5 | 59.5 | 0 | 0 | 0 | 0 | 123.1 | ||||
| 41 | S | 43.2 | Very low | 40.9 | Very low | 105 Ų | 105 | 116.9 Ų | 116.9 | 73% | 0.734 | 80% | 0.804 | S | S | * | * | 92.5 | 137.5 | 120.7 | 65.9 | 0 | 0 | 0 | 0 | 123.4 | |||||
| 42 | S | 41.8 | Very low | 40.6 | Very low | 99 Ų | 99 | 116.4 Ų | 116.4 | 69% | 0.692 | 80% | 0.802 | S | S | * | * | trans | 67.1 | 99.1 | 149.1 | 48.4 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 43 | S | 38 | Very low | 40.7 | Very low | 112 Ų | 112 | 116.5 Ų | 116.5 | 78% | 0.783 | 80% | 0.8 | S | S | * | * | 50.4 | 111.1 | 126.4 | 63.2 | 0 | 0 | 0 | 0 | 120.4 | |||||
| 44 | S | 40.9 | Very low | 40.7 | Very low | 122 Ų | 122 | 117.1 Ų | 117.1 | 85% | 0.853 | 80% | 0.799 | S | S | * | * | -158.8 | 153.1 | 112.3 | 41.8 | 0 | 0 | 0 | 0 | 111.8 | |||||
| 45 | S | 37.5 | Very low | 40.7 | Very low | 126 Ų | 126 | 115.8 Ų | 115.8 | 88% | 0.881 | 80% | 0.796 | S | S | * | * | trans | -72.6 | 123.3 | -177.4 | 49.2 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 46 | A | 42.8 | Very low | 40.8 | Very low | 99 Ų | 99 | 113.9 Ų | 113.9 | 82% | 0.818 | 79% | 0.791 | S | S | * | * | trans | -130.8 | 106.4 | 162.8 | 0 | 0 | 0 | 0 | 0 | 109.1 | A48 | A46-A48 PolarHBondContact O-N 3.42Š| ||
| 47 | A | 34.4 | Very low | 40.9 | Very low | 114 Ų | 114 | 109.1 Ų | 109.1 | 94% | 0.942 | 76% | 0.763 | S | S | * | * | trans | -80 | 107.3 | -179.7 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 48 | A | 40.9 | Very low | 41.4 | Very low | 94 Ų | 94 | 108.1 Ų | 108.1 | 78% | 0.777 | 76% | 0.755 | S | S | * | * | trans | -112.8 | 110.8 | 164.8 | 0 | 0 | 0 | 0 | 0 | 108.2 | A46 A50 | A46-A48 PolarHBondContact O-N 3.42Å; A48-A50 PolarHBondContact O-N 3.45Å | ||
| 49 | A | 37.9 | Very low | 41.5 | Very low | 103 Ų | 103 | 107.6 Ų | 107.6 | 85% | 0.851 | 75% | 0.746 | S | S | * | * | trans | -71 | 93.7 | -177.7 | 0 | 0 | 0 | 0 | 0 | 110.6 | S51 | A49-S51 VanDerWaalsContact C-N 3.28Å; A49-S51 PolarHBondContact O-N 3.17Å | ||
| 50 | A | 40.9 | Very low | 42.3 | Very low | 96 Ų | 96 | 107.2 Ų | 107.2 | 79% | 0.793 | 74% | 0.735 | S | S | * | * | trans | -66 | 91.3 | 166.2 | 0 | 0 | 0 | 0 | 0 | 108.6 | A48 L52 | A48-A50 PolarHBondContact O-N 3.45Å; A50-L52 PolarHBondContact O-N 3.11Å; A50-L52 VanDerWaalsContact O-N 3.12Å | ||
| 51 | S | 39.1 | Very low | 43.1 | Very low | 108 Ų | 108 | 106.7 Ų | 106.7 | 76% | 0.755 | 73% | 0.727 | S | S | * | * | trans | -55.6 | 115.9 | 176.4 | 55.3 | 0 | 0 | 0 | 0 | 109.6 | A49 | A49-S51 VanDerWaalsContact C-N 3.28Å; A49-S51 PolarHBondContact O-N 3.17Å | ||
| 52 | L | 35.8 | Very low | 44 | Very low | 150 Ų | 150 | 106.6 Ų | 106.6 | 79% | 0.785 | 72% | 0.718 | S | S | * | * | trans | -51.5 | 127.8 | 171.4 | -122.1 | 70.6 | 0 | 0 | 0 | 109.1 | A50 T54 | A50-L52 PolarHBondContact O-N 3.11Å; A50-L52 VanDerWaalsContact O-N 3.12Å; L52-T54 VanDerWaalsContact C-N 3.29Å; L52-T54 PolarHBondContact O-N 3.11Å | ||
| 53 | P | 42.8 | Very low | 45 | Very low | 122 Ų | 122 | 107.7 Ų | 107.7 | 79% | 0.792 | 72% | 0.715 | S | S | * | * | trans | -68.1 | 96 | 163.7 | 28.7 | -31 | 0 | 0 | 0 | 106.9 | S55 | P53-S55 PolarHBondContact O-N 2.92Å; P53-S55 VanDerWaalsContact O-N 3.09Å | ||
| 54 | T | 39.7 | Very low | 46.4 | Very low | 117 Ų | 117 | 105.4 Ų | 105.4 | 72% | 0.718 | 70% | 0.699 | S | S | * | * | trans | -53.6 | 118.2 | 171.4 | 17.5 | 0 | 0 | 0 | 0 | 108.6 | L52 T56 | L52-T54 VanDerWaalsContact C-N 3.29Å; L52-T54 PolarHBondContact O-N 3.11Å; T54-T56 PolarHBondContact O-N 3.25Å | ||
| 55 | S | 40.8 | Very low | 47.5 | Very low | 119 Ų | 119 | 103 Ų | 103 | 83% | 0.832 | 68% | 0.682 | S | S | * | * | trans | -73.6 | 64.9 | 178.3 | 46.2 | 0 | 0 | 0 | 0 | 111.3 | P53 S57 | P53-S55 PolarHBondContact O-N 2.92Å; P53-S55 VanDerWaalsContact O-N 3.09Å; S55-S57 PolarHBondContact O-N 2.84Å | ||
| 56 | T | 43.9 | Very low | 49.1 | Very low | 113 Ų | 113 | 103.1 Ų | 103.1 | 69% | 0.693 | 66% | 0.664 | S | S | * | * | trans | -53.8 | 126.4 | 154.3 | 49.8 | 0 | 0 | 0 | 0 | 107 | T54 T58 | T54-T56 PolarHBondContact O-N 3.25Å; T56-T58 PolarHBondContact O-N 3.32Å | ||
| 57 | S | 44.3 | Very low | 50.4 | Low | 40 Ų | 40 | 103.7 Ų | 103.7 | 28% | 0.28 | 65% | 0.652 | S | S | . | * | trans | -60.6 | 142.7 | -166.6 | 79.9 | 0 | 0 | 0 | 0 | 111 | S55 D59 D60 | S55-S57 PolarHBondContact O-N 2.84Å; S57-D59 PolarHBondContact O-N 3.27Å; S57-D59 PolarHBondContact OG-N 3.15Å; S57-D60 PolarHBondContact O-N 3.39Å; S57-D60 WeakPolarHBondContact OG-CB 3.49Å; S57-D60 PolarHBondContact OG-N 3.39Å; S57-D60 PolarHBondContact OG-OD2 2.91Å | ||
| 58 | T | 51.7 | Low | 52 | Low | 99 Ų | 99 | 100 Ų | 100 | 61% | 0.607 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -55.1 | -31.2 | 167.7 | 37.7 | 0 | 0 | 0 | 0 | 111 | T56 V61 I62 | T56-T58 PolarHBondContact O-N 3.32Å; T58-V61 PolarHBondContact O-N 3.49Å; T58-I62 VanDerWaalsContact O-CG1 3.3Å; T58-I62 WeakPolarHBondContact O-CG1 3.34Å; T58-I62 PolarHBondContact O-N 3.24Å |
| 59 | D | 53.2 | Low | 53.4 | Low | 108 Ų | 108 | 97 Ų | 97 | 58% | 0.578 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -73.8 | -38.6 | -170 | -47.1 | -13.1 | 0 | 0 | 0 | 110.4 | S57 V61 I62 L63 | S57-D59 PolarHBondContact O-N 3.27Å; S57-D59 PolarHBondContact OG-N 3.15Å; D59-V61 VanDerWaalsContact C-N 3.31Å; D59-V61 PolarHBondContact O-N 3.25Å; D59-I62 PolarHBondContact O-N 3.45Å; D59-L63 WeakPolarHBondContact O-CB 3.46Å; D59-L63 PolarHBondContact O-N 2.74Å |
| 60 | D | 57.1 | Low | 55 | Low | 103 Ų | 103 | 94.7 Ų | 94.7 | 55% | 0.551 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -59.4 | -40.2 | 171.1 | -70.6 | -56.8 | 0 | 0 | 0 | 111.9 | S57 S64 | S57-D60 PolarHBondContact O-N 3.39Å; S57-D60 WeakPolarHBondContact OG-CB 3.49Å; S57-D60 PolarHBondContact OG-N 3.39Å; S57-D60 PolarHBondContact OG-OD2 2.91Å; D60-S64 VanDerWaalsContact O-CB 3.31Å; D60-S64 WeakPolarHBondContact O-CB 3.33Å; D60-S64 PolarHBondContact O-N 3.02Å; D60-S64 PolarHBondContact O-OG 3.25Å |
| 61 | V | 59.4 | Low | 56.6 | Low | 92 Ų | 92 | 93.1 Ų | 93.1 | 56% | 0.558 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -71.5 | -44.6 | -179.5 | -177.3 | 0 | 0 | 0 | 0 | 110.6 | T58 D59 S64 S65 | T58-V61 PolarHBondContact O-N 3.49Å; D59-V61 VanDerWaalsContact C-N 3.31Å; D59-V61 PolarHBondContact O-N 3.25Å; V61-S64 PolarHBondContact O-OG 2.84Å; V61-S65 WeakPolarHBondContact O-CB 3.25Å; V61-S65 PolarHBondContact O-N 2.98Å; V61-S65 VanDerWaalsContact O-N 3.13Å |
| 62 | I | 60.8 | Low | 58.1 | Low | 103 Ų | 103 | 89.4 Ų | 89.4 | 53% | 0.528 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -63.4 | -46.4 | 176.1 | -67.4 | 164 | 0 | 0 | 0 | 110.6 | T58 D59 S65 W66 | T58-I62 VanDerWaalsContact O-CG1 3.3Å; T58-I62 WeakPolarHBondContact O-CG1 3.34Å; T58-I62 PolarHBondContact O-N 3.24Å; D59-I62 PolarHBondContact O-N 3.45Å; I62-S65 PolarHBondContact O-N 3.01Å; I62-W66 PolarHBondContact O-N 2.97Å |
| 63 | L | 63.7 | Low | 59.9 | Low | 122 Ų | 122 | 83.1 Ų | 83.1 | 64% | 0.639 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -64.7 | -41 | -178.5 | -170.3 | 71.9 | 0 | 0 | 0 | 112.2 | D59 W66 L67 | D59-L63 WeakPolarHBondContact O-CB 3.46Å; D59-L63 PolarHBondContact O-N 2.74Å; L63-W66 PolarHBondContact O-N 3.03Å; L63-L67 WeakPolarHBondContact O-CB 3.43Å; L63-L67 PolarHBondContact O-N 3.21Å |
| 64 | S | 66.3 | Low | 61.5 | Low | 63 Ų | 63 | 80.9 Ų | 80.9 | 44% | 0.441 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -68.5 | -36.9 | 177 | 57.6 | 0 | 0 | 0 | 0 | 112.9 | D60 V61 S68 | D60-S64 VanDerWaalsContact O-CB 3.31Å; D60-S64 WeakPolarHBondContact O-CB 3.33Å; D60-S64 PolarHBondContact O-N 3.02Å; D60-S64 PolarHBondContact O-OG 3.25Å; V61-S64 PolarHBondContact O-OG 2.84Å; S64-S68 WeakPolarHBondContact O-CB 3.43Å; S64-S68 PolarHBondContact O-N 3.35Å |
| 65 | S | 65.5 | Low | 63.3 | Low | 73 Ų | 73 | 79.7 Ų | 79.7 | 51% | 0.51 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -62.4 | -49 | 171.7 | -172 | 0 | 0 | 0 | 0 | 111.4 | V61 I62 L67 S68 S69 | V61-S65 WeakPolarHBondContact O-CB 3.25Å; V61-S65 PolarHBondContact O-N 2.98Å; V61-S65 VanDerWaalsContact O-N 3.13Å; I62-S65 PolarHBondContact O-N 3.01Å; S65-L67 PolarHBondContact O-N 3.08Å; S65-S68 PolarHBondContact O-N 3.05Å; S65-S69 PolarHBondContact O-N 3.45Å; S65-S69 PolarHBondContact O-OG 3.39Å |
| 66 | W | 69.7 | Low | 64.8 | Low | 128 Ų | 128 | 75.4 Ų | 75.4 | 49% | 0.485 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -58.8 | -48.6 | 175.2 | -107.6 | 57.7 | 0 | 0 | 0 | 112.4 | I62 L63 S68 S69 F70 | I62-W66 PolarHBondContact O-N 2.97Å; L63-W66 PolarHBondContact O-N 3.03Å; W66-S68 VanDerWaalsContact C-N 3.29Å; W66-S68 PolarHBondContact O-N 3.02Å; W66-S69 PolarHBondContact O-N 2.87Å; W66-F70 HydrophobicContact CD2-CD2 4.32Å; W66-F70 AromaticContact CD2-CE2 3.8Å; W66-F70 HydrophobicContact CD2-CE2 3.8Å; W66-F70 AromaticContact CE3-CD2 3.92Å; W66-F70 HydrophobicContact CE3-CD2 3.92Å; W66-F70 AromaticContact CE3-CE2 3.29Å; W66-F70 HydrophobicContact CE3-CE2 3.29Å; W66-F70 AromaticContact CE3-CZ 3.87Å; W66-F70 HydrophobicContact CE3-CZ 3.87Å; W66-F70 AromaticContact CH2-CE2 3.87Å; W66-F70 HydrophobicContact CH2-CE2 3.87Å; W66-F70 AromaticContact CH2-CZ 3.96Å; W66-F70 HydrophobicContact CH2-CZ 3.96Å; W66-F70 HydrophobicContact CZ2-CE2 4.31Å; W66-F70 HydrophobicContact CZ3-CD2 4.36Å; W66-F70 AromaticContact CZ3-CE2 3.34Å; W66-F70 HydrophobicContact CZ3-CE2 3.34Å; W66-F70 AromaticContact CZ3-CZ 3.44Å; W66-F70 HydrophobicContact CZ3-CZ 3.44Å; W66-F70 VanDerWaalsContact CZ3-CZ 3.44Å; W66-F70 WeakPolarHBondContact O-CD2 3.41Å; W66-F70 PolarHBondContact O-N 3.36Å |
| 67 | L | 71 | Confident | 66.2 | Low | 110 Ų | 110 | 72.5 Ų | 72.5 | 58% | 0.576 | 40% | 0.398 | S | S | * | . | H | α-helix | trans | -59.6 | -40.6 | -179.7 | -175.3 | 64.9 | 0 | 0 | 0 | 111.8 | L63 S65 F70 L71 | L63-L67 WeakPolarHBondContact O-CB 3.43Å; L63-L67 PolarHBondContact O-N 3.21Å; S65-L67 PolarHBondContact O-N 3.08Å; L67-F70 PolarHBondContact O-N 2.82Å; L67-L71 HydrophobicContact CD1-CD1 4.46Å; L67-L71 HydrophobicContact CG-CD1 4.14Å; L67-L71 WeakPolarHBondContact O-CB 3.46Å; L67-L71 VanDerWaalsContact O-CG 3.27Å; L67-L71 WeakPolarHBondContact O-CG 3.49Å; L67-L71 PolarHBondContact O-N 3.19Å |
| 68 | S | 68 | Low | 67.9 | Low | 37 Ų | 37 | 75 Ų | 75 | 26% | 0.259 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -62.4 | -48.6 | 174.8 | -169.4 | 0 | 0 | 0 | 0 | 111.6 | S64 S65 W66 F70 L71 L72 | S64-S68 WeakPolarHBondContact O-CB 3.43Å; S64-S68 PolarHBondContact O-N 3.35Å; S65-S68 PolarHBondContact O-N 3.05Å; W66-S68 VanDerWaalsContact C-N 3.29Å; W66-S68 PolarHBondContact O-N 3.02Å; S68-F70 PolarHBondContact O-N 3.4Å; S68-L71 PolarHBondContact O-N 3.14Å; S68-L72 WeakPolarHBondContact O-CB 3.47Å; S68-L72 PolarHBondContact O-N 2.88Å |
| 69 | S | 69.4 | Low | 69 | Low | 30 Ų | 30 | 75.1 Ų | 75.1 | 21% | 0.21 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -61.9 | -39.6 | 177.2 | -60.6 | 0 | 0 | 0 | 0 | 113.2 | S65 W66 L72 I73 | S65-S69 PolarHBondContact O-N 3.45Å; S65-S69 PolarHBondContact O-OG 3.39Å; W66-S69 PolarHBondContact O-N 2.87Å; S69-L72 WeakPolarHBondContact O-CB 3.43Å; S69-L72 PolarHBondContact O-N 3.24Å; S69-I73 WeakPolarHBondContact O-CG1 3.4Å; S69-I73 PolarHBondContact O-N 2.9Å |
| 70 | F | 72.6 | Confident | 70.1 | Confident | 56 Ų | 56 | 70.2 Ų | 70.2 | 25% | 0.246 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -68.4 | -42.7 | 176.6 | -89.4 | -107.6 | 0 | 0 | 0 | 111.9 | W66 L67 S68 L72 I73 I74 F137 | W66-F70 HydrophobicContact CD2-CD2 4.32Å; W66-F70 AromaticContact CD2-CE2 3.8Å; W66-F70 HydrophobicContact CD2-CE2 3.8Å; W66-F70 AromaticContact CE3-CD2 3.92Å; W66-F70 HydrophobicContact CE3-CD2 3.92Å; W66-F70 AromaticContact CE3-CE2 3.29Å; W66-F70 HydrophobicContact CE3-CE2 3.29Å; W66-F70 AromaticContact CE3-CZ 3.87Å; W66-F70 HydrophobicContact CE3-CZ 3.87Å; W66-F70 AromaticContact CH2-CE2 3.87Å; W66-F70 HydrophobicContact CH2-CE2 3.87Å; W66-F70 AromaticContact CH2-CZ 3.96Å; W66-F70 HydrophobicContact CH2-CZ 3.96Å; W66-F70 HydrophobicContact CZ2-CE2 4.31Å; W66-F70 HydrophobicContact CZ3-CD2 4.36Å; W66-F70 AromaticContact CZ3-CE2 3.34Å; W66-F70 HydrophobicContact CZ3-CE2 3.34Å; W66-F70 AromaticContact CZ3-CZ 3.44Å; W66-F70 HydrophobicContact CZ3-CZ 3.44Å; W66-F70 VanDerWaalsContact CZ3-CZ 3.44Å; W66-F70 WeakPolarHBondContact O-CD2 3.41Å; W66-F70 PolarHBondContact O-N 3.36Å; L67-F70 PolarHBondContact O-N 2.82Å; S68-F70 PolarHBondContact O-N 3.4Å; F70-L72 VanDerWaalsContact C-N 3.31Å; F70-L72 PolarHBondContact O-N 3.33Å; F70-I73 PolarHBondContact O-N 3.02Å; F70-I74 HydrophobicContact CB-CD1 4.29Å; F70-I74 HydrophobicContact CD1-CD1 4.39Å; F70-I74 WeakPolarHBondContact O-CB 3.22Å; F70-I74 WeakPolarHBondContact O-CD1 3.46Å; F70-I74 VanDerWaalsContact O-CG1 3.23Å; F70-I74 WeakPolarHBondContact O-CG1 3.08Å; F70-I74 PolarHBondContact O-N 3.09Å; F70-F137 HydrophobicContact CE1-CE1 4.07Å; F70-F137 HydrophobicContact CE1-CZ 4.01Å; F70-F137 AromaticContact CZ-CE1 3.9Å; F70-F137 HydrophobicContact CZ-CE1 3.9Å; F70-F137 HydrophobicContact CZ-CZ 4.25Å |
| 71 | L | 74.3 | Confident | 71.1 | Confident | 63 Ų | 63 | 69 Ų | 69 | 33% | 0.33 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -61.4 | -39.3 | 173.9 | -73.3 | 168.9 | 0 | 0 | 0 | 112 | L8 L67 S68 I73 I74 I75 | L8-L71 HydrophobicContact CD1-CD1 4.21Å; L67-L71 HydrophobicContact CD1-CD1 4.46Å; L67-L71 HydrophobicContact CG-CD1 4.14Å; L67-L71 WeakPolarHBondContact O-CB 3.46Å; L67-L71 VanDerWaalsContact O-CG 3.27Å; L67-L71 WeakPolarHBondContact O-CG 3.49Å; L67-L71 PolarHBondContact O-N 3.19Å; S68-L71 PolarHBondContact O-N 3.14Å; L71-I73 PolarHBondContact O-N 3.38Å; L71-I74 PolarHBondContact O-N 2.9Å; L71-I75 HydrophobicContact CB-CD1 4.28Å; L71-I75 WeakPolarHBondContact O-CB 3.47Å; L71-I75 VanDerWaalsContact O-CG1 3.29Å; L71-I75 WeakPolarHBondContact O-CG1 3.39Å; L71-I75 PolarHBondContact O-N 3.48Å |
| 72 | L | 70.2 | Confident | 72.1 | Confident | 30 Ų | 30 | 69.8 Ų | 69.8 | 16% | 0.157 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -60 | -27.5 | 176.3 | -164.2 | 83.3 | 0 | 0 | 0 | 113.1 | L12 L15 S68 S69 F70 P76 I158 | L12-L72 HydrophobicContact CD2-CD1 3.7Å; L15-L72 HydrophobicContact CD1-CD1 4.01Å; L15-L72 HydrophobicContact CD1-CD2 3.83Å; S68-L72 WeakPolarHBondContact O-CB 3.47Å; S68-L72 PolarHBondContact O-N 2.88Å; S69-L72 WeakPolarHBondContact O-CB 3.43Å; S69-L72 PolarHBondContact O-N 3.24Å; F70-L72 VanDerWaalsContact C-N 3.31Å; F70-L72 PolarHBondContact O-N 3.33Å; L72-P76 WeakPolarHBondContact O-CD 3.18Å; L72-P76 VanDerWaalsContact O-CG 3.27Å; L72-P76 WeakPolarHBondContact O-CG 3.34Å; L72-I158 HydrophobicContact CD1-CD1 4.38Å; L72-I158 HydrophobicContact CD2-CD1 3.97Å; L72-I158 HydrophobicContact CG-CD1 4.12Å |
| 73 | I | 73.6 | Confident | 72.8 | Confident | 18 Ų | 18 | 67.3 Ų | 67.3 | 9% | 0.092 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -93.5 | -42.1 | 177.8 | -63.8 | 166 | 0 | 0 | 0 | 111.2 | S69 F70 L71 L77 H136 | S69-I73 WeakPolarHBondContact O-CG1 3.4Å; S69-I73 PolarHBondContact O-N 2.9Å; F70-I73 PolarHBondContact O-N 3.02Å; L71-I73 PolarHBondContact O-N 3.38Å; I73-L77 WeakPolarHBondContact O-CB 3.46Å; I73-L77 PolarHBondContact O-N 3.4Å; I73-H136 WeakPolarHBondContact CD1-NE2 3.5Å |
| 74 | I | 77.1 | Confident | 73.4 | Confident | 75 Ų | 75 | 62.1 Ų | 62.1 | 39% | 0.385 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -69.1 | -38.4 | -176.4 | -69.9 | 166.4 | 0 | 0 | 0 | 111.8 | F70 L71 L77 L78 | F70-I74 HydrophobicContact CB-CD1 4.29Å; F70-I74 HydrophobicContact CD1-CD1 4.39Å; F70-I74 WeakPolarHBondContact O-CB 3.22Å; F70-I74 WeakPolarHBondContact O-CD1 3.46Å; F70-I74 VanDerWaalsContact O-CG1 3.23Å; F70-I74 WeakPolarHBondContact O-CG1 3.08Å; F70-I74 PolarHBondContact O-N 3.09Å; L71-I74 PolarHBondContact O-N 2.9Å; I74-L77 PolarHBondContact O-N 2.99Å; I74-L78 HydrophobicContact CG2-CD1 3.71Å; I74-L78 HydrophobicContact CG2-CG 4.15Å; I74-L78 WeakPolarHBondContact O-CB 3.4Å; I74-L78 WeakPolarHBondContact O-CG 3.46Å; I74-L78 PolarHBondContact O-N 3.49Å |
| 75 | I | 76.8 | Confident | 74 | Confident | 92 Ų | 92 | 63.2 Ų | 63.2 | 47% | 0.472 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -65.4 | -49.4 | -177.6 | -68.5 | 167.3 | 0 | 0 | 0 | 111.7 | L71 L77 L78 L79 | L71-I75 HydrophobicContact CB-CD1 4.28Å; L71-I75 WeakPolarHBondContact O-CB 3.47Å; L71-I75 VanDerWaalsContact O-CG1 3.29Å; L71-I75 WeakPolarHBondContact O-CG1 3.39Å; L71-I75 PolarHBondContact O-N 3.48Å; I75-L77 VanDerWaalsContact C-N 3.34Å; I75-L77 PolarHBondContact O-N 3.44Å; I75-L78 PolarHBondContact O-N 3.39Å; I75-L79 WeakPolarHBondContact O-CB 3.04Å; I75-L79 PolarHBondContact O-N 3.28Å |
| 76 | P | 72.5 | Confident | 74.7 | Confident | 29 Ų | 29 | 64.5 Ų | 64.5 | 19% | 0.188 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -61.5 | -37.8 | 171.9 | -25.7 | 36.4 | 0 | 0 | 0 | 113.5 | L72 L79 Q80 Y161 | L72-P76 WeakPolarHBondContact O-CD 3.18Å; L72-P76 VanDerWaalsContact O-CG 3.27Å; L72-P76 WeakPolarHBondContact O-CG 3.34Å; P76-L79 PolarHBondContact O-N 3.44Å; P76-Q80 WeakPolarHBondContact O-CB 3.17Å; P76-Q80 PolarHBondContact O-N 2.65Å; P76-Y161 VanDerWaalsContact C-CE1 3.46Å; P76-Y161 HydrophobicContact CB-CD1 3.71Å; P76-Y161 HydrophobicContact CB-CD2 3.44Å; P76-Y161 VanDerWaalsContact CB-CD2 3.44Å; P76-Y161 HydrophobicContact CB-CE1 3.9Å; P76-Y161 HydrophobicContact CB-CE2 3.65Å; P76-Y161 HydrophobicContact CB-CG 3.51Å; P76-Y161 HydrophobicContact CG-CD2 4.32Å; P76-Y161 WeakPolarHBondContact O-CE1 3.29Å |
| 77 | L | 73.5 | Confident | 75 | Confident | 51 Ų | 51 | 59.7 Ų | 59.7 | 27% | 0.267 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -60.5 | -47.8 | 176.5 | -177.7 | 133.1 | 0 | 0 | 0 | 112.3 | I73 I74 I75 L79 Q80 I81 I133 Y161 | I73-L77 WeakPolarHBondContact O-CB 3.46Å; I73-L77 PolarHBondContact O-N 3.4Å; I74-L77 PolarHBondContact O-N 2.99Å; I75-L77 VanDerWaalsContact C-N 3.34Å; I75-L77 PolarHBondContact O-N 3.44Å; L77-L79 VanDerWaalsContact C-N 3.34Å; L77-Q80 PolarHBondContact O-N 3.48Å; L77-I81 HydrophobicContact CD2-CD1 3.6Å; L77-I81 HydrophobicContact CG-CD1 4.09Å; L77-I81 WeakPolarHBondContact O-CG1 3.48Å; L77-I81 PolarHBondContact O-N 2.9Å; L77-I133 HydrophobicContact CD1-CD1 3.6Å; L77-Y161 WeakPolarHBondContact CA-OH 3.39Å; L77-Y161 WeakPolarHBondContact CB-OH 3.48Å |
| 78 | L | 79.2 | Confident | 75.3 | Confident | 92 Ų | 92 | 58.1 Ų | 58.1 | 48% | 0.482 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -62.8 | -41.6 | 176.3 | -71.9 | 171.4 | 0 | 0 | 0 | 111.5 | I74 I75 I81 I82 | I74-L78 HydrophobicContact CG2-CD1 3.71Å; I74-L78 HydrophobicContact CG2-CG 4.15Å; I74-L78 WeakPolarHBondContact O-CB 3.4Å; I74-L78 WeakPolarHBondContact O-CG 3.46Å; I74-L78 PolarHBondContact O-N 3.49Å; I75-L78 PolarHBondContact O-N 3.39Å; L78-I81 PolarHBondContact O-N 2.85Å; L78-I82 WeakPolarHBondContact O-CD1 3.38Å; L78-I82 VanDerWaalsContact O-CG1 3.26Å; L78-I82 WeakPolarHBondContact O-CG1 3.45Å; L78-I82 PolarHBondContact O-N 3.09Å |
| 79 | L | 76.3 | Confident | 75.9 | Confident | 103 Ų | 103 | 60.4 Ų | 60.4 | 54% | 0.539 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -62.4 | -43.7 | 176.5 | -174 | 64.4 | 0 | 0 | 0 | 111.7 | I75 P76 L77 I82 I83 | I75-L79 WeakPolarHBondContact O-CB 3.04Å; I75-L79 PolarHBondContact O-N 3.28Å; P76-L79 PolarHBondContact O-N 3.44Å; L77-L79 VanDerWaalsContact C-N 3.34Å; L79-I82 PolarHBondContact O-N 3.48Å; L79-I83 HydrophobicContact CG-CD1 4.09Å; L79-I83 WeakPolarHBondContact O-CG1 3.45Å; L79-I83 PolarHBondContact O-N 2.85Å |
| 80 | Q | 75.3 | Confident | 76.2 | Confident | 4 Ų | 4 | 63.5 Ų | 63.5 | 2% | 0.019 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -63.8 | -43.2 | 177.3 | -163.7 | 67.2 | 12.1 | 0 | 0 | 111.7 | P76 L77 I82 I83 I84 E125 L129 Y161 | P76-Q80 WeakPolarHBondContact O-CB 3.17Å; P76-Q80 PolarHBondContact O-N 2.65Å; L77-Q80 PolarHBondContact O-N 3.48Å; Q80-I82 VanDerWaalsContact C-N 3.32Å; Q80-I82 PolarHBondContact O-N 3.49Å; Q80-I83 PolarHBondContact O-N 3.39Å; Q80-I84 HydrophobicContact CG-CD1 3.95Å; Q80-I84 HydrophobicContact CG-CG1 4.48Å; Q80-I84 WeakPolarHBondContact O-CB 3.43Å; Q80-I84 VanDerWaalsContact O-CG1 3.31Å; Q80-I84 WeakPolarHBondContact O-CG1 3.38Å; Q80-I84 PolarHBondContact O-N 3.37Å; Q80-E125 PolarHBondContact NE2-OE1 3.36Å; Q80-L129 HydrophobicContact CB-CD2 4.18Å; Q80-L129 HydrophobicContact CG-CD1 4.36Å; Q80-L129 HydrophobicContact CG-CD2 3.89Å; Q80-Y161 HydrophobicContact CB-CD1 4.1Å; Q80-Y161 HydrophobicContact CB-CE1 3.89Å; Q80-Y161 HydrophobicContact CG-CE1 4.45Å |
| 81 | I | 77.3 | Confident | 76.4 | Confident | 78 Ų | 78 | 63 Ų | 63 | 40% | 0.4 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -60.4 | -42.5 | 175.8 | -71.1 | 168.6 | 0 | 0 | 0 | 110.7 | L77 L78 I84 I85 | L77-I81 HydrophobicContact CD2-CD1 3.6Å; L77-I81 HydrophobicContact CG-CD1 4.09Å; L77-I81 WeakPolarHBondContact O-CG1 3.48Å; L77-I81 PolarHBondContact O-N 2.9Å; L78-I81 PolarHBondContact O-N 2.85Å; I81-I84 PolarHBondContact O-N 3.1Å; I81-I85 HydrophobicContact CG2-CD1 3.69Å; I81-I85 HydrophobicContact CG2-CG1 4.42Å; I81-I85 WeakPolarHBondContact O-CB 3.27Å; I81-I85 VanDerWaalsContact O-CG1 3.24Å; I81-I85 WeakPolarHBondContact O-CG1 3.15Å; I81-I85 PolarHBondContact O-N 2.26Å |
| 82 | I | 81 | Confident | 76.6 | Confident | 109 Ų | 109 | 66.6 Ų | 66.6 | 56% | 0.559 | 34% | 0.343 | S | S | * | . | H | α-helix | trans | -62.9 | -42.6 | 175.8 | -69.1 | 163.4 | 0 | 0 | 0 | 111.3 | L78 L79 Q80 I85 L86 | L78-I82 WeakPolarHBondContact O-CD1 3.38Å; L78-I82 VanDerWaalsContact O-CG1 3.26Å; L78-I82 WeakPolarHBondContact O-CG1 3.45Å; L78-I82 PolarHBondContact O-N 3.09Å; L79-I82 PolarHBondContact O-N 3.48Å; Q80-I82 VanDerWaalsContact C-N 3.32Å; Q80-I82 PolarHBondContact O-N 3.49Å; I82-I85 PolarHBondContact O-N 3.12Å; I82-L86 WeakPolarHBondContact O-CB 3.46Å; I82-L86 PolarHBondContact O-N 2.81Å |
| 83 | I | 76.5 | Confident | 76.9 | Confident | 50 Ų | 50 | 69.4 Ų | 69.4 | 26% | 0.256 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -63.6 | -45.8 | 176.5 | -69.3 | 165.1 | 0 | 0 | 0 | 111 | L79 Q80 L86 C87 P165 | L79-I83 HydrophobicContact CG-CD1 4.09Å; L79-I83 WeakPolarHBondContact O-CG1 3.45Å; L79-I83 PolarHBondContact O-N 2.85Å; Q80-I83 PolarHBondContact O-N 3.39Å; I83-L86 PolarHBondContact O-N 2.92Å; I83-C87 WeakPolarHBondContact O-CB 3.16Å; I83-C87 PolarHBondContact O-N 3.49Å; I83-C87 PolarHBondContact O-SG 3.06Å; I83-P165 HydrophobicContact CD1-CG 4.31Å |
| 84 | I | 76.1 | Confident | 76.8 | Confident | 14 Ų | 14 | 72.4 Ų | 72.4 | 7% | 0.072 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -61.7 | -46.1 | 177.9 | -71.9 | 169.8 | 0 | 0 | 0 | 110.6 | Q80 I81 L86 C87 I88 L122 I126 | Q80-I84 HydrophobicContact CG-CD1 3.95Å; Q80-I84 HydrophobicContact CG-CG1 4.48Å; Q80-I84 WeakPolarHBondContact O-CB 3.43Å; Q80-I84 VanDerWaalsContact O-CG1 3.31Å; Q80-I84 WeakPolarHBondContact O-CG1 3.38Å; Q80-I84 PolarHBondContact O-N 3.37Å; I81-I84 PolarHBondContact O-N 3.1Å; I84-L86 PolarHBondContact O-N 3.16Å; I84-C87 PolarHBondContact O-N 3.23Å; I84-I88 HydrophobicContact CG2-CD1 3.88Å; I84-I88 VanDerWaalsContact O-CG1 3.32Å; I84-I88 WeakPolarHBondContact O-CG1 3.29Å; I84-I88 PolarHBondContact O-N 3.5Å; I84-L122 HydrophobicContact CG2-CD1 4.13Å; I84-L122 HydrophobicContact CG2-CD2 4.49Å; I84-L122 HydrophobicContact CG2-CG 4.37Å; I84-I126 HydrophobicContact CD1-CG1 4.01Å |
| 85 | I | 79.1 | Confident | 76.5 | Confident | 86 Ų | 86 | 71.5 Ų | 71.5 | 44% | 0.441 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -61.2 | -43.8 | 175.8 | -71.1 | 168.4 | 0 | 0 | 0 | 110.8 | I81 I82 C87 I88 I89 | I81-I85 HydrophobicContact CG2-CD1 3.69Å; I81-I85 HydrophobicContact CG2-CG1 4.42Å; I81-I85 WeakPolarHBondContact O-CB 3.27Å; I81-I85 VanDerWaalsContact O-CG1 3.24Å; I81-I85 WeakPolarHBondContact O-CG1 3.15Å; I81-I85 PolarHBondContact O-N 2.26Å; I82-I85 PolarHBondContact O-N 3.12Å; I85-C87 PolarHBondContact O-N 2.94Å; I85-I88 PolarHBondContact O-N 3.24Å; I85-I89 HydrophobicContact CG2-CD1 3.74Å; I85-I89 HydrophobicContact CG2-CG1 4.42Å; I85-I89 VanDerWaalsContact O-CG1 3.31Å; I85-I89 WeakPolarHBondContact O-CG1 3.42Å; I85-I89 PolarHBondContact O-N 2.83Å |
| 86 | L | 79 | Confident | 76.5 | Confident | 99 Ų | 99 | 73 Ų | 73 | 52% | 0.518 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -61.8 | -42.6 | 176.7 | -172.6 | 69.7 | 0 | 0 | 0 | 111.5 | I82 I83 I84 I89 L90 | I82-L86 WeakPolarHBondContact O-CB 3.46Å; I82-L86 PolarHBondContact O-N 2.81Å; I83-L86 PolarHBondContact O-N 2.92Å; I84-L86 PolarHBondContact O-N 3.16Å; L86-I89 PolarHBondContact O-N 3.41Å; L86-L90 HydrophobicContact CG-CD1 4.18Å; L86-L90 WeakPolarHBondContact O-CB 3.31Å; L86-L90 VanDerWaalsContact O-CG 3.26Å; L86-L90 WeakPolarHBondContact O-CG 3.07Å; L86-L90 PolarHBondContact O-N 2.94Å |
| 87 | C | 75.9 | Confident | 76.3 | Confident | 28 Ų | 28 | 76.1 Ų | 76.1 | 19% | 0.189 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -62.2 | -41.9 | 174.3 | -77.8 | 0 | 0 | 0 | 0 | 112.3 | I83 I84 I85 L90 L91 | I83-C87 WeakPolarHBondContact O-CB 3.16Å; I83-C87 PolarHBondContact O-N 3.49Å; I83-C87 PolarHBondContact O-SG 3.06Å; I84-C87 PolarHBondContact O-N 3.23Å; I85-C87 PolarHBondContact O-N 2.94Å; C87-L90 PolarHBondContact O-N 2.88Å; C87-L91 WeakPolarHBondContact O-CB 3.26Å; C87-L91 VanDerWaalsContact O-CG 3.27Å; C87-L91 WeakPolarHBondContact O-CG 3.44Å; C87-L91 PolarHBondContact O-N 2.95Å |
| 88 | I | 77.6 | Confident | 76 | Confident | 76 Ų | 76 | 75 Ų | 75 | 39% | 0.39 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -63.9 | -43.9 | 175.4 | -68.9 | 165.5 | 0 | 0 | 0 | 110.9 | I84 I85 L91 F92 L122 | I84-I88 HydrophobicContact CG2-CD1 3.88Å; I84-I88 VanDerWaalsContact O-CG1 3.32Å; I84-I88 WeakPolarHBondContact O-CG1 3.29Å; I84-I88 PolarHBondContact O-N 3.5Å; I85-I88 PolarHBondContact O-N 3.24Å; I88-L91 PolarHBondContact O-N 3.49Å; I88-F92 WeakPolarHBondContact O-CB 3.35Å; I88-F92 PolarHBondContact O-N 3.49Å; I88-L122 HydrophobicContact CD1-CD1 4.21Å; I88-L122 HydrophobicContact CG1-CD1 4Å |
| 89 | I | 80.3 | Confident | 75.5 | Confident | 86 Ų | 86 | 75.2 Ų | 75.2 | 44% | 0.441 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -62.6 | -44.2 | 176.3 | -70.2 | 167.7 | 0 | 0 | 0 | 110.8 | I85 L86 F92 I93 | I85-I89 HydrophobicContact CG2-CD1 3.74Å; I85-I89 HydrophobicContact CG2-CG1 4.42Å; I85-I89 VanDerWaalsContact O-CG1 3.31Å; I85-I89 WeakPolarHBondContact O-CG1 3.42Å; I85-I89 PolarHBondContact O-N 2.83Å; L86-I89 PolarHBondContact O-N 3.41Å; I89-F92 PolarHBondContact O-N 3.36Å; I89-I93 HydrophobicContact CG2-CD1 3.74Å; I89-I93 HydrophobicContact CG2-CG1 4.41Å; I89-I93 WeakPolarHBondContact O-CB 3.47Å; I89-I93 VanDerWaalsContact O-CG1 3.27Å; I89-I93 WeakPolarHBondContact O-CG1 3.45Å; I89-I93 PolarHBondContact O-N 2.85Å |
| 90 | L | 76.5 | Confident | 74.9 | Confident | 95 Ų | 95 | 76.3 Ų | 76.3 | 50% | 0.497 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -64.3 | -41 | 176.6 | -72.9 | 169.9 | 0 | 0 | 0 | 112.1 | L86 C87 I93 M94 | L86-L90 HydrophobicContact CG-CD1 4.18Å; L86-L90 WeakPolarHBondContact O-CB 3.31Å; L86-L90 VanDerWaalsContact O-CG 3.26Å; L86-L90 WeakPolarHBondContact O-CG 3.07Å; L86-L90 PolarHBondContact O-N 2.94Å; C87-L90 PolarHBondContact O-N 2.88Å; L90-I93 PolarHBondContact O-N 3.49Å; L90-M94 WeakPolarHBondContact O-CB 3.46Å; L90-M94 VanDerWaalsContact O-CG 3.23Å; L90-M94 WeakPolarHBondContact O-CG 3.44Å; L90-M94 PolarHBondContact O-N 3.5Å |
| 91 | L | 76 | Confident | 74.3 | Confident | 46 Ų | 46 | 80.4 Ų | 80.4 | 24% | 0.241 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -61.6 | -44.5 | 172.9 | -76 | 166.4 | 0 | 0 | 0 | 111.4 | C87 I88 M94 I95 I118 L172 | C87-L91 WeakPolarHBondContact O-CB 3.26Å; C87-L91 VanDerWaalsContact O-CG 3.27Å; C87-L91 WeakPolarHBondContact O-CG 3.44Å; C87-L91 PolarHBondContact O-N 2.95Å; I88-L91 PolarHBondContact O-N 3.49Å; L91-M94 PolarHBondContact O-N 3.33Å; L91-I95 VanDerWaalsContact O-CG1 3.29Å; L91-I95 WeakPolarHBondContact O-CG1 3.42Å; L91-I95 PolarHBondContact O-N 2.88Å; L91-I118 HydrophobicContact CD1-CG2 3.82Å; L91-I118 HydrophobicContact CD2-CD1 4.47Å; L91-L172 HydrophobicContact CD2-CD1 4.23Å |
| 92 | F | 78 | Confident | 73.1 | Confident | 137 Ų | 137 | 85.4 Ų | 85.4 | 60% | 0.601 | 41% | 0.414 | S | S | * | . | H | α-helix | trans | -63.9 | -44.5 | 177 | -172.6 | -92.2 | 0 | 0 | 0 | 111.9 | I88 I89 M94 I95 Y96 | I88-F92 WeakPolarHBondContact O-CB 3.35Å; I88-F92 PolarHBondContact O-N 3.49Å; I89-F92 PolarHBondContact O-N 3.36Å; F92-M94 VanDerWaalsContact C-N 3.31Å; F92-M94 PolarHBondContact O-N 2.84Å; F92-I95 PolarHBondContact O-N 3.43Å; F92-Y96 VanDerWaalsContact O-CB 3.22Å; F92-Y96 WeakPolarHBondContact O-CB 3.46Å; F92-Y96 PolarHBondContact O-N 3.29Å |
| 93 | I | 77.9 | Confident | 71.7 | Confident | 90 Ų | 90 | 84 Ų | 84 | 46% | 0.462 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -59.9 | -41.6 | 174.7 | -71.2 | 167.4 | 0 | 0 | 0 | 110.7 | I89 L90 Y96 Y97 | I89-I93 HydrophobicContact CG2-CD1 3.74Å; I89-I93 HydrophobicContact CG2-CG1 4.41Å; I89-I93 WeakPolarHBondContact O-CB 3.47Å; I89-I93 VanDerWaalsContact O-CG1 3.27Å; I89-I93 WeakPolarHBondContact O-CG1 3.45Å; I89-I93 PolarHBondContact O-N 2.85Å; L90-I93 PolarHBondContact O-N 3.49Å; I93-Y96 PolarHBondContact O-N 3.25Å; I93-Y97 WeakPolarHBondContact O-CB 3.49Å; I93-Y97 PolarHBondContact O-N 2.77Å |
| 94 | M | 70.9 | Confident | 70.3 | Confident | 80 Ų | 80 | 88.4 Ų | 88.4 | 39% | 0.394 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -64.5 | -44.4 | 176.5 | -74.1 | -67.8 | -70.8 | 0 | 0 | 112 | L90 L91 F92 Y97 I98 F181 | L90-M94 WeakPolarHBondContact O-CB 3.46Å; L90-M94 VanDerWaalsContact O-CG 3.23Å; L90-M94 WeakPolarHBondContact O-CG 3.44Å; L90-M94 PolarHBondContact O-N 3.5Å; L91-M94 PolarHBondContact O-N 3.33Å; F92-M94 VanDerWaalsContact C-N 3.31Å; F92-M94 PolarHBondContact O-N 2.84Å; M94-Y97 PolarHBondContact O-N 3.23Å; M94-I98 VanDerWaalsContact O-CB 3.29Å; M94-I98 WeakPolarHBondContact O-CB 3.27Å; M94-I98 WeakPolarHBondContact O-CD1 3.34Å; M94-I98 WeakPolarHBondContact O-CG1 3.38Å; M94-I98 PolarHBondContact O-N 3.35Å; M94-F181 HydrophobicContact CE-CE1 3.97Å; M94-F181 HydrophobicContact CE-CZ 3.71Å |
| 95 | I | 70.9 | Confident | 69 | Low | 56 Ų | 56 | 90.6 Ų | 90.6 | 29% | 0.287 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -64 | -46.1 | 176 | -67.6 | 162.8 | 0 | 0 | 0 | 110.9 | L91 F92 Y97 I98 N99 L115 | L91-I95 VanDerWaalsContact O-CG1 3.29Å; L91-I95 WeakPolarHBondContact O-CG1 3.42Å; L91-I95 PolarHBondContact O-N 2.88Å; F92-I95 PolarHBondContact O-N 3.43Å; I95-Y97 PolarHBondContact O-N 3.07Å; I95-I98 WeakPolarHBondContact O-CB 3.46Å; I95-I98 PolarHBondContact O-N 2.8Å; I95-N99 VanDerWaalsContact O-CG 3.29Å; I95-N99 PolarHBondContact O-N 2.91Å; I95-L115 HydrophobicContact CD1-CD1 3.91Å |
| 96 | Y | 76.4 | Confident | 67.3 | Low | 124 Ų | 124 | 91.6 Ų | 91.6 | 49% | 0.486 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -61 | -44.4 | 177.3 | 178.6 | -92.3 | 0 | 0 | 0 | 112 | F92 I93 N99 H100 | F92-Y96 VanDerWaalsContact O-CB 3.22Å; F92-Y96 WeakPolarHBondContact O-CB 3.46Å; F92-Y96 PolarHBondContact O-N 3.29Å; I93-Y96 PolarHBondContact O-N 3.25Å; Y96-N99 PolarHBondContact O-N 2.97Å; Y96-H100 AromaticContact CD2-CD2 3.71Å; Y96-H100 AromaticContact CE1-CD2 3.8Å; Y96-H100 AromaticContact CE2-CD2 3.25Å; Y96-H100 WeakPolarHBondContact CE2-CD2 3.39Å; Y96-H100 AromaticContact CE2-NE2 3.34Å; Y96-H100 VanDerWaalsContact CE2-NE2 3.34Å; Y96-H100 WeakPolarHBondContact CE2-NE2 3.31Å; Y96-H100 AromaticContact CZ-CD2 3.31Å; Y96-H100 AromaticContact CZ-NE2 3.5Å; Y96-H100 WeakPolarHBondContact O-CB 3.14Å; Y96-H100 PolarHBondContact O-N 3.07Å; Y96-H100 PolarHBondContact OH-NE2 3.37Å |
| 97 | Y | 68.8 | Low | 65.8 | Low | 95 Ų | 95 | 94.6 Ų | 94.6 | 37% | 0.373 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -64.5 | -39.2 | 176.6 | -179.9 | -90.2 | 0 | 0 | 0 | 112.5 | I93 M94 I95 K101 F188 | I93-Y97 WeakPolarHBondContact O-CB 3.49Å; I93-Y97 PolarHBondContact O-N 2.77Å; M94-Y97 PolarHBondContact O-N 3.23Å; I95-Y97 PolarHBondContact O-N 3.07Å; Y97-K101 HydrophobicContact CE1-CD 4.14Å; Y97-K101 HydrophobicContact CE2-CD 3.95Å; Y97-K101 VanDerWaalsContact CE2-CE 3.42Å; Y97-K101 VanDerWaalsContact CE2-NZ 3.27Å; Y97-K101 VanDerWaalsContact CZ-NZ 3.31Å; Y97-K101 PolarHBondContact O-N 2.94Å; Y97-K101 PolarHBondContact OH-NZ 3.39Å; Y97-F188 HydrophobicContact CE1-CE2 4.42Å; Y97-F188 HydrophobicContact CE1-CZ 4.21Å; Y97-F188 AromaticContact CZ-CZ 3.98Å; Y97-F188 WeakPolarHBondContact OH-CE1 3.4Å; Y97-F188 WeakPolarHBondContact OH-CZ 3.18Å |
| 98 | I | 67.6 | Low | 64.6 | Low | 26 Ų | 26 | 95.3 Ų | 95.3 | 13% | 0.133 | 47% | 0.468 | C | S | . | . | H | α-helix | trans | -62.5 | -42.4 | 173.2 | -78.1 | 168.4 | 0 | 0 | 0 | 110.7 | M94 I95 L105 L108 | M94-I98 VanDerWaalsContact O-CB 3.29Å; M94-I98 WeakPolarHBondContact O-CB 3.27Å; M94-I98 WeakPolarHBondContact O-CD1 3.34Å; M94-I98 WeakPolarHBondContact O-CG1 3.38Å; M94-I98 PolarHBondContact O-N 3.35Å; I95-I98 WeakPolarHBondContact O-CB 3.46Å; I95-I98 PolarHBondContact O-N 2.8Å; I98-L105 HydrophobicContact CG2-CD1 3.95Å; I98-L105 HydrophobicContact CG2-CD2 3.54Å; I98-L105 HydrophobicContact CG2-CG 4.27Å; I98-L105 WeakPolarHBondContact O-CD1 3.4Å; I98-L108 HydrophobicContact CD1-CD2 4.29Å; I98-L108 HydrophobicContact CG1-CD2 4.37Å; I98-L108 HydrophobicContact CG2-CD2 4.24Å |
| 99 | N | 67.7 | Low | 63.3 | Low | 98 Ų | 98 | 99.1 Ų | 99.1 | 52% | 0.524 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -73.6 | -47.2 | -180 | -70 | -10.7 | 0 | 0 | 0 | 112.9 | I95 Y96 K101 | I95-N99 VanDerWaalsContact O-CG 3.29Å; I95-N99 PolarHBondContact O-N 2.91Å; Y96-N99 PolarHBondContact O-N 2.97Å; N99-K101 VanDerWaalsContact C-N 3.32Å; N99-K101 PolarHBondContact O-N 3.08Å |
| 100 | H | 63.8 | Low | 62.2 | Low | 126 Ų | 126 | 98.7 Ų | 98.7 | 58% | 0.583 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -70.9 | -24.1 | -175.5 | -97.3 | -86.1 | 0 | 0 | 0 | 114.2 | Y96 H102 | Y96-H100 AromaticContact CD2-CD2 3.71Å; Y96-H100 AromaticContact CE1-CD2 3.8Å; Y96-H100 AromaticContact CE2-CD2 3.25Å; Y96-H100 WeakPolarHBondContact CE2-CD2 3.39Å; Y96-H100 AromaticContact CE2-NE2 3.34Å; Y96-H100 VanDerWaalsContact CE2-NE2 3.34Å; Y96-H100 WeakPolarHBondContact CE2-NE2 3.31Å; Y96-H100 AromaticContact CZ-CD2 3.31Å; Y96-H100 AromaticContact CZ-NE2 3.5Å; Y96-H100 WeakPolarHBondContact O-CB 3.14Å; Y96-H100 PolarHBondContact O-N 3.07Å; Y96-H100 PolarHBondContact OH-NE2 3.37Å; H100-H102 PolarHBondContact O-N 3.46Å |
| 101 | K | 63 | Low | 61.4 | Low | 89 Ų | 89 | 96.5 Ų | 96.5 | 39% | 0.387 | 47% | 0.469 | S | S | . | . | S | Bend | trans | -91.2 | 99.6 | 169.1 | -65.9 | -168 | 179.6 | -176.7 | 0 | 108.2 | Y97 N99 L103 F188 | Y97-K101 HydrophobicContact CE1-CD 4.14Å; Y97-K101 HydrophobicContact CE2-CD 3.95Å; Y97-K101 VanDerWaalsContact CE2-CE 3.42Å; Y97-K101 VanDerWaalsContact CE2-NZ 3.27Å; Y97-K101 VanDerWaalsContact CZ-NZ 3.31Å; Y97-K101 PolarHBondContact O-N 2.94Å; Y97-K101 PolarHBondContact OH-NZ 3.39Å; N99-K101 VanDerWaalsContact C-N 3.32Å; N99-K101 PolarHBondContact O-N 3.08Å; K101-L103 WeakPolarHBondContact O-CB 3.32Å; K101-L103 PolarHBondContact O-N 3.09Å; K101-F188 HydrophobicContact CD-CE2 4.24Å; K101-F188 HydrophobicContact CD-CZ 3.77Å |
| 102 | H | 51.7 | Low | 60.6 | Low | 184 Ų | 184 | 101.4 Ų | 101.4 | 85% | 0.852 | 49% | 0.49 | S | S | * | . | trans | -54.7 | 47.3 | -179.5 | -112.8 | -90.1 | 0 | 0 | 0 | 115.6 | H100 N104 | H100-H102 PolarHBondContact O-N 3.46Å; H102-N104 VanDerWaalsContact C-N 3.29Å; H102-N104 PolarHBondContact O-N 3.48Å | ||
| 103 | L | 52 | Low | 59.9 | Low | 78 Ų | 78 | 102.5 Ų | 102.5 | 41% | 0.408 | 50% | 0.495 | S | S | . | . | trans | -90.6 | 50.3 | -161.7 | -154.7 | 91.6 | 0 | 0 | 0 | 112.3 | K101 L105 F188 | K101-L103 WeakPolarHBondContact O-CB 3.32Å; K101-L103 PolarHBondContact O-N 3.09Å; L103-L105 PolarHBondContact O-N 2.8Å; L103-F188 HydrophobicContact CD1-CE2 4.49Å; L103-F188 HydrophobicContact CD2-CD2 4.25Å; L103-F188 HydrophobicContact CD2-CE2 4.42Å | ||
| 104 | N | 48 | Very low | 59.4 | Low | 144 Ų | 144 | 100 Ų | 100 | 77% | 0.77 | 49% | 0.485 | S | S | * | . | trans | 44.2 | 60.6 | -179.4 | -75.2 | -12.4 | 0 | 0 | 0 | 113.2 | H102 S106 | H102-N104 VanDerWaalsContact C-N 3.29Å; H102-N104 PolarHBondContact O-N 3.48Å; N104-S106 PolarHBondContact O-N 3.34Å | ||
| 105 | L | 47.1 | Very low | 59.3 | Low | 60 Ų | 60 | 99 Ų | 99 | 31% | 0.314 | 48% | 0.481 | S | S | . | . | G | 310 helix | trans | -71.4 | -2.8 | -160.9 | -134.7 | 87 | 0 | 0 | 0 | 116.2 | I98 L103 K107 L108 | I98-L105 HydrophobicContact CG2-CD1 3.95Å; I98-L105 HydrophobicContact CG2-CD2 3.54Å; I98-L105 HydrophobicContact CG2-CG 4.27Å; I98-L105 WeakPolarHBondContact O-CD1 3.4Å; L103-L105 PolarHBondContact O-N 2.8Å; L105-K107 PolarHBondContact O-N 3.29Å; L105-K107 VanDerWaalsContact O-N 3.1Å; L105-L108 HydrophobicContact CD1-CB 4.33Å; L105-L108 HydrophobicContact CG-CB 3.99Å; L105-L108 CarbonylContact O-C 3.54Å; L105-L108 WeakPolarHBondContact O-CA 3.27Å; L105-L108 PolarHBondContact O-N 2.7Å |
| 106 | S | 43.3 | Very low | 59.2 | Low | 107 Ų | 107 | 100.8 Ų | 100.8 | 75% | 0.748 | 49% | 0.491 | S | S | * | . | G | 310 helix | trans | -58 | -23.7 | 176.4 | 56.5 | 0 | 0 | 0 | 0 | 113.6 | N104 | N104-S106 PolarHBondContact O-N 3.34Š|
| 107 | K | 47.7 | Very low | 59 | Low | 162 Ų | 162 | 98.8 Ų | 98.8 | 70% | 0.704 | 49% | 0.488 | S | S | * | . | G | 310 helix | trans | -96.4 | -4 | 171.9 | -71 | -171.5 | 175.8 | -177.1 | 0 | 114.7 | L105 | L105-K107 PolarHBondContact O-N 3.29Å; L105-K107 VanDerWaalsContact O-N 3.1Å |
| 108 | L | 50.9 | Low | 59.1 | Low | 43 Ų | 43 | 95.4 Ų | 95.4 | 23% | 0.225 | 48% | 0.476 | C | S | . | . | trans | -109.3 | 47.6 | 169.5 | -145.4 | 79.7 | 0 | 0 | 0 | 111.7 | I98 L105 L110 L184 | I98-L108 HydrophobicContact CD1-CD2 4.29Å; I98-L108 HydrophobicContact CG1-CD2 4.37Å; I98-L108 HydrophobicContact CG2-CD2 4.24Å; L105-L108 HydrophobicContact CD1-CB 4.33Å; L105-L108 HydrophobicContact CG-CB 3.99Å; L105-L108 CarbonylContact O-C 3.54Å; L105-L108 WeakPolarHBondContact O-CA 3.27Å; L105-L108 PolarHBondContact O-N 2.7Å; L108-L110 PolarHBondContact O-N 2.93Å; L108-L184 HydrophobicContact CD1-CD1 3.77Å; L108-L184 HydrophobicContact CD1-CD2 3.6Å; L108-L184 HydrophobicContact CD1-CG 4.3Å; L108-L184 HydrophobicContact CD2-CD2 3.72Å; L108-L184 HydrophobicContact CG-CD2 4.32Å | ||
| 109 | Y | 50.7 | Low | 59.3 | Low | 155 Ų | 155 | 99.3 Ų | 99.3 | 61% | 0.608 | 49% | 0.492 | S | S | * | . | trans | -61.7 | 84.5 | 155.8 | -133.7 | -98.4 | 0 | 0 | 0 | 108.1 | S111 H112 | Y109-S111 PolarHBondContact O-N 2.8Å; Y109-H112 AromaticContact CE1-CD2 3.67Å; Y109-H112 AromaticContact CE1-NE2 3.61Å; Y109-H112 AromaticContact CZ-CD2 3.99Å; Y109-H112 AromaticContact CZ-NE2 3.12Å; Y109-H112 PolarHBondContact OH-NE2 3.26Å | ||
| 110 | L | 56.6 | Low | 59.7 | Low | 77 Ų | 77 | 98.9 Ų | 98.9 | 40% | 0.403 | 49% | 0.489 | S | S | . | . | trans | -61.5 | 88.7 | 159.5 | 179.8 | 74.2 | 0 | 0 | 0 | 104.7 | L108 H112 | L108-L110 PolarHBondContact O-N 2.93Å; L110-H112 PolarHBondContact O-N 3.5Å | ||
| 111 | S | 60 | Low | 60.1 | Low | 49 Ų | 49 | 95.6 Ų | 95.6 | 34% | 0.343 | 48% | 0.475 | S | S | . | . | trans | -50.6 | 136.7 | -161.7 | -176.3 | 0 | 0 | 0 | 0 | 110 | Y109 K113 S114 L115 | Y109-S111 PolarHBondContact O-N 2.8Å; S111-K113 CarbonylContact O-C 3.39Å; S111-K113 PolarHBondContact O-N 3.13Å; S111-S114 WeakPolarHBondContact O-CA 3.23Å; S111-S114 WeakPolarHBondContact O-CB 3.41Å; S111-S114 PolarHBondContact O-N 2.91Å; S111-L115 PolarHBondContact O-N 3.41Å | ||
| 112 | H | 60.4 | Low | 60.5 | Low | 150 Ų | 150 | 92.1 Ų | 92.1 | 69% | 0.694 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -48.3 | -32 | 175.9 | -62.1 | -57.7 | 0 | 0 | 0 | 111.4 | Y109 L110 S114 L115 L116 | Y109-H112 AromaticContact CE1-CD2 3.67Å; Y109-H112 AromaticContact CE1-NE2 3.61Å; Y109-H112 AromaticContact CZ-CD2 3.99Å; Y109-H112 AromaticContact CZ-NE2 3.12Å; Y109-H112 PolarHBondContact OH-NE2 3.26Å; L110-H112 PolarHBondContact O-N 3.5Å; H112-S114 PolarHBondContact O-N 2.85Å; H112-L115 PolarHBondContact O-N 3.45Å; H112-L116 WeakPolarHBondContact O-CB 3.31Å; H112-L116 PolarHBondContact O-N 3.02Å |
| 113 | K | 63.3 | Low | 61.7 | Low | 160 Ų | 160 | 88 Ų | 88 | 70% | 0.696 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -56.2 | -44.2 | 170.4 | -59.3 | -172 | 177.8 | -171.2 | 0 | 114 | S111 I117 | S111-K113 CarbonylContact O-C 3.39Å; S111-K113 PolarHBondContact O-N 3.13Å; K113-I117 WeakPolarHBondContact O-CB 3.42Å; K113-I117 WeakPolarHBondContact O-CD1 3.47Å; K113-I117 WeakPolarHBondContact O-CG1 3.47Å; K113-I117 PolarHBondContact O-N 3.41Å |
| 114 | S | 67.4 | Low | 62.8 | Low | 37 Ų | 37 | 88 Ų | 88 | 26% | 0.259 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -71.7 | -36.2 | 179.2 | -167.7 | 0 | 0 | 0 | 0 | 112.8 | S111 H112 I118 | S111-S114 WeakPolarHBondContact O-CA 3.23Å; S111-S114 WeakPolarHBondContact O-CB 3.41Å; S111-S114 PolarHBondContact O-N 2.91Å; H112-S114 PolarHBondContact O-N 2.85Å; S114-I118 WeakPolarHBondContact O-CG1 3.49Å; S114-I118 PolarHBondContact O-N 3.44Å |
| 115 | L | 67.4 | Low | 63.9 | Low | 58 Ų | 58 | 82 Ų | 82 | 30% | 0.304 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -71 | -44.8 | 174.3 | 179.7 | 143.8 | 0 | 0 | 0 | 110.2 | I95 S111 H112 I117 I118 F119 | I95-L115 HydrophobicContact CD1-CD1 3.91Å; S111-L115 PolarHBondContact O-N 3.41Å; H112-L115 PolarHBondContact O-N 3.45Å; L115-I117 VanDerWaalsContact C-N 3.31Å; L115-I117 PolarHBondContact O-N 2.9Å; L115-I118 WeakPolarHBondContact O-CB 3.25Å; L115-I118 PolarHBondContact O-N 3.27Å; L115-F119 HydrophobicContact CD2-CD2 3.6Å; L115-F119 HydrophobicContact CD2-CE2 3.66Å; L115-F119 HydrophobicContact CG-CD2 4.02Å; L115-F119 HydrophobicContact CG-CE2 4.01Å; L115-F119 WeakPolarHBondContact O-CD2 3.31Å; L115-F119 PolarHBondContact O-N 2.92Å |
| 116 | L | 69.9 | Low | 65.1 | Low | 95 Ų | 95 | 82.9 Ų | 82.9 | 50% | 0.497 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -60 | -36.2 | 173.6 | 176.8 | 139.3 | 0 | 0 | 0 | 112.6 | H112 F119 I120 | H112-L116 WeakPolarHBondContact O-CB 3.31Å; H112-L116 PolarHBondContact O-N 3.02Å; L116-F119 PolarHBondContact O-N 2.86Å; L116-I120 HydrophobicContact CD2-CD1 3.51Å; L116-I120 HydrophobicContact CD2-CG1 4.48Å; L116-I120 HydrophobicContact CG-CD1 3.97Å; L116-I120 WeakPolarHBondContact O-CB 3.45Å; L116-I120 VanDerWaalsContact O-CG1 3.27Å; L116-I120 WeakPolarHBondContact O-CG1 3.33Å; L116-I120 PolarHBondContact O-N 2.76Å |
| 117 | I | 72 | Confident | 66.7 | Low | 82 Ų | 82 | 80.7 Ų | 80.7 | 42% | 0.421 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -62 | -43.7 | 170.8 | -76.4 | 161.2 | 0 | 0 | 0 | 111.1 | K113 L115 I120 L121 | K113-I117 WeakPolarHBondContact O-CB 3.42Å; K113-I117 WeakPolarHBondContact O-CD1 3.47Å; K113-I117 WeakPolarHBondContact O-CG1 3.47Å; K113-I117 PolarHBondContact O-N 3.41Å; L115-I117 VanDerWaalsContact C-N 3.31Å; L115-I117 PolarHBondContact O-N 2.9Å; I117-I120 PolarHBondContact O-N 3.46Å; I117-L121 HydrophobicContact CG2-CD1 3.95Å; I117-L121 HydrophobicContact CG2-CG 4.45Å; I117-L121 WeakPolarHBondContact O-CB 3.42Å; I117-L121 VanDerWaalsContact O-CG 3.27Å; I117-L121 WeakPolarHBondContact O-CG 3.27Å; I117-L121 PolarHBondContact O-N 3.26Å |
| 118 | I | 71.1 | Confident | 67.9 | Low | 24 Ų | 24 | 75.3 Ų | 75.3 | 12% | 0.123 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -64.6 | -41.9 | 177.1 | -66.6 | 164.3 | 0 | 0 | 0 | 110.8 | L91 S114 L115 L121 L122 L172 | L91-I118 HydrophobicContact CD1-CG2 3.82Å; L91-I118 HydrophobicContact CD2-CD1 4.47Å; S114-I118 WeakPolarHBondContact O-CG1 3.49Å; S114-I118 PolarHBondContact O-N 3.44Å; L115-I118 WeakPolarHBondContact O-CB 3.25Å; L115-I118 PolarHBondContact O-N 3.27Å; I118-L121 PolarHBondContact O-N 3.29Å; I118-L122 WeakPolarHBondContact O-CB 3.34Å; I118-L122 PolarHBondContact O-N 2.93Å; I118-L172 HydrophobicContact CD1-CD1 4.39Å |
| 119 | F | 72.1 | Confident | 68.8 | Low | 108 Ų | 108 | 74 Ų | 74 | 47% | 0.474 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -65.1 | -41.9 | 174.7 | -88.4 | -85.8 | 0 | 0 | 0 | 112.9 | L115 L116 L122 I123 | L115-F119 HydrophobicContact CD2-CD2 3.6Å; L115-F119 HydrophobicContact CD2-CE2 3.66Å; L115-F119 HydrophobicContact CG-CD2 4.02Å; L115-F119 HydrophobicContact CG-CE2 4.01Å; L115-F119 WeakPolarHBondContact O-CD2 3.31Å; L115-F119 PolarHBondContact O-N 2.92Å; L116-F119 PolarHBondContact O-N 2.86Å; F119-L122 PolarHBondContact O-N 3.19Å; F119-I123 WeakPolarHBondContact O-CB 3.45Å; F119-I123 WeakPolarHBondContact O-CD1 3.24Å; F119-I123 VanDerWaalsContact O-CG1 3.25Å; F119-I123 WeakPolarHBondContact O-CG1 3.26Å; F119-I123 PolarHBondContact O-N 3.08Å |
| 120 | I | 74.8 | Confident | 69.8 | Low | 89 Ų | 89 | 70 Ų | 70 | 46% | 0.456 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -64.7 | -42.4 | 176 | -73.3 | 171.7 | 0 | 0 | 0 | 110.8 | L116 I117 I123 T124 | L116-I120 HydrophobicContact CD2-CD1 3.51Å; L116-I120 HydrophobicContact CD2-CG1 4.48Å; L116-I120 HydrophobicContact CG-CD1 3.97Å; L116-I120 WeakPolarHBondContact O-CB 3.45Å; L116-I120 VanDerWaalsContact O-CG1 3.27Å; L116-I120 WeakPolarHBondContact O-CG1 3.33Å; L116-I120 PolarHBondContact O-N 2.76Å; I117-I120 PolarHBondContact O-N 3.46Å; I120-I123 PolarHBondContact O-N 3.09Å; I120-T124 VanDerWaalsContact O-CB 3.31Å; I120-T124 WeakPolarHBondContact O-CB 3.27Å; I120-T124 PolarHBondContact O-N 3.28Å; I120-T124 PolarHBondContact O-OG1 2.85Å |
| 121 | L | 72.4 | Confident | 70.6 | Confident | 56 Ų | 56 | 70.8 Ų | 70.8 | 29% | 0.293 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -59.3 | -47.5 | 174.2 | -74.8 | 169.7 | 0 | 0 | 0 | 111.1 | I117 I118 I123 T124 E125 L171 | I117-L121 HydrophobicContact CG2-CD1 3.95Å; I117-L121 HydrophobicContact CG2-CG 4.45Å; I117-L121 WeakPolarHBondContact O-CB 3.42Å; I117-L121 VanDerWaalsContact O-CG 3.27Å; I117-L121 WeakPolarHBondContact O-CG 3.27Å; I117-L121 PolarHBondContact O-N 3.26Å; I118-L121 PolarHBondContact O-N 3.29Å; L121-I123 PolarHBondContact O-N 3.4Å; L121-T124 CarbonylContact O-C 3.6Å; L121-T124 WeakPolarHBondContact O-CB 3.43Å; L121-T124 PolarHBondContact O-N 3.47Å; L121-T124 VanDerWaalsContact O-N 3.12Å; L121-E125 WeakPolarHBondContact O-CB 3.46Å; L121-E125 PolarHBondContact O-N 3.02Å; L121-L171 HydrophobicContact CD1-CB 4.46Å; L121-L171 HydrophobicContact CD1-CD1 4.17Å; L121-L171 HydrophobicContact CD2-CD1 3.99Å |
| 122 | L | 72.3 | Confident | 71.1 | Confident | 17 Ų | 17 | 69.9 Ų | 69.9 | 9% | 0.089 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -64.6 | -37.9 | 179.6 | -175.2 | 147.2 | 0 | 0 | 0 | 112.7 | I84 I88 I118 F119 I126 | I84-L122 HydrophobicContact CG2-CD1 4.13Å; I84-L122 HydrophobicContact CG2-CD2 4.49Å; I84-L122 HydrophobicContact CG2-CG 4.37Å; I88-L122 HydrophobicContact CD1-CD1 4.21Å; I88-L122 HydrophobicContact CG1-CD1 4Å; I118-L122 WeakPolarHBondContact O-CB 3.34Å; I118-L122 PolarHBondContact O-N 2.93Å; F119-L122 PolarHBondContact O-N 3.19Å; L122-I126 HydrophobicContact CD2-CD1 3.66Å; L122-I126 HydrophobicContact CG-CD1 4.44Å; L122-I126 VanDerWaalsContact O-CG1 3.26Å; L122-I126 WeakPolarHBondContact O-CG1 3.45Å; L122-I126 PolarHBondContact O-N 3.27Å |
| 123 | I | 76.7 | Confident | 71.6 | Confident | 96 Ų | 96 | 63.8 Ų | 63.8 | 49% | 0.492 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -67.4 | -38.4 | 171.8 | -69.1 | 164 | 0 | 0 | 0 | 111 | F119 I120 L121 S127 | F119-I123 WeakPolarHBondContact O-CB 3.45Å; F119-I123 WeakPolarHBondContact O-CD1 3.24Å; F119-I123 VanDerWaalsContact O-CG1 3.25Å; F119-I123 WeakPolarHBondContact O-CG1 3.26Å; F119-I123 PolarHBondContact O-N 3.08Å; I120-I123 PolarHBondContact O-N 3.09Å; L121-I123 PolarHBondContact O-N 3.4Å; I123-S127 WeakPolarHBondContact O-CB 3.33Å; I123-S127 PolarHBondContact O-N 3.05Å; I123-S127 PolarHBondContact O-OG 3.16Å |
| 124 | T | 73.9 | Confident | 72.3 | Confident | 80 Ų | 80 | 61 Ų | 61 | 49% | 0.491 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -66.4 | -42 | 177.8 | -55.8 | 0 | 0 | 0 | 0 | 110.7 | I120 L121 S127 S128 | I120-T124 VanDerWaalsContact O-CB 3.31Å; I120-T124 WeakPolarHBondContact O-CB 3.27Å; I120-T124 PolarHBondContact O-N 3.28Å; I120-T124 PolarHBondContact O-OG1 2.85Å; L121-T124 CarbonylContact O-C 3.6Å; L121-T124 WeakPolarHBondContact O-CB 3.43Å; L121-T124 PolarHBondContact O-N 3.47Å; L121-T124 VanDerWaalsContact O-N 3.12Å; T124-S127 PolarHBondContact O-N 3.08Å; T124-S128 VanDerWaalsContact O-CB 3.26Å; T124-S128 WeakPolarHBondContact O-CB 3.39Å; T124-S128 PolarHBondContact O-N 2.99Å |
| 125 | E | 72.8 | Confident | 72.7 | Confident | 17 Ų | 17 | 65.6 Ų | 65.6 | 8% | 0.079 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -61.5 | -50 | 174.8 | -169.2 | -176.5 | 148.5 | 0 | 0 | 111.1 | Q80 L121 S127 S128 L129 D164 L168 | Q80-E125 PolarHBondContact NE2-OE1 3.36Å; L121-E125 WeakPolarHBondContact O-CB 3.46Å; L121-E125 PolarHBondContact O-N 3.02Å; E125-S127 VanDerWaalsContact C-N 3.29Å; E125-S127 PolarHBondContact O-N 3.23Å; E125-S128 PolarHBondContact O-N 3.21Å; E125-L129 WeakPolarHBondContact O-CB 3.26Å; E125-L129 PolarHBondContact O-N 3.39Å; E125-D164 HydrophobicContact CG-CB 4.23Å; E125-L168 WeakPolarHBondContact OE2-CD2 3.4Å |
| 126 | I | 72.2 | Confident | 72.9 | Confident | 78 Ų | 78 | 63 Ų | 63 | 40% | 0.4 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -59.6 | -38.5 | 174.8 | -69 | 167.9 | 0 | 0 | 0 | 112 | I84 L122 L129 C130 | I84-I126 HydrophobicContact CD1-CG1 4.01Å; L122-I126 HydrophobicContact CD2-CD1 3.66Å; L122-I126 HydrophobicContact CG-CD1 4.44Å; L122-I126 VanDerWaalsContact O-CG1 3.26Å; L122-I126 WeakPolarHBondContact O-CG1 3.45Å; L122-I126 PolarHBondContact O-N 3.27Å; I126-L129 PolarHBondContact O-N 3.05Å; I126-C130 WeakPolarHBondContact O-CB 3.34Å; I126-C130 PolarHBondContact O-N 3.27Å |
| 127 | S | 75.9 | Confident | 73.1 | Confident | 61 Ų | 61 | 63.6 Ų | 63.6 | 43% | 0.427 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -69.4 | -41 | 177.5 | -56.9 | 0 | 0 | 0 | 0 | 111.6 | I123 T124 E125 L129 C130 T131 | I123-S127 WeakPolarHBondContact O-CB 3.33Å; I123-S127 PolarHBondContact O-N 3.05Å; I123-S127 PolarHBondContact O-OG 3.16Å; T124-S127 PolarHBondContact O-N 3.08Å; E125-S127 VanDerWaalsContact C-N 3.29Å; E125-S127 PolarHBondContact O-N 3.23Å; S127-L129 VanDerWaalsContact C-N 3.32Å; S127-C130 PolarHBondContact O-N 3.41Å; S127-T131 PolarHBondContact O-N 2.87Å; S127-T131 PolarHBondContact O-OG1 2.88Å |
| 128 | S | 73.4 | Confident | 73.4 | Confident | 49 Ų | 49 | 63.7 Ų | 63.7 | 34% | 0.343 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -64.4 | -37.5 | 175.3 | -163.9 | 0 | 0 | 0 | 0 | 111.1 | T124 E125 P132 H160 | T124-S128 VanDerWaalsContact O-CB 3.26Å; T124-S128 WeakPolarHBondContact O-CB 3.39Å; T124-S128 PolarHBondContact O-N 2.99Å; E125-S128 PolarHBondContact O-N 3.21Å; S128-P132 WeakPolarHBondContact O-CD 3.19Å; S128-H160 VanDerWaalsContact C-NE2 3.33Å; S128-H160 WeakPolarHBondContact CB-NE2 3.23Å; S128-H160 PolarHBondContact O-NE2 3.5Å; S128-H160 PolarHBondContact OG-CE1 3.07Å; S128-H160 PolarHBondContact OG-NE2 2.92Å |
| 129 | L | 68.6 | Low | 73.4 | Confident | 16 Ų | 16 | 63.6 Ų | 63.6 | 8% | 0.084 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -66.1 | -42.8 | 174.3 | -157.1 | 70.7 | 0 | 0 | 0 | 112.8 | Q80 E125 I126 S127 P132 I133 Y161 | Q80-L129 HydrophobicContact CB-CD2 4.18Å; Q80-L129 HydrophobicContact CG-CD1 4.36Å; Q80-L129 HydrophobicContact CG-CD2 3.89Å; E125-L129 WeakPolarHBondContact O-CB 3.26Å; E125-L129 PolarHBondContact O-N 3.39Å; I126-L129 PolarHBondContact O-N 3.05Å; S127-L129 VanDerWaalsContact C-N 3.32Å; L129-P132 WeakPolarHBondContact O-CD 3.42Å; L129-I133 VanDerWaalsContact O-CD1 3.31Å; L129-I133 WeakPolarHBondContact O-CD1 3.21Å; L129-I133 WeakPolarHBondContact O-CG1 3.33Å; L129-Y161 HydrophobicContact CD1-CD1 3.7Å; L129-Y161 HydrophobicContact CD1-CE1 3.24Å; L129-Y161 HydrophobicContact CD1-CE2 4.45Å; L129-Y161 HydrophobicContact CD1-CG 4.44Å; L129-Y161 HydrophobicContact CD2-CE1 4.06Å; L129-Y161 HydrophobicContact CG-CE1 3.98Å |
| 130 | C | 71.7 | Confident | 73.3 | Confident | 72 Ų | 72 | 60.1 Ų | 60.1 | 49% | 0.486 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -69.3 | -36.4 | -179.2 | -170.3 | 0 | 0 | 0 | 0 | 112.2 | I126 S127 I133 L134 | I126-C130 WeakPolarHBondContact O-CB 3.34Å; I126-C130 PolarHBondContact O-N 3.27Å; S127-C130 PolarHBondContact O-N 3.41Å; C130-I133 PolarHBondContact O-N 2.89Å; C130-L134 WeakPolarHBondContact O-CB 3.41Å; C130-L134 PolarHBondContact O-N 2.75Å |
| 131 | T | 74.2 | Confident | 73.2 | Confident | 92 Ų | 92 | 64.8 Ų | 64.8 | 56% | 0.564 | 34% | 0.34 | S | S | * | . | H | α-helix | trans | -55.7 | -53 | -173.9 | -62.2 | 0 | 0 | 0 | 0 | 114.4 | S127 I133 L134 Y135 | S127-T131 PolarHBondContact O-N 2.87Å; S127-T131 PolarHBondContact O-OG1 2.88Å; T131-I133 VanDerWaalsContact C-N 3.34Å; T131-I133 PolarHBondContact O-N 3.36Å; T131-L134 PolarHBondContact O-N 2.91Å; T131-Y135 WeakPolarHBondContact O-CB 3.02Å; T131-Y135 PolarHBondContact O-N 3.4Å |
| 132 | P | 70.8 | Confident | 73.1 | Confident | 30 Ų | 30 | 70.8 Ų | 70.8 | 20% | 0.195 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -75.6 | -22.5 | -178.4 | 32.8 | -37.7 | 0 | 0 | 0 | 112.8 | S128 L129 H136 I157 | S128-P132 WeakPolarHBondContact O-CD 3.19Å; L129-P132 WeakPolarHBondContact O-CD 3.42Å; P132-H136 VanDerWaalsContact O-CB 3.27Å; P132-H136 WeakPolarHBondContact O-CB 3.26Å; P132-H136 PolarHBondContact O-N 3.29Å; P132-I157 HydrophobicContact CB-CD1 4.33Å; P132-I157 HydrophobicContact CB-CG1 3.75Å; P132-I157 HydrophobicContact CG-CG1 4.09Å |
| 133 | I | 70.9 | Confident | 72.8 | Confident | 23 Ų | 23 | 71.4 Ų | 71.4 | 12% | 0.118 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -69.8 | -47.5 | 171.9 | -59.7 | 171.5 | 0 | 0 | 0 | 109.6 | L77 L129 C130 T131 Y135 H136 F137 | L77-I133 HydrophobicContact CD1-CD1 3.6Å; L129-I133 VanDerWaalsContact O-CD1 3.31Å; L129-I133 WeakPolarHBondContact O-CD1 3.21Å; L129-I133 WeakPolarHBondContact O-CG1 3.33Å; C130-I133 PolarHBondContact O-N 2.89Å; T131-I133 VanDerWaalsContact C-N 3.34Å; T131-I133 PolarHBondContact O-N 3.36Å; I133-Y135 VanDerWaalsContact C-N 3.31Å; I133-Y135 PolarHBondContact O-N 2.89Å; I133-H136 WeakPolarHBondContact O-CB 3.41Å; I133-H136 PolarHBondContact O-N 3.35Å; I133-F137 HydrophobicContact CG2-CD2 3.93Å; I133-F137 HydrophobicContact CG2-CE2 3.78Å; I133-F137 VanDerWaalsContact O-CD2 3.29Å; I133-F137 WeakPolarHBondContact O-CD2 3.48Å; I133-F137 PolarHBondContact O-N 3.25Å |
| 134 | L | 77.9 | Confident | 72 | Confident | 101 Ų | 101 | 76.4 Ų | 76.4 | 53% | 0.529 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -60.1 | -43 | 174.1 | -172.2 | 68.5 | 0 | 0 | 0 | 110.8 | C130 T131 H136 F137 I138 | C130-L134 WeakPolarHBondContact O-CB 3.41Å; C130-L134 PolarHBondContact O-N 2.75Å; T131-L134 PolarHBondContact O-N 2.91Å; L134-H136 PolarHBondContact O-N 2.88Å; L134-F137 PolarHBondContact O-N 3.08Å; L134-I138 HydrophobicContact CG-CD1 3.95Å; L134-I138 WeakPolarHBondContact O-CB 3.4Å; L134-I138 VanDerWaalsContact O-CG1 3.25Å; L134-I138 WeakPolarHBondContact O-CG1 3.26Å; L134-I138 PolarHBondContact O-N 3.19Å |
| 135 | Y | 75.8 | Confident | 71.5 | Confident | 133 Ų | 133 | 80.2 Ų | 80.2 | 52% | 0.522 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -62.2 | -39.6 | 174.7 | -170.7 | -98.4 | 0 | 0 | 0 | 112.9 | T131 I133 I138 L139 I153 | T131-Y135 WeakPolarHBondContact O-CB 3.02Å; T131-Y135 PolarHBondContact O-N 3.4Å; I133-Y135 VanDerWaalsContact C-N 3.31Å; I133-Y135 PolarHBondContact O-N 2.89Å; Y135-I138 PolarHBondContact O-N 2.89Å; Y135-L139 WeakPolarHBondContact O-CB 3.32Å; Y135-L139 PolarHBondContact O-N 3.42Å; Y135-I153 HydrophobicContact CD1-CD1 4.06Å; Y135-I153 HydrophobicContact CD1-CG1 4.46Å; Y135-I153 HydrophobicContact CE1-CD1 3.73Å; Y135-I153 HydrophobicContact CE1-CG1 4.28Å |
| 136 | H | 72.4 | Confident | 71.1 | Confident | 5 Ų | 5 | 81.3 Ų | 81.3 | 2% | 0.023 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -61.2 | -47.5 | 173.8 | 172 | -71.8 | 0 | 0 | 0 | 111.6 | I73 P132 I133 L134 L139 S140 Y146 L150 I153 I157 | I73-H136 WeakPolarHBondContact CD1-NE2 3.5Å; P132-H136 VanDerWaalsContact O-CB 3.27Å; P132-H136 WeakPolarHBondContact O-CB 3.26Å; P132-H136 PolarHBondContact O-N 3.29Å; I133-H136 WeakPolarHBondContact O-CB 3.41Å; I133-H136 PolarHBondContact O-N 3.35Å; L134-H136 PolarHBondContact O-N 2.88Å; H136-L139 PolarHBondContact O-N 3.47Å; H136-S140 VanDerWaalsContact O-CB 3.3Å; H136-S140 WeakPolarHBondContact O-CB 3.31Å; H136-S140 PolarHBondContact O-N 3.35Å; H136-Y146 PolarHBondContact CE1-OH 2.87Å; H136-Y146 PolarHBondContact NE2-OH 3.4Å; H136-L150 WeakPolarHBondContact NE2-CD1 3.43Å; H136-I153 HydrophobicContact CB-CG2 4.24Å; H136-I157 HydrophobicContact CB-CD1 4.29Å |
| 137 | F | 73.4 | Confident | 70.9 | Confident | 106 Ų | 106 | 84.9 Ų | 84.9 | 47% | 0.465 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -63.8 | -42.7 | 175.9 | -81.6 | -69.2 | 0 | 0 | 0 | 112.7 | F70 I133 L134 S140 Y141 | F70-F137 HydrophobicContact CE1-CE1 4.07Å; F70-F137 HydrophobicContact CE1-CZ 4.01Å; F70-F137 AromaticContact CZ-CE1 3.9Å; F70-F137 HydrophobicContact CZ-CE1 3.9Å; F70-F137 HydrophobicContact CZ-CZ 4.25Å; I133-F137 HydrophobicContact CG2-CD2 3.93Å; I133-F137 HydrophobicContact CG2-CE2 3.78Å; I133-F137 VanDerWaalsContact O-CD2 3.29Å; I133-F137 WeakPolarHBondContact O-CD2 3.48Å; I133-F137 PolarHBondContact O-N 3.25Å; L134-F137 PolarHBondContact O-N 3.08Å; F137-S140 PolarHBondContact O-N 3.39Å; F137-Y141 PolarHBondContact O-N 2.97Å |
| 138 | I | 78 | Confident | 70.5 | Confident | 85 Ų | 85 | 90.6 Ų | 90.6 | 44% | 0.436 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -61.1 | -48.6 | 176 | -70.2 | 166.4 | 0 | 0 | 0 | 110.4 | L134 Y135 S140 Y141 Y142 | L134-I138 HydrophobicContact CG-CD1 3.95Å; L134-I138 WeakPolarHBondContact O-CB 3.4Å; L134-I138 VanDerWaalsContact O-CG1 3.25Å; L134-I138 WeakPolarHBondContact O-CG1 3.26Å; L134-I138 PolarHBondContact O-N 3.19Å; Y135-I138 PolarHBondContact O-N 2.89Å; I138-S140 VanDerWaalsContact C-N 3.32Å; I138-S140 PolarHBondContact O-N 2.83Å; I138-Y141 WeakPolarHBondContact O-CB 3.33Å; I138-Y141 PolarHBondContact O-N 3.45Å; I138-Y141 VanDerWaalsContact O-N 3.11Å; I138-Y142 HydrophobicContact CG2-CD2 4.02Å; I138-Y142 HydrophobicContact CG2-CE2 4.4Å; I138-Y142 WeakPolarHBondContact O-CD2 3.46Å; I138-Y142 PolarHBondContact O-N 3.43Å |
| 139 | L | 71.1 | Confident | 70.3 | Confident | 21 Ų | 21 | 95 Ų | 95 | 11% | 0.11 | 44% | 0.441 | C | S | . | . | H | α-helix | trans | -67.6 | -33.7 | -179.2 | -164.6 | 71.3 | 0 | 0 | 0 | 112.3 | Y135 H136 Y141 Y142 D143 R149 I153 | Y135-L139 WeakPolarHBondContact O-CB 3.32Å; Y135-L139 PolarHBondContact O-N 3.42Å; H136-L139 PolarHBondContact O-N 3.47Å; L139-Y141 PolarHBondContact O-N 2.91Å; L139-Y142 PolarHBondContact O-N 3.19Å; L139-D143 HydrophobicContact CD1-CB 3.76Å; L139-D143 HydrophobicContact CG-CB 4.05Å; L139-D143 PolarHBondContact O-N 3.29Å; L139-D143 VanDerWaalsContact O-N 3.13Å; L139-R149 HydrophobicContact CD2-CB 3.84Å; L139-I153 HydrophobicContact CD2-CD1 3.33Å |
| 140 | S | 70.7 | Confident | 70.3 | Confident | 36 Ų | 36 | 95.5 Ų | 95.5 | 25% | 0.252 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -62.5 | -21.4 | 172.8 | -169.5 | 0 | 0 | 0 | 0 | 113.9 | H136 F137 I138 Y146 | H136-S140 VanDerWaalsContact O-CB 3.3Å; H136-S140 WeakPolarHBondContact O-CB 3.31Å; H136-S140 PolarHBondContact O-N 3.35Å; F137-S140 PolarHBondContact O-N 3.39Å; I138-S140 VanDerWaalsContact C-N 3.32Å; I138-S140 PolarHBondContact O-N 2.83Å; S140-Y146 WeakPolarHBondContact CB-OH 3.45Å; S140-Y146 PolarHBondContact OG-OH 3.4Å |
| 141 | Y | 72.6 | Confident | 70.1 | Confident | 187 Ų | 187 | 96.1 Ų | 96.1 | 73% | 0.733 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -91.7 | -29.1 | 179.1 | -171.5 | -91.8 | 0 | 0 | 0 | 112.7 | F137 I138 L139 | F137-Y141 PolarHBondContact O-N 2.97Å; I138-Y141 WeakPolarHBondContact O-CB 3.33Å; I138-Y141 PolarHBondContact O-N 3.45Å; I138-Y141 VanDerWaalsContact O-N 3.11Å; L139-Y141 PolarHBondContact O-N 2.91Å |
| 142 | Y | 70.6 | Confident | 70 | Confident | 181 Ų | 181 | 98.3 Ų | 98.3 | 71% | 0.71 | 44% | 0.443 | S | S | * | . | H | α-helix | trans | -110.1 | -17.4 | -168.6 | -77.4 | -70.1 | 0 | 0 | 0 | 116.5 | I138 L139 | I138-Y142 HydrophobicContact CG2-CD2 4.02Å; I138-Y142 HydrophobicContact CG2-CE2 4.4Å; I138-Y142 WeakPolarHBondContact O-CD2 3.46Å; I138-Y142 PolarHBondContact O-N 3.43Å; L139-Y142 PolarHBondContact O-N 3.19Å |
| 143 | D | 65.6 | Low | 70 | Confident | 30 Ų | 30 | 97.7 Ų | 97.7 | 16% | 0.16 | 44% | 0.438 | C | S | . | . | trans | -119.4 | 110.8 | -168.7 | -167.8 | -5.8 | 0 | 0 | 0 | 113.9 | L139 H145 Y146 R149 | L139-D143 HydrophobicContact CD1-CB 3.76Å; L139-D143 HydrophobicContact CG-CB 4.05Å; L139-D143 PolarHBondContact O-N 3.29Å; L139-D143 VanDerWaalsContact O-N 3.13Å; D143-H145 PolarHBondContact O-N 2.85Å; D143-H145 WeakPolarHBondContact OD1-CB 3.41Å; D143-H145 PolarHBondContact OD1-N 2.74Å; D143-Y146 WeakPolarHBondContact O-CB 3.15Å; D143-Y146 PolarHBondContact O-N 3.26Å; D143-R149 WeakPolarHBondContact OD2-CD 3.41Å; D143-R149 IonicContact OD2-CZ 3.46Å; D143-R149 IonicContact OD2-NE 3.75Å; D143-R149 IonicContact OD2-NH1 2.91Å; D143-R149 PolarHBondContact OD2-NH1 3.41Å | ||
| 144 | H | 59.6 | Low | 70 | Confident | 202 Ų | 202 | 97 Ų | 97 | 94% | 0.935 | 44% | 0.435 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.1 | -15.1 | 174.4 | -109.2 | -20 | 0 | 0 | 0 | 113.8 | Y146 | H144-Y146 VanDerWaalsContact C-N 3.25Å; H144-Y146 PolarHBondContact O-N 3.1Å |
| 145 | H | 63 | Low | 69.9 | Low | 159 Ų | 159 | 97.3 Ų | 97.3 | 74% | 0.736 | 43% | 0.429 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91.7 | 26.6 | 173.1 | -77.6 | -51.8 | 0 | 0 | 0 | 113.3 | D143 E147 | D143-H145 PolarHBondContact O-N 2.85Å; D143-H145 WeakPolarHBondContact OD1-CB 3.41Å; D143-H145 PolarHBondContact OD1-N 2.74Å; H145-E147 PolarHBondContact O-N 2.88Å |
| 146 | Y | 65.6 | Low | 69.7 | Low | 40 Ų | 40 | 95 Ų | 95 | 16% | 0.157 | 43% | 0.426 | C | S | . | . | H | α-helix | trans | -45.1 | -52.2 | -172.7 | -167.7 | -134.1 | 0 | 0 | 0 | 115.3 | H136 S140 D143 H144 K148 R149 L150 | H136-Y146 PolarHBondContact CE1-OH 2.87Å; H136-Y146 PolarHBondContact NE2-OH 3.4Å; S140-Y146 WeakPolarHBondContact CB-OH 3.45Å; S140-Y146 PolarHBondContact OG-OH 3.4Å; D143-Y146 WeakPolarHBondContact O-CB 3.15Å; D143-Y146 PolarHBondContact O-N 3.26Å; H144-Y146 VanDerWaalsContact C-N 3.25Å; H144-Y146 PolarHBondContact O-N 3.1Å; Y146-K148 PolarHBondContact O-N 2.67Å; Y146-K148 VanDerWaalsContact O-N 3.14Å; Y146-R149 PolarHBondContact O-N 2.84Å; Y146-L150 HydrophobicContact CD1-CB 4.46Å; Y146-L150 HydrophobicContact CD1-CD2 4.09Å; Y146-L150 HydrophobicContact CD2-CB 4.38Å; Y146-L150 HydrophobicContact CE1-CB 4.41Å; Y146-L150 HydrophobicContact CE1-CD1 4.26Å; Y146-L150 HydrophobicContact CE1-CD2 3.67Å; Y146-L150 HydrophobicContact CE1-CG 4.32Å; Y146-L150 HydrophobicContact CE2-CB 4.28Å; Y146-L150 HydrophobicContact CE2-CD1 4.25Å; Y146-L150 HydrophobicContact CG-CB 4.45Å; Y146-L150 WeakPolarHBondContact O-CB 3.37Å; Y146-L150 PolarHBondContact O-N 3.11Å |
| 147 | E | 66.6 | Low | 69.7 | Low | 153 Ų | 153 | 95 Ų | 95 | 72% | 0.715 | 43% | 0.426 | S | S | * | . | H | α-helix | trans | -50.7 | -47 | -164.1 | -58.7 | -176.6 | 146.8 | 0 | 0 | 114.9 | H145 L151 | H145-E147 PolarHBondContact O-N 2.88Å; E147-L151 PolarHBondContact O-N 3.36Å |
| 148 | K | 67.2 | Low | 69.7 | Low | 182 Ų | 182 | 92.2 Ų | 92.2 | 79% | 0.791 | 42% | 0.415 | S | S | * | . | H | α-helix | trans | -75.4 | -29 | -176.6 | -67.7 | -178.8 | -178.2 | 173.7 | 0 | 112.6 | Y146 | Y146-K148 PolarHBondContact O-N 2.67Å; Y146-K148 VanDerWaalsContact O-N 3.14Å |
| 149 | R | 69.1 | Low | 69.6 | Low | 142 Ų | 142 | 92.7 Ų | 92.7 | 54% | 0.536 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -79.8 | -39.3 | 175.8 | -72.2 | 174.9 | 165.5 | -177.5 | -5.2 | 110.9 | L139 D143 Y146 L151 F152 I153 | L139-R149 HydrophobicContact CD2-CB 3.84Å; D143-R149 WeakPolarHBondContact OD2-CD 3.41Å; D143-R149 IonicContact OD2-CZ 3.46Å; D143-R149 IonicContact OD2-NE 3.75Å; D143-R149 IonicContact OD2-NH1 2.91Å; D143-R149 PolarHBondContact OD2-NH1 3.41Å; Y146-R149 PolarHBondContact O-N 2.84Å; R149-L151 PolarHBondContact O-N 3.31Å; R149-F152 PolarHBondContact O-N 3.06Å; R149-F152 VanDerWaalsContact O-N 3.17Å; R149-I153 HydrophobicContact CB-CD1 4.41Å; R149-I153 WeakPolarHBondContact O-CD1 3.45Å; R149-I153 WeakPolarHBondContact O-CG1 2.87Å; R149-I153 PolarHBondContact O-N 2.83Å |
| 150 | L | 68.6 | Low | 69.8 | Low | 25 Ų | 25 | 93.5 Ų | 93.5 | 13% | 0.131 | 42% | 0.421 | C | S | . | . | H | α-helix | trans | -53.4 | -49.9 | 175.2 | 174.2 | 61.5 | 0 | 0 | 0 | 112.2 | H136 Y146 F152 I153 S154 | H136-L150 WeakPolarHBondContact NE2-CD1 3.43Å; Y146-L150 HydrophobicContact CD1-CB 4.46Å; Y146-L150 HydrophobicContact CD1-CD2 4.09Å; Y146-L150 HydrophobicContact CD2-CB 4.38Å; Y146-L150 HydrophobicContact CE1-CB 4.41Å; Y146-L150 HydrophobicContact CE1-CD1 4.26Å; Y146-L150 HydrophobicContact CE1-CD2 3.67Å; Y146-L150 HydrophobicContact CE1-CG 4.32Å; Y146-L150 HydrophobicContact CE2-CB 4.28Å; Y146-L150 HydrophobicContact CE2-CD1 4.25Å; Y146-L150 HydrophobicContact CG-CB 4.45Å; Y146-L150 WeakPolarHBondContact O-CB 3.37Å; Y146-L150 PolarHBondContact O-N 3.11Å; L150-F152 VanDerWaalsContact C-N 3.28Å; L150-F152 PolarHBondContact O-N 3.46Å; L150-I153 PolarHBondContact O-N 2.93Å; L150-S154 VanDerWaalsContact O-CB 3.32Å; L150-S154 WeakPolarHBondContact O-CB 3.38Å; L150-S154 PolarHBondContact O-N 3.29Å; L150-S154 PolarHBondContact O-OG 3.12Å |
| 151 | L | 68.2 | Low | 69.9 | Low | 86 Ų | 86 | 92.6 Ų | 92.6 | 45% | 0.45 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -61.7 | -34.6 | 179.8 | -76.3 | 169 | 0 | 0 | 0 | 112.9 | L15 E147 R149 R155 | L15-L151 HydrophobicContact CD2-CD2 3.6Å; E147-L151 PolarHBondContact O-N 3.36Å; R149-L151 PolarHBondContact O-N 3.31Å; L151-R155 WeakPolarHBondContact O-CB 3.24Å; L151-R155 WeakPolarHBondContact O-CD 3.19Å; L151-R155 VanDerWaalsContact O-CG 3.24Å; L151-R155 WeakPolarHBondContact O-CG 3.48Å; L151-R155 PolarHBondContact O-N 3.02Å |
| 152 | F | 71.7 | Confident | 69.9 | Low | 137 Ų | 137 | 90.8 Ų | 90.8 | 60% | 0.601 | 41% | 0.409 | S | S | * | . | H | α-helix | trans | -73 | -45.1 | 175.9 | -176.8 | -105.1 | 0 | 0 | 0 | 111.8 | R149 L150 R155 L156 | R149-F152 PolarHBondContact O-N 3.06Å; R149-F152 VanDerWaalsContact O-N 3.17Å; L150-F152 VanDerWaalsContact C-N 3.28Å; L150-F152 PolarHBondContact O-N 3.46Å; F152-R155 PolarHBondContact O-N 3.49Å; F152-L156 HydrophobicContact CD1-CD1 3.99Å; F152-L156 HydrophobicContact CE1-CD1 3.49Å; F152-L156 VanDerWaalsContact CE1-CD1 3.49Å; F152-L156 HydrophobicContact CE1-CG 4.27Å; F152-L156 HydrophobicContact CZ-CD1 3.93Å; F152-L156 HydrophobicContact CZ-CG 4.36Å; F152-L156 PolarHBondContact O-N 3.48Å |
| 153 | I | 72.1 | Confident | 70.2 | Confident | 17 Ų | 17 | 86.2 Ų | 86.2 | 9% | 0.087 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -64.2 | -44.5 | 178.8 | -68 | 160.9 | 0 | 0 | 0 | 110.8 | Y135 H136 L139 R149 L150 R155 L156 I157 | Y135-I153 HydrophobicContact CD1-CD1 4.06Å; Y135-I153 HydrophobicContact CD1-CG1 4.46Å; Y135-I153 HydrophobicContact CE1-CD1 3.73Å; Y135-I153 HydrophobicContact CE1-CG1 4.28Å; H136-I153 HydrophobicContact CB-CG2 4.24Å; L139-I153 HydrophobicContact CD2-CD1 3.33Å; R149-I153 HydrophobicContact CB-CD1 4.41Å; R149-I153 WeakPolarHBondContact O-CD1 3.45Å; R149-I153 WeakPolarHBondContact O-CG1 2.87Å; R149-I153 PolarHBondContact O-N 2.83Å; L150-I153 PolarHBondContact O-N 2.93Å; I153-R155 VanDerWaalsContact C-N 3.32Å; I153-R155 PolarHBondContact O-N 2.9Å; I153-L156 PolarHBondContact O-N 3.3Å; I153-L156 VanDerWaalsContact O-N 3.16Å; I153-I157 HydrophobicContact CG2-CD1 3.8Å; I153-I157 HydrophobicContact CG2-CG1 4.41Å; I153-I157 WeakPolarHBondContact O-CB 3.45Å; I153-I157 VanDerWaalsContact O-CG1 3.3Å; I153-I157 WeakPolarHBondContact O-CG1 3.44Å; I153-I157 PolarHBondContact O-N 3.47Å |
| 154 | S | 69.8 | Low | 70.4 | Confident | 8 Ų | 8 | 85.5 Ų | 85.5 | 6% | 0.056 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -63.8 | -36.5 | 177.1 | -55.7 | 0 | 0 | 0 | 0 | 112.1 | L150 I157 I158 | L150-S154 VanDerWaalsContact O-CB 3.32Å; L150-S154 WeakPolarHBondContact O-CB 3.38Å; L150-S154 PolarHBondContact O-N 3.29Å; L150-S154 PolarHBondContact O-OG 3.12Å; S154-I157 PolarHBondContact O-N 3.27Å; S154-I158 WeakPolarHBondContact O-CB 3.48Å; S154-I158 WeakPolarHBondContact O-CD1 3.23Å; S154-I158 VanDerWaalsContact O-CG1 3.27Å; S154-I158 WeakPolarHBondContact O-CG1 3.43Å; S154-I158 PolarHBondContact O-N 2.88Å |
| 155 | R | 75.2 | Confident | 71 | Confident | 108 Ų | 108 | 77.2 Ų | 77.2 | 41% | 0.408 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -66.8 | -38.5 | 172.5 | -78.6 | 173.8 | 172.9 | 169.6 | 0.5 | 112.5 | L15 C18 L151 F152 I153 L159 | L15-R155 PolarHBondContact O-NH2 3.49Å; C18-R155 PolarHBondContact SG-NH2 3.4Å; L151-R155 WeakPolarHBondContact O-CB 3.24Å; L151-R155 WeakPolarHBondContact O-CD 3.19Å; L151-R155 VanDerWaalsContact O-CG 3.24Å; L151-R155 WeakPolarHBondContact O-CG 3.48Å; L151-R155 PolarHBondContact O-N 3.02Å; F152-R155 PolarHBondContact O-N 3.49Å; I153-R155 VanDerWaalsContact C-N 3.32Å; I153-R155 PolarHBondContact O-N 2.9Å; R155-L159 WeakPolarHBondContact O-CB 3.34Å; R155-L159 PolarHBondContact O-N 3.48Å |
| 156 | L | 72.7 | Confident | 71.6 | Confident | 86 Ų | 86 | 75.4 Ų | 75.4 | 45% | 0.45 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -66.6 | -41.8 | 172.7 | -73 | 177.2 | 0 | 0 | 0 | 112.2 | F152 I153 L159 H160 | F152-L156 HydrophobicContact CD1-CD1 3.99Å; F152-L156 HydrophobicContact CE1-CD1 3.49Å; F152-L156 VanDerWaalsContact CE1-CD1 3.49Å; F152-L156 HydrophobicContact CE1-CG 4.27Å; F152-L156 HydrophobicContact CZ-CD1 3.93Å; F152-L156 HydrophobicContact CZ-CG 4.36Å; F152-L156 PolarHBondContact O-N 3.48Å; I153-L156 PolarHBondContact O-N 3.3Å; I153-L156 VanDerWaalsContact O-N 3.16Å; L156-L159 PolarHBondContact O-N 3.27Å; L156-H160 WeakPolarHBondContact O-CB 3.33Å; L156-H160 PolarHBondContact O-N 2.85Å |
| 157 | I | 72.5 | Confident | 71.9 | Confident | 4 Ų | 4 | 77.6 Ų | 77.6 | 2% | 0.021 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -56.9 | -51.5 | 174.1 | -73.7 | 167.7 | 0 | 0 | 0 | 110.2 | P132 H136 I153 S154 L159 H160 Y161 | P132-I157 HydrophobicContact CB-CD1 4.33Å; P132-I157 HydrophobicContact CB-CG1 3.75Å; P132-I157 HydrophobicContact CG-CG1 4.09Å; H136-I157 HydrophobicContact CB-CD1 4.29Å; I153-I157 HydrophobicContact CG2-CD1 3.8Å; I153-I157 HydrophobicContact CG2-CG1 4.41Å; I153-I157 WeakPolarHBondContact O-CB 3.45Å; I153-I157 VanDerWaalsContact O-CG1 3.3Å; I153-I157 WeakPolarHBondContact O-CG1 3.44Å; I153-I157 PolarHBondContact O-N 3.47Å; S154-I157 PolarHBondContact O-N 3.27Å; I157-L159 PolarHBondContact O-N 2.91Å; I157-H160 WeakPolarHBondContact O-CB 3.48Å; I157-H160 PolarHBondContact O-N 3.45Å; I157-Y161 HydrophobicContact CG2-CD2 3.68Å; I157-Y161 HydrophobicContact CG2-CE2 3.44Å; I157-Y161 VanDerWaalsContact CG2-CE2 3.44Å; I157-Y161 WeakPolarHBondContact O-CD2 3.48Å; I157-Y161 PolarHBondContact O-N 3.33Å |
| 158 | I | 73.3 | Confident | 72.1 | Confident | 48 Ų | 48 | 71.2 Ų | 71.2 | 25% | 0.246 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -61.1 | -44.2 | 178.2 | -70.2 | 164.4 | 0 | 0 | 0 | 111.5 | L72 S154 H160 Y161 F162 | L72-I158 HydrophobicContact CD1-CD1 4.38Å; L72-I158 HydrophobicContact CD2-CD1 3.97Å; L72-I158 HydrophobicContact CG-CD1 4.12Å; S154-I158 WeakPolarHBondContact O-CB 3.48Å; S154-I158 WeakPolarHBondContact O-CD1 3.23Å; S154-I158 VanDerWaalsContact O-CG1 3.27Å; S154-I158 WeakPolarHBondContact O-CG1 3.43Å; S154-I158 PolarHBondContact O-N 2.88Å; I158-H160 VanDerWaalsContact C-N 3.3Å; I158-H160 PolarHBondContact O-N 2.83Å; I158-Y161 PolarHBondContact O-N 3.32Å; I158-F162 HydrophobicContact CG2-CD2 3.83Å; I158-F162 HydrophobicContact CG2-CE2 3.66Å; I158-F162 VanDerWaalsContact O-CD2 3.26Å; I158-F162 WeakPolarHBondContact O-CD2 3.33Å; I158-F162 PolarHBondContact O-N 2.93Å; I158-F162 VanDerWaalsContact O-N 3.13Å |
| 159 | L | 76.3 | Confident | 72.4 | Confident | 94 Ų | 94 | 68.1 Ų | 68.1 | 49% | 0.492 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -61.1 | -40.2 | 177.7 | -177.7 | 63.2 | 0 | 0 | 0 | 111.7 | R155 L156 I157 F162 I163 | R155-L159 WeakPolarHBondContact O-CB 3.34Å; R155-L159 PolarHBondContact O-N 3.48Å; L156-L159 PolarHBondContact O-N 3.27Å; I157-L159 PolarHBondContact O-N 2.91Å; L159-F162 PolarHBondContact O-N 3.03Å; L159-I163 HydrophobicContact CD1-CD1 3.96Å; L159-I163 HydrophobicContact CD1-CG1 4.43Å; L159-I163 HydrophobicContact CG-CD1 3.85Å; L159-I163 WeakPolarHBondContact O-CG1 3.41Å; L159-I163 PolarHBondContact O-N 2.71Å |
| 160 | H | 74.9 | Confident | 72.7 | Confident | 39 Ų | 39 | 66.8 Ų | 66.8 | 18% | 0.181 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -63.1 | -47.5 | 176.2 | -168.6 | 33.1 | 0 | 0 | 0 | 111.5 | S128 L156 I157 I158 F162 I163 D164 | S128-H160 VanDerWaalsContact C-NE2 3.33Å; S128-H160 WeakPolarHBondContact CB-NE2 3.23Å; S128-H160 PolarHBondContact O-NE2 3.5Å; S128-H160 PolarHBondContact OG-CE1 3.07Å; S128-H160 PolarHBondContact OG-NE2 2.92Å; L156-H160 WeakPolarHBondContact O-CB 3.33Å; L156-H160 PolarHBondContact O-N 2.85Å; I157-H160 WeakPolarHBondContact O-CB 3.48Å; I157-H160 PolarHBondContact O-N 3.45Å; I158-H160 VanDerWaalsContact C-N 3.3Å; I158-H160 PolarHBondContact O-N 2.83Å; H160-F162 PolarHBondContact O-N 2.82Å; H160-I163 PolarHBondContact O-N 3.12Å; H160-I163 VanDerWaalsContact O-N 3.09Å; H160-D164 IonicContact CE1-OD1 3.57Å; H160-D164 PolarHBondContact CE1-OD1 3.21Å; H160-D164 IonicContact CE1-OD2 3.01Å; H160-D164 PolarHBondContact CE1-OD2 2.84Å; H160-D164 IonicContact ND1-OD1 2.67Å; H160-D164 PolarHBondContact ND1-OD1 3.38Å; H160-D164 IonicContact ND1-OD2 2.92Å; H160-D164 IonicContact NE2-OD2 3.52Å; H160-D164 PolarHBondContact NE2-OD2 3.47Å; H160-D164 PolarHBondContact O-N 3.46Å |
| 161 | Y | 71.9 | Confident | 72.8 | Confident | 17 Ų | 17 | 68 Ų | 68 | 7% | 0.067 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -56.9 | -29 | 173.5 | -82.8 | -66.3 | 0 | 0 | 0 | 114.2 | P76 L77 Q80 L129 I157 I158 P165 | P76-Y161 VanDerWaalsContact C-CE1 3.46Å; P76-Y161 HydrophobicContact CB-CD1 3.71Å; P76-Y161 HydrophobicContact CB-CD2 3.44Å; P76-Y161 VanDerWaalsContact CB-CD2 3.44Å; P76-Y161 HydrophobicContact CB-CE1 3.9Å; P76-Y161 HydrophobicContact CB-CE2 3.65Å; P76-Y161 HydrophobicContact CB-CG 3.51Å; P76-Y161 HydrophobicContact CG-CD2 4.32Å; P76-Y161 WeakPolarHBondContact O-CE1 3.29Å; L77-Y161 WeakPolarHBondContact CA-OH 3.39Å; L77-Y161 WeakPolarHBondContact CB-OH 3.48Å; Q80-Y161 HydrophobicContact CB-CD1 4.1Å; Q80-Y161 HydrophobicContact CB-CE1 3.89Å; Q80-Y161 HydrophobicContact CG-CE1 4.45Å; L129-Y161 HydrophobicContact CD1-CD1 3.7Å; L129-Y161 HydrophobicContact CD1-CE1 3.24Å; L129-Y161 HydrophobicContact CD1-CE2 4.45Å; L129-Y161 HydrophobicContact CD1-CG 4.44Å; L129-Y161 HydrophobicContact CD2-CE1 4.06Å; L129-Y161 HydrophobicContact CG-CE1 3.98Å; I157-Y161 HydrophobicContact CG2-CD2 3.68Å; I157-Y161 HydrophobicContact CG2-CE2 3.44Å; I157-Y161 VanDerWaalsContact CG2-CE2 3.44Å; I157-Y161 WeakPolarHBondContact O-CD2 3.48Å; I157-Y161 PolarHBondContact O-N 3.33Å; I158-Y161 PolarHBondContact O-N 3.32Å; Y161-P165 WeakPolarHBondContact O-CD 3.09Å; Y161-P165 WeakPolarHBondContact O-CG 3.17Å |
| 162 | F | 74.2 | Confident | 72.8 | Confident | 148 Ų | 148 | 65.6 Ų | 65.6 | 65% | 0.649 | 32% | 0.316 | S | S | * | . | H | α-helix | trans | -82.8 | -32.8 | 174.7 | -81.1 | -65.2 | 0 | 0 | 0 | 113.6 | I158 L159 H160 I166 | I158-F162 HydrophobicContact CG2-CD2 3.83Å; I158-F162 HydrophobicContact CG2-CE2 3.66Å; I158-F162 VanDerWaalsContact O-CD2 3.26Å; I158-F162 WeakPolarHBondContact O-CD2 3.33Å; I158-F162 PolarHBondContact O-N 2.93Å; I158-F162 VanDerWaalsContact O-N 3.13Å; L159-F162 PolarHBondContact O-N 3.03Å; H160-F162 PolarHBondContact O-N 2.82Å; F162-I166 VanDerWaalsContact O-CD1 3.29Å; F162-I166 WeakPolarHBondContact O-CD1 3.29Å; F162-I166 WeakPolarHBondContact O-CG1 3.42Å |
| 163 | I | 76.3 | Confident | 73 | Confident | 86 Ų | 86 | 65.2 Ų | 65.2 | 44% | 0.441 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -78.7 | -41.5 | -177.5 | -69.5 | 171.5 | 0 | 0 | 0 | 111.3 | L159 H160 I166 L167 | L159-I163 HydrophobicContact CD1-CD1 3.96Å; L159-I163 HydrophobicContact CD1-CG1 4.43Å; L159-I163 HydrophobicContact CG-CD1 3.85Å; L159-I163 WeakPolarHBondContact O-CG1 3.41Å; L159-I163 PolarHBondContact O-N 2.71Å; H160-I163 PolarHBondContact O-N 3.12Å; H160-I163 VanDerWaalsContact O-N 3.09Å; I163-I166 WeakPolarHBondContact O-CB 3.44Å; I163-I166 PolarHBondContact O-N 2.82Å; I163-I166 VanDerWaalsContact O-N 3.14Å; I163-L167 WeakPolarHBondContact O-CB 3.4Å; I163-L167 PolarHBondContact O-N 3.37Å |
| 164 | D | 70.5 | Confident | 73 | Confident | 14 Ų | 14 | 70.2 Ų | 70.2 | 8% | 0.075 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -63 | -47.8 | -169.7 | -83.1 | 25.3 | 0 | 0 | 0 | 114.2 | E125 H160 I166 L167 L168 | E125-D164 HydrophobicContact CG-CB 4.23Å; H160-D164 IonicContact CE1-OD1 3.57Å; H160-D164 PolarHBondContact CE1-OD1 3.21Å; H160-D164 IonicContact CE1-OD2 3.01Å; H160-D164 PolarHBondContact CE1-OD2 2.84Å; H160-D164 IonicContact ND1-OD1 2.67Å; H160-D164 PolarHBondContact ND1-OD1 3.38Å; H160-D164 IonicContact ND1-OD2 2.92Å; H160-D164 IonicContact NE2-OD2 3.52Å; H160-D164 PolarHBondContact NE2-OD2 3.47Å; H160-D164 PolarHBondContact O-N 3.46Å; D164-I166 PolarHBondContact O-N 2.81Å; D164-L167 PolarHBondContact O-N 2.8Å; D164-L167 VanDerWaalsContact O-N 3.14Å; D164-L168 WeakPolarHBondContact O-CB 3.36Å; D164-L168 PolarHBondContact O-N 3.3Å |
| 165 | P | 70.2 | Confident | 72.8 | Confident | 29 Ų | 29 | 72 Ų | 72 | 19% | 0.188 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -56.5 | -36.8 | 173 | -27.5 | 35.7 | 0 | 0 | 0 | 113.6 | I83 Y161 L169 | I83-P165 HydrophobicContact CD1-CG 4.31Å; Y161-P165 WeakPolarHBondContact O-CD 3.09Å; Y161-P165 WeakPolarHBondContact O-CG 3.17Å; P165-L169 WeakPolarHBondContact O-CB 3.42Å; P165-L169 PolarHBondContact O-N 3.41Å |
| 166 | I | 75.7 | Confident | 72.4 | Confident | 120 Ų | 120 | 70.3 Ų | 70.3 | 62% | 0.615 | 35% | 0.348 | S | S | * | . | H | α-helix | trans | -72.5 | -40.5 | -179.9 | -58.5 | 176.9 | 0 | 0 | 0 | 109.7 | F162 I163 D164 Y170 | F162-I166 VanDerWaalsContact O-CD1 3.29Å; F162-I166 WeakPolarHBondContact O-CD1 3.29Å; F162-I166 WeakPolarHBondContact O-CG1 3.42Å; I163-I166 WeakPolarHBondContact O-CB 3.44Å; I163-I166 PolarHBondContact O-N 2.82Å; I163-I166 VanDerWaalsContact O-N 3.14Å; D164-I166 PolarHBondContact O-N 2.81Å; I166-Y170 WeakPolarHBondContact O-CB 3.29Å; I166-Y170 PolarHBondContact O-N 3.1Å |
| 167 | L | 73.6 | Confident | 71.9 | Confident | 87 Ų | 87 | 69.3 Ų | 69.3 | 46% | 0.455 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -67.8 | -45.7 | 176.5 | -175.9 | 61.8 | 0 | 0 | 0 | 111.6 | I163 D164 Y170 L171 | I163-L167 WeakPolarHBondContact O-CB 3.4Å; I163-L167 PolarHBondContact O-N 3.37Å; D164-L167 PolarHBondContact O-N 2.8Å; D164-L167 VanDerWaalsContact O-N 3.14Å; L167-Y170 PolarHBondContact O-N 2.99Å; L167-L171 HydrophobicContact CD1-CD1 4.15Å; L167-L171 HydrophobicContact CD1-CG 4.26Å; L167-L171 HydrophobicContact CG-CD1 3.99Å; L167-L171 HydrophobicContact CG-CG 4.48Å; L167-L171 WeakPolarHBondContact O-CB 3.44Å; L167-L171 VanDerWaalsContact O-CG 3.24Å; L167-L171 WeakPolarHBondContact O-CG 3.31Å; L167-L171 PolarHBondContact O-N 3.49Å |
| 168 | L | 71.2 | Confident | 71.4 | Confident | 19 Ų | 19 | 74.2 Ų | 74.2 | 10% | 0.099 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -58.7 | -49.4 | 173.8 | 177.4 | 64.8 | 0 | 0 | 0 | 110.7 | E125 D164 Y170 L171 L172 | E125-L168 WeakPolarHBondContact OE2-CD2 3.4Å; D164-L168 WeakPolarHBondContact O-CB 3.36Å; D164-L168 PolarHBondContact O-N 3.3Å; L168-Y170 PolarHBondContact O-N 3.5Å; L168-L171 PolarHBondContact O-N 3.49Å; L168-L172 VanDerWaalsContact O-CB 3.23Å; L168-L172 WeakPolarHBondContact O-CB 3.35Å; L168-L172 PolarHBondContact O-N 3.09Å |
| 169 | L | 72.2 | Confident | 70.7 | Confident | 116 Ų | 116 | 80.4 Ų | 80.4 | 61% | 0.607 | 40% | 0.399 | S | S | * | . | H | α-helix | trans | -62.7 | -41.8 | 178.6 | -177.5 | 62.2 | 0 | 0 | 0 | 111.8 | P165 Q173 | P165-L169 WeakPolarHBondContact O-CB 3.42Å; P165-L169 PolarHBondContact O-N 3.41Å; L169-Q173 WeakPolarHBondContact O-CB 3.49Å; L169-Q173 PolarHBondContact O-N 3.02Å |
| 170 | Y | 75.6 | Confident | 69.7 | Low | 115 Ų | 115 | 84 Ų | 84 | 45% | 0.451 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -64.4 | -43 | 175.5 | 174.1 | -97.2 | 0 | 0 | 0 | 112 | I166 L167 L168 Q173 K174 | I166-Y170 WeakPolarHBondContact O-CB 3.29Å; I166-Y170 PolarHBondContact O-N 3.1Å; L167-Y170 PolarHBondContact O-N 2.99Å; L168-Y170 PolarHBondContact O-N 3.5Å; Y170-Q173 PolarHBondContact O-N 3.3Å; Y170-K174 HydrophobicContact CE1-CD 3.83Å; Y170-K174 WeakPolarHBondContact O-CB 3.25Å; Y170-K174 PolarHBondContact O-N 3.08Å; Y170-K174 PolarHBondContact OH-NZ 3.02Å; Y170-K174 VanDerWaalsContact OH-NZ 3.1Å |
| 171 | L | 70.6 | Confident | 68.8 | Low | 49 Ų | 49 | 84.9 Ų | 84.9 | 26% | 0.257 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -68.2 | -41.7 | 177.5 | -72.3 | 173.1 | 0 | 0 | 0 | 111.8 | L121 L167 L168 K174 C175 | L121-L171 HydrophobicContact CD1-CB 4.46Å; L121-L171 HydrophobicContact CD1-CD1 4.17Å; L121-L171 HydrophobicContact CD2-CD1 3.99Å; L167-L171 HydrophobicContact CD1-CD1 4.15Å; L167-L171 HydrophobicContact CD1-CG 4.26Å; L167-L171 HydrophobicContact CG-CD1 3.99Å; L167-L171 HydrophobicContact CG-CG 4.48Å; L167-L171 WeakPolarHBondContact O-CB 3.44Å; L167-L171 VanDerWaalsContact O-CG 3.24Å; L167-L171 WeakPolarHBondContact O-CG 3.31Å; L167-L171 PolarHBondContact O-N 3.49Å; L168-L171 PolarHBondContact O-N 3.49Å; L171-K174 PolarHBondContact O-N 2.98Å; L171-C175 WeakPolarHBondContact O-CB 3.47Å; L171-C175 PolarHBondContact O-N 3.3Å; L171-C175 PolarHBondContact O-SG 3.35Å |
| 172 | L | 69.3 | Low | 68 | Low | 37 Ų | 37 | 88.2 Ų | 88.2 | 19% | 0.194 | 43% | 0.433 | C | S | . | . | H | α-helix | trans | -61.6 | -47.4 | 173.5 | -170.5 | 74.6 | 0 | 0 | 0 | 110.5 | L91 I118 L168 K174 C175 L176 | L91-L172 HydrophobicContact CD2-CD1 4.23Å; I118-L172 HydrophobicContact CD1-CD1 4.39Å; L168-L172 VanDerWaalsContact O-CB 3.23Å; L168-L172 WeakPolarHBondContact O-CB 3.35Å; L168-L172 PolarHBondContact O-N 3.09Å; L172-K174 VanDerWaalsContact C-N 3.29Å; L172-K174 PolarHBondContact O-N 3.31Å; L172-C175 PolarHBondContact O-N 2.98Å; L172-L176 HydrophobicContact CG-CD1 4.09Å; L172-L176 WeakPolarHBondContact O-CB 3.29Å; L172-L176 VanDerWaalsContact O-CG 3.31Å; L172-L176 WeakPolarHBondContact O-CG 3.5Å; L172-L176 PolarHBondContact O-N 3Å |
| 173 | Q | 74.5 | Confident | 67.1 | Low | 129 Ų | 129 | 86.4 Ų | 86.4 | 60% | 0.603 | 43% | 0.429 | S | S | * | . | H | α-helix | trans | -59 | -39.9 | 173.8 | -172 | -173.2 | 25.3 | 0 | 0 | 111.3 | L169 Y170 L176 S177 | L169-Q173 WeakPolarHBondContact O-CB 3.49Å; L169-Q173 PolarHBondContact O-N 3.02Å; Y170-Q173 PolarHBondContact O-N 3.3Å; Q173-L176 PolarHBondContact O-N 3.43Å; Q173-S177 WeakPolarHBondContact O-CA 3.09Å; Q173-S177 WeakPolarHBondContact O-CB 3.36Å; Q173-S177 PolarHBondContact O-N 3.28Å |
| 174 | K | 73 | Confident | 66.2 | Low | 122 Ų | 122 | 84.9 Ų | 84.9 | 53% | 0.53 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -70.5 | -37 | 179.2 | -165.1 | 168.6 | -172.4 | 168.2 | 0 | 112.4 | Y170 L171 L172 | Y170-K174 HydrophobicContact CE1-CD 3.83Å; Y170-K174 WeakPolarHBondContact O-CB 3.25Å; Y170-K174 PolarHBondContact O-N 3.08Å; Y170-K174 PolarHBondContact OH-NZ 3.02Å; Y170-K174 VanDerWaalsContact OH-NZ 3.1Å; L171-K174 PolarHBondContact O-N 2.98Å; L172-K174 VanDerWaalsContact C-N 3.29Å; L172-K174 PolarHBondContact O-N 3.31Å |
| 175 | C | 66.3 | Low | 65.6 | Low | 46 Ų | 46 | 87.1 Ų | 87.1 | 31% | 0.311 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -65.1 | -43.5 | 172 | -68.4 | 0 | 0 | 0 | 0 | 111.6 | L171 L172 N178 | L171-C175 WeakPolarHBondContact O-CB 3.47Å; L171-C175 PolarHBondContact O-N 3.3Å; L171-C175 PolarHBondContact O-SG 3.35Å; L172-C175 PolarHBondContact O-N 2.98Å; C175-N178 VanDerWaalsContact O-CB 3.27Å; C175-N178 WeakPolarHBondContact O-CB 3.37Å |
| 176 | L | 65.1 | Low | 65.1 | Low | 71 Ų | 71 | 90.7 Ų | 90.7 | 37% | 0.372 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -74.9 | -31.2 | 178 | -67.3 | 171 | 0 | 0 | 0 | 113.2 | L172 Q173 N178 F181 | L172-L176 HydrophobicContact CG-CD1 4.09Å; L172-L176 WeakPolarHBondContact O-CB 3.29Å; L172-L176 VanDerWaalsContact O-CG 3.31Å; L172-L176 WeakPolarHBondContact O-CG 3.5Å; L172-L176 PolarHBondContact O-N 3Å; Q173-L176 PolarHBondContact O-N 3.43Å; L176-N178 PolarHBondContact O-N 2.99Å; L176-F181 HydrophobicContact CD2-CD2 4.36Å; L176-F181 HydrophobicContact CD2-CE1 4.34Å; L176-F181 HydrophobicContact CD2-CE2 4.13Å; L176-F181 HydrophobicContact CD2-CZ 4.12Å; L176-F181 WeakPolarHBondContact O-CB 3.42Å |
| 177 | S | 63.3 | Low | 64.5 | Low | 65 Ų | 65 | 90.4 Ų | 90.4 | 46% | 0.455 | 45% | 0.45 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -73.6 | -6.9 | 178.1 | -171.7 | 0 | 0 | 0 | 0 | 113 | Q173 K179 | Q173-S177 WeakPolarHBondContact O-CA 3.09Å; Q173-S177 WeakPolarHBondContact O-CB 3.36Å; Q173-S177 PolarHBondContact O-N 3.28Å; S177-K179 PolarHBondContact O-N 3.39Å; S177-K179 VanDerWaalsContact O-N 3.1Å |
| 178 | N | 62.2 | Low | 63.8 | Low | 107 Ų | 107 | 88.8 Ų | 88.8 | 57% | 0.572 | 44% | 0.439 | S | S | * | . | S | Bend | trans | -53.2 | 119 | 169.9 | -168.8 | -17.3 | 0 | 0 | 0 | 109.7 | C175 L176 K180 F181 | C175-N178 VanDerWaalsContact O-CB 3.27Å; C175-N178 WeakPolarHBondContact O-CB 3.37Å; L176-N178 PolarHBondContact O-N 2.99Å; N178-K180 PolarHBondContact O-N 3.21Å; N178-F181 PolarHBondContact O-N 2.95Å |
| 179 | K | 57.2 | Low | 63.6 | Low | 178 Ų | 178 | 92.1 Ų | 92.1 | 77% | 0.774 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -48.8 | -26.4 | -157.5 | -66.1 | -178.1 | 179 | 178.8 | 0 | 115.7 | S177 F181 I182 L183 | S177-K179 PolarHBondContact O-N 3.39Å; S177-K179 VanDerWaalsContact O-N 3.1Å; K179-F181 VanDerWaalsContact C-N 3.31Å; K179-F181 PolarHBondContact O-N 2.78Å; K179-I182 PolarHBondContact O-N 2.94Å; K179-L183 WeakPolarHBondContact O-CB 3.44Å; K179-L183 PolarHBondContact O-N 2.89Å |
| 180 | K | 56.6 | Low | 63.2 | Low | 169 Ų | 169 | 93.2 Ų | 93.2 | 74% | 0.735 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -55.2 | -40.2 | 174 | -64 | -177.4 | 178.3 | -178 | 0 | 112.8 | N178 L184 | N178-K180 PolarHBondContact O-N 3.21Å; K180-L184 WeakPolarHBondContact O-CB 3.27Å; K180-L184 PolarHBondContact O-N 3.27Å |
| 181 | F | 55.6 | Low | 62.7 | Low | 59 Ų | 59 | 94.4 Ų | 94.4 | 26% | 0.259 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -74.5 | -37.3 | -178.7 | -138.3 | -87.2 | 0 | 0 | 0 | 112.4 | M94 L176 N178 K179 L184 S185 | M94-F181 HydrophobicContact CE-CE1 3.97Å; M94-F181 HydrophobicContact CE-CZ 3.71Å; L176-F181 HydrophobicContact CD2-CD2 4.36Å; L176-F181 HydrophobicContact CD2-CE1 4.34Å; L176-F181 HydrophobicContact CD2-CE2 4.13Å; L176-F181 HydrophobicContact CD2-CZ 4.12Å; L176-F181 WeakPolarHBondContact O-CB 3.42Å; N178-F181 PolarHBondContact O-N 2.95Å; K179-F181 VanDerWaalsContact C-N 3.31Å; K179-F181 PolarHBondContact O-N 2.78Å; F181-L184 CarbonylContact O-C 3.59Å; F181-L184 WeakPolarHBondContact O-CB 3.26Å; F181-L184 PolarHBondContact O-N 3Å; F181-L184 VanDerWaalsContact O-N 3.16Å; F181-S185 PolarHBondContact O-N 3.46Å |
| 182 | I | 56 | Low | 62.5 | Low | 87 Ų | 87 | 96.3 Ų | 96.3 | 45% | 0.446 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -64.9 | -43.1 | 174.5 | -61.1 | 173.5 | 0 | 0 | 0 | 110.2 | K179 L184 S185 N186 | K179-I182 PolarHBondContact O-N 2.94Å; I182-L184 VanDerWaalsContact C-N 3.26Å; I182-L184 PolarHBondContact O-N 3.36Å; I182-S185 PolarHBondContact O-N 2.91Å; I182-N186 PolarHBondContact O-N 3.19Å; I182-N186 VanDerWaalsContact O-N 3.09Å |
| 183 | L | 55 | Low | 62.5 | Low | 110 Ų | 110 | 100.3 Ų | 100.3 | 58% | 0.576 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -60.3 | -38.2 | 172.2 | -168.4 | 75.7 | 0 | 0 | 0 | 111.6 | K179 K187 | K179-L183 WeakPolarHBondContact O-CB 3.44Å; K179-L183 PolarHBondContact O-N 2.89Å; L183-K187 PolarHBondContact O-N 2.79Å; L183-K187 VanDerWaalsContact O-N 3.08Å |
| 184 | L | 56.3 | Low | 62.3 | Low | 54 Ų | 54 | 99.4 Ų | 99.4 | 28% | 0.283 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -66.1 | -44 | 176.1 | -145.7 | 81.7 | 0 | 0 | 0 | 111.9 | L108 K180 F181 I182 N186 K187 F188 | L108-L184 HydrophobicContact CD1-CD1 3.77Å; L108-L184 HydrophobicContact CD1-CD2 3.6Å; L108-L184 HydrophobicContact CD1-CG 4.3Å; L108-L184 HydrophobicContact CD2-CD2 3.72Å; L108-L184 HydrophobicContact CG-CD2 4.32Å; K180-L184 WeakPolarHBondContact O-CB 3.27Å; K180-L184 PolarHBondContact O-N 3.27Å; F181-L184 CarbonylContact O-C 3.59Å; F181-L184 WeakPolarHBondContact O-CB 3.26Å; F181-L184 PolarHBondContact O-N 3Å; F181-L184 VanDerWaalsContact O-N 3.16Å; I182-L184 VanDerWaalsContact C-N 3.26Å; I182-L184 PolarHBondContact O-N 3.36Å; L184-N186 PolarHBondContact O-N 3.46Å; L184-K187 CarbonylContact O-C 3.6Å; L184-K187 PolarHBondContact O-N 2.81Å; L184-F188 VanDerWaalsContact O-CB 3.31Å; L184-F188 WeakPolarHBondContact O-CB 3.35Å; L184-F188 PolarHBondContact O-N 3.14Å |
| 185 | S | 58.9 | Low | 62.1 | Low | 61 Ų | 61 | 99.2 Ų | 99.2 | 43% | 0.427 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -58.4 | -45.9 | 176.8 | -175.7 | 0 | 0 | 0 | 0 | 111.8 | F181 I182 F188 N189 | F181-S185 PolarHBondContact O-N 3.46Å; I182-S185 PolarHBondContact O-N 2.91Å; S185-F188 PolarHBondContact O-N 3.35Å; S185-N189 PolarHBondContact O-N 2.88Å |
| 186 | N | 59.1 | Low | 62.6 | Low | 104 Ų | 104 | 102.9 Ų | 102.9 | 56% | 0.556 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -63.1 | -44.4 | 176.2 | -75.8 | -4.5 | 0 | 0 | 0 | 112.1 | I182 L184 F188 N189 Q190 | I182-N186 PolarHBondContact O-N 3.19Å; I182-N186 VanDerWaalsContact O-N 3.09Å; L184-N186 PolarHBondContact O-N 3.46Å; N186-F188 VanDerWaalsContact C-N 3.32Å; N186-F188 PolarHBondContact O-N 2.86Å; N186-N189 PolarHBondContact O-N 2.76Å; N186-Q190 PolarHBondContact O-N 3.06Å |
| 187 | K | 63.5 | Low | 62.8 | Low | 114 Ų | 114 | 104.6 Ų | 104.6 | 50% | 0.496 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -63.6 | -36.7 | 173.4 | -75.8 | -169.3 | 173 | -168.9 | 0 | 112.4 | L183 L184 Q190 Y191 | L183-K187 PolarHBondContact O-N 2.79Å; L183-K187 VanDerWaalsContact O-N 3.08Å; L184-K187 CarbonylContact O-C 3.6Å; L184-K187 PolarHBondContact O-N 2.81Å; K187-Q190 WeakPolarHBondContact O-CB 3.27Å; K187-Q190 PolarHBondContact O-N 3.29Å; K187-Y191 WeakPolarHBondContact O-CD2 3.5Å; K187-Y191 PolarHBondContact O-N 2.83Å |
| 188 | F | 59.4 | Low | 63.1 | Low | 52 Ų | 52 | 106.1 Ų | 106.1 | 23% | 0.228 | 51% | 0.512 | C | S | . | . | H | α-helix | trans | -68.6 | -40.2 | 179.4 | -158.3 | -81.6 | 0 | 0 | 0 | 111.7 | Y97 K101 L103 L184 S185 N186 Q190 Y191 H192 | Y97-F188 HydrophobicContact CE1-CE2 4.42Å; Y97-F188 HydrophobicContact CE1-CZ 4.21Å; Y97-F188 AromaticContact CZ-CZ 3.98Å; Y97-F188 WeakPolarHBondContact OH-CE1 3.4Å; Y97-F188 WeakPolarHBondContact OH-CZ 3.18Å; K101-F188 HydrophobicContact CD-CE2 4.24Å; K101-F188 HydrophobicContact CD-CZ 3.77Å; L103-F188 HydrophobicContact CD1-CE2 4.49Å; L103-F188 HydrophobicContact CD2-CD2 4.25Å; L103-F188 HydrophobicContact CD2-CE2 4.42Å; L184-F188 VanDerWaalsContact O-CB 3.31Å; L184-F188 WeakPolarHBondContact O-CB 3.35Å; L184-F188 PolarHBondContact O-N 3.14Å; S185-F188 PolarHBondContact O-N 3.35Å; N186-F188 VanDerWaalsContact C-N 3.32Å; N186-F188 PolarHBondContact O-N 2.86Å; F188-Q190 VanDerWaalsContact C-N 3.34Å; F188-Y191 PolarHBondContact O-N 3.07Å; F188-H192 VanDerWaalsContact O-CB 3.26Å; F188-H192 WeakPolarHBondContact O-CB 3.3Å; F188-H192 PolarHBondContact O-N 3.31Å |
| 189 | N | 65.4 | Low | 63.5 | Low | 89 Ų | 89 | 108.1 Ų | 108.1 | 48% | 0.476 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -62 | -40.9 | 170.1 | -83.6 | -33.4 | 0 | 0 | 0 | 111.9 | S185 N186 H192 M193 | S185-N189 PolarHBondContact O-N 2.88Å; N186-N189 PolarHBondContact O-N 2.76Å; N189-H192 PolarHBondContact O-N 3.12Å; N189-M193 WeakPolarHBondContact O-CG 3.35Å; N189-M193 PolarHBondContact O-N 2.95Å |
| 190 | Q | 64.8 | Low | 64.1 | Low | 140 Ų | 140 | 106.6 Ų | 106.6 | 65% | 0.654 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -62.7 | -46.7 | 175.7 | -164.3 | 175.4 | 14.2 | 0 | 0 | 111.9 | N186 K187 F188 H192 M193 M194 | N186-Q190 PolarHBondContact O-N 3.06Å; K187-Q190 WeakPolarHBondContact O-CB 3.27Å; K187-Q190 PolarHBondContact O-N 3.29Å; F188-Q190 VanDerWaalsContact C-N 3.34Å; Q190-H192 PolarHBondContact O-N 3.42Å; Q190-M193 PolarHBondContact O-N 3.42Å; Q190-M194 WeakPolarHBondContact O-CB 3.3Å; Q190-M194 PolarHBondContact O-N 3.14Å |
| 191 | Y | 64.3 | Low | 64.2 | Low | 140 Ų | 140 | 103 Ų | 103 | 55% | 0.549 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -63.3 | -38.7 | 173.5 | -79.3 | -60.7 | 0 | 0 | 0 | 112.8 | K187 F188 M194 M195 | K187-Y191 WeakPolarHBondContact O-CD2 3.5Å; K187-Y191 PolarHBondContact O-N 2.83Å; F188-Y191 PolarHBondContact O-N 3.07Å; Y191-M194 PolarHBondContact O-N 3.41Å; Y191-M195 WeakPolarHBondContact O-CB 3.33Å; Y191-M195 PolarHBondContact O-N 3.04Å |
| 192 | H | 68 | Low | 64.3 | Low | 88 Ų | 88 | 107 Ų | 107 | 41% | 0.407 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -66.8 | -39.8 | 177.8 | 179.2 | -143.4 | 0 | 0 | 0 | 112 | F188 N189 Q190 M195 K196 | F188-H192 VanDerWaalsContact O-CB 3.26Å; F188-H192 WeakPolarHBondContact O-CB 3.3Å; F188-H192 PolarHBondContact O-N 3.31Å; N189-H192 PolarHBondContact O-N 3.12Å; Q190-H192 PolarHBondContact O-N 3.42Å; H192-M195 PolarHBondContact O-N 3.26Å; H192-K196 WeakPolarHBondContact NE2-CE 3.38Å; H192-K196 WeakPolarHBondContact O-CB 3.22Å; H192-K196 WeakPolarHBondContact O-CG 3.49Å; H192-K196 PolarHBondContact O-N 3.4Å |
| 193 | M | 68.9 | Low | 64.3 | Low | 122 Ų | 122 | 110.9 Ų | 110.9 | 60% | 0.601 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -63.9 | -46.6 | 171.4 | -72.1 | -61.5 | -160.4 | 0 | 0 | 111.5 | N189 Q190 M195 K196 L197 | N189-M193 WeakPolarHBondContact O-CG 3.35Å; N189-M193 PolarHBondContact O-N 2.95Å; Q190-M193 PolarHBondContact O-N 3.42Å; M193-M195 VanDerWaalsContact C-N 3.34Å; M193-M195 PolarHBondContact O-N 3.05Å; M193-K196 PolarHBondContact O-N 3.03Å; M193-L197 WeakPolarHBondContact O-CG 3.27Å; M193-L197 PolarHBondContact O-N 3.27Å |
| 194 | M | 69.6 | Low | 64.4 | Low | 109 Ų | 109 | 109.7 Ų | 109.7 | 54% | 0.537 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -57.9 | -44.9 | 175.6 | -171.8 | -174.3 | -173.9 | 0 | 0 | 111.8 | Q190 Y191 K196 L197 I198 | Q190-M194 WeakPolarHBondContact O-CB 3.3Å; Q190-M194 PolarHBondContact O-N 3.14Å; Y191-M194 PolarHBondContact O-N 3.41Å; M194-K196 PolarHBondContact O-N 3.44Å; M194-L197 WeakPolarHBondContact O-CB 3.36Å; M194-L197 PolarHBondContact O-N 3.26Å; M194-I198 HydrophobicContact CE-CD1 4.33Å; M194-I198 HydrophobicContact CG-CD1 4.03Å; M194-I198 WeakPolarHBondContact O-CG1 3.33Å; M194-I198 PolarHBondContact O-N 3.44Å |
| 195 | M | 69.9 | Low | 64.1 | Low | 119 Ų | 119 | 112.5 Ų | 112.5 | 59% | 0.586 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -70.5 | -31.6 | 179.7 | -157.4 | -178.4 | -157.1 | 0 | 0 | 112.6 | Y191 H192 M193 K199 | Y191-M195 WeakPolarHBondContact O-CB 3.33Å; Y191-M195 PolarHBondContact O-N 3.04Å; H192-M195 PolarHBondContact O-N 3.26Å; M193-M195 VanDerWaalsContact C-N 3.34Å; M193-M195 PolarHBondContact O-N 3.05Å; M195-K199 WeakPolarHBondContact O-CB 3.34Å; M195-K199 WeakPolarHBondContact O-CG 3.42Å; M195-K199 PolarHBondContact O-N 3.22Å |
| 196 | K | 75.3 | Confident | 63.9 | Low | 123 Ų | 123 | 115.3 Ų | 115.3 | 54% | 0.535 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -64.1 | -43.6 | 168.6 | -84.1 | -176.2 | 170.7 | -178.7 | 0 | 111.7 | H192 M193 M194 K199 K200 | H192-K196 WeakPolarHBondContact NE2-CE 3.38Å; H192-K196 WeakPolarHBondContact O-CB 3.22Å; H192-K196 WeakPolarHBondContact O-CG 3.49Å; H192-K196 PolarHBondContact O-N 3.4Å; M193-K196 PolarHBondContact O-N 3.03Å; M194-K196 PolarHBondContact O-N 3.44Å; K196-K199 PolarHBondContact O-N 3.47Å; K196-K200 WeakPolarHBondContact O-CB 3.37Å; K196-K200 PolarHBondContact O-N 3.26Å |
| 197 | L | 70.5 | Confident | 63.5 | Low | 107 Ų | 107 | 115.1 Ų | 115.1 | 56% | 0.56 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -62.9 | -46 | 175.8 | -70.2 | 167.9 | 0 | 0 | 0 | 111.6 | M193 M194 K199 K200 N201 | M193-L197 WeakPolarHBondContact O-CG 3.27Å; M193-L197 PolarHBondContact O-N 3.27Å; M194-L197 WeakPolarHBondContact O-CB 3.36Å; M194-L197 PolarHBondContact O-N 3.26Å; L197-K199 PolarHBondContact O-N 2.86Å; L197-K200 PolarHBondContact O-N 3.04Å; L197-K200 VanDerWaalsContact O-N 3.16Å; L197-N201 PolarHBondContact O-N 3.14Å; L197-N201 PolarHBondContact O-OD1 2.91Å |
| 198 | I | 68.6 | Low | 63 | Low | 96 Ų | 96 | 115.7 Ų | 115.7 | 49% | 0.492 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -59.4 | -45.1 | 175.7 | -67.9 | 164.5 | 0 | 0 | 0 | 111.1 | M194 K200 N201 K202 | M194-I198 HydrophobicContact CE-CD1 4.33Å; M194-I198 HydrophobicContact CG-CD1 4.03Å; M194-I198 WeakPolarHBondContact O-CG1 3.33Å; M194-I198 PolarHBondContact O-N 3.44Å; I198-K200 PolarHBondContact O-N 3.33Å; I198-N201 PolarHBondContact O-N 3.23Å; I198-K202 WeakPolarHBondContact O-CB 3.49Å; I198-K202 PolarHBondContact O-N 3.44Å |
| 199 | K | 70.2 | Confident | 62.4 | Low | 150 Ų | 150 | 119.7 Ų | 119.7 | 65% | 0.652 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -63.9 | -37.7 | 175.4 | -78.4 | -169.8 | 175.5 | -171.3 | 0 | 112.7 | M195 K196 L197 K203 | M195-K199 WeakPolarHBondContact O-CB 3.34Å; M195-K199 WeakPolarHBondContact O-CG 3.42Å; M195-K199 PolarHBondContact O-N 3.22Å; K196-K199 PolarHBondContact O-N 3.47Å; L197-K199 PolarHBondContact O-N 2.86Å; K199-K203 PolarHBondContact O-N 3.31Å; K199-K203 VanDerWaalsContact O-N 3.09Å |
| 200 | K | 69.5 | Low | 61.5 | Low | 145 Ų | 145 | 122.4 Ų | 122.4 | 63% | 0.63 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -65.8 | -47.6 | 177.1 | -164.7 | 176.3 | -178.1 | -175.5 | 0 | 111.1 | K196 L197 I198 K203 I204 | K196-K200 WeakPolarHBondContact O-CB 3.37Å; K196-K200 PolarHBondContact O-N 3.26Å; L197-K200 PolarHBondContact O-N 3.04Å; L197-K200 VanDerWaalsContact O-N 3.16Å; I198-K200 PolarHBondContact O-N 3.33Å; K200-K203 PolarHBondContact O-N 3.2Å; K200-I204 HydrophobicContact CG-CD1 4.41Å; K200-I204 WeakPolarHBondContact O-CG1 3.42Å; K200-I204 PolarHBondContact O-N 2.98Å; K200-I204 VanDerWaalsContact O-N 3.14Å |
| 201 | N | 58.5 | Low | 60.7 | Low | 94 Ų | 94 | 123 Ų | 123 | 50% | 0.503 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -66.5 | -40 | 178.7 | -68.1 | 7.2 | 0 | 0 | 0 | 112 | L197 I198 K203 I204 N205 | L197-N201 PolarHBondContact O-N 3.14Å; L197-N201 PolarHBondContact O-OD1 2.91Å; I198-N201 PolarHBondContact O-N 3.23Å; N201-K203 VanDerWaalsContact C-N 3.29Å; N201-K203 PolarHBondContact O-N 3.45Å; N201-I204 PolarHBondContact O-N 3.49Å; N201-N205 PolarHBondContact O-N 3.31Å |
| 202 | K | 57.7 | Low | 59.8 | Low | 144 Ų | 144 | 123.7 Ų | 123.7 | 63% | 0.626 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -63.8 | -33.5 | 175 | -168 | 166.8 | -175.3 | 174.7 | 0 | 112.2 | I198 L206 | I198-K202 WeakPolarHBondContact O-CB 3.49Å; I198-K202 PolarHBondContact O-N 3.44Å; K202-L206 HydrophobicContact CG-CD1 3.88Å; K202-L206 WeakPolarHBondContact O-CD1 3.27Å; K202-L206 PolarHBondContact O-N 3.01Å |
| 203 | K | 56.6 | Low | 58.7 | Low | 167 Ų | 167 | 131 Ų | 131 | 73% | 0.726 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -69.6 | -34.5 | 174.1 | -166.7 | 172.9 | -177.8 | -179.1 | 0 | 112.8 | K199 K200 N201 T207 | K199-K203 PolarHBondContact O-N 3.31Å; K199-K203 VanDerWaalsContact O-N 3.09Å; K200-K203 PolarHBondContact O-N 3.2Å; N201-K203 VanDerWaalsContact C-N 3.29Å; N201-K203 PolarHBondContact O-N 3.45Å; K203-T207 PolarHBondContact O-OG1 3.09Å |
| 204 | I | 57 | Low | 57.6 | Low | 85 Ų | 85 | 130.6 Ų | 130.6 | 44% | 0.436 | 64% | 0.641 | S | S | . | * | H | α-helix | trans | -69.6 | -42.1 | 176.4 | -66.9 | 163.5 | 0 | 0 | 0 | 111.2 | K200 N201 L206 T207 | K200-I204 HydrophobicContact CG-CD1 4.41Å; K200-I204 WeakPolarHBondContact O-CG1 3.42Å; K200-I204 PolarHBondContact O-N 2.98Å; K200-I204 VanDerWaalsContact O-N 3.14Å; N201-I204 PolarHBondContact O-N 3.49Å; I204-L206 PolarHBondContact O-N 2.92Å; I204-T207 PolarHBondContact O-N 2.98Å; I204-T207 PolarHBondContact O-OG1 3.07Å |
| 205 | N | 51 | Low | 56.7 | Low | 114 Ų | 114 | 132.4 Ų | 132.4 | 61% | 0.61 | 65% | 0.652 | S | S | * | * | H | α-helix | trans | -72.1 | -29.1 | -179.1 | -72.5 | 16.1 | 0 | 0 | 0 | 113.1 | N201 T207 | N201-N205 PolarHBondContact O-N 3.31Å; N205-T207 VanDerWaalsContact C-N 3.29Å; N205-T207 PolarHBondContact O-N 3Å |
| 206 | L | 53.1 | Low | 55.7 | Low | 119 Ų | 119 | 133.6 Ų | 133.6 | 62% | 0.623 | 66% | 0.66 | S | S | * | * | H | α-helix | trans | -71 | -19.9 | 174.5 | -97.4 | 88.2 | 0 | 0 | 0 | 113.8 | K202 I204 | K202-L206 HydrophobicContact CG-CD1 3.88Å; K202-L206 WeakPolarHBondContact O-CD1 3.27Å; K202-L206 PolarHBondContact O-N 3.01Å; I204-L206 PolarHBondContact O-N 2.92Å |
| 207 | T | 52.2 | Low | 54.5 | Low | 100 Ų | 100 | 132.7 Ų | 132.7 | 61% | 0.613 | 66% | 0.661 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.8 | -11.1 | 178.1 | 39.1 | 0 | 0 | 0 | 0 | 114.6 | K203 I204 N205 | K203-T207 PolarHBondContact O-OG1 3.09Å; I204-T207 PolarHBondContact O-N 2.98Å; I204-T207 PolarHBondContact O-OG1 3.07Å; N205-T207 VanDerWaalsContact C-N 3.29Å; N205-T207 PolarHBondContact O-N 3Å |
| 208 | N | 52.4 | Low | 53.4 | Low | 127 Ų | 127 | 132.5 Ų | 132.5 | 68% | 0.679 | 66% | 0.657 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -107 | -14.7 | -176.3 | -74.7 | 21.3 | 0 | 0 | 0 | 114.6 | ||
| 209 | N | 45.9 | Very low | 52.3 | Low | 135 Ų | 135 | 135.1 Ų | 135.1 | 72% | 0.722 | 67% | 0.668 | S | S | * | * | trans | -104 | 50.5 | -175.8 | -79.3 | 21.5 | 0 | 0 | 0 | 113.2 | N211 | N209-N211 PolarHBondContact O-N 3.03Š| ||
| 210 | N | 48.3 | Very low | 51.3 | Low | 147 Ų | 147 | 134.5 Ų | 134.5 | 79% | 0.786 | 67% | 0.67 | S | S | * | * | trans | -85.8 | 68.6 | 159.2 | -80.1 | 1.7 | 0 | 0 | 0 | 109.4 | ||||
| 211 | N | 46.9 | Very low | 50.1 | Low | 151 Ų | 151 | 133.5 Ų | 133.5 | 81% | 0.807 | 67% | 0.666 | S | S | * | * | trans | -155.8 | 134.6 | 165.6 | -91.8 | -50.6 | 0 | 0 | 0 | 108.2 | N209 | N209-N211 PolarHBondContact O-N 3.03Š| ||
| 212 | D | 45.5 | Very low | 49.5 | Very low | 156 Ų | 156 | 133 Ų | 133 | 83% | 0.834 | 66% | 0.662 | S | S | * | * | trans | -74.2 | 175.6 | -164.1 | -66.4 | -76.7 | 0 | 0 | 0 | 116.2 | ||||
| 213 | R | 44.4 | Very low | 48.7 | Very low | 240 Ų | 240 | 131.2 Ų | 131.2 | 91% | 0.906 | 66% | 0.659 | S | S | * | * | S | Bend | trans | 87.9 | 20.6 | 141.3 | -141.2 | 177.3 | -168.3 | 174.4 | 3.6 | 119.6 | ||
| 214 | L | 45.4 | Very low | 48 | Very low | 115 Ų | 115 | 130.8 Ų | 130.8 | 60% | 0.602 | 66% | 0.657 | S | S | * | * | trans | -131.7 | 31.2 | 179 | -114.4 | 170.3 | 0 | 0 | 0 | 115.9 | D217 | L214-D217 HydrophobicContact CD2-CB 4.22Š| ||
| 215 | I | 52 | Low | 47.4 | Very low | 147 Ų | 147 | 130.8 Ų | 130.8 | 75% | 0.754 | 66% | 0.657 | S | S | * | * | trans | -73.3 | -34.7 | -169.1 | -69.2 | 174.8 | 0 | 0 | 0 | 114 | ||||
| 216 | N | 49 | Very low | 47.2 | Very low | 144 Ų | 144 | 130 Ų | 130 | 77% | 0.77 | 65% | 0.652 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.5 | -22.4 | -168.1 | -67 | 14.7 | 0 | 0 | 0 | 115.3 | ||
| 217 | D | 49.4 | Very low | 46.6 | Very low | 103 Ų | 103 | 130.1 Ų | 130.1 | 55% | 0.551 | 65% | 0.653 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.1 | -13.4 | -176.9 | -98.8 | 8.2 | 0 | 0 | 0 | 114 | L214 | L214-D217 HydrophobicContact CD2-CB 4.22Š|
| 218 | H | 47.8 | Very low | 46.1 | Very low | 104 Ų | 104 | 130.5 Ų | 130.5 | 48% | 0.481 | 65% | 0.652 | S | S | . | * | H | α-helix | trans | -84 | -27.3 | -170 | -109.5 | -56.9 | 0 | 0 | 0 | 114.1 | K221 I222 | H218-K221 PolarHBondContact O-N 2.9Å; H218-I222 HydrophobicContact CB-CD1 4.49Å; H218-I222 VanDerWaalsContact O-CG1 3.26Å; H218-I222 WeakPolarHBondContact O-CG1 3.32Å; H218-I222 PolarHBondContact O-N 3.48Å |
| 219 | E | 46.4 | Very low | 45.4 | Very low | 151 Ų | 151 | 130.1 Ų | 130.1 | 71% | 0.706 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -67.5 | -41.2 | -175.3 | -164.1 | 158.3 | -132.3 | 0 | 0 | 112.2 | K221 I222 N223 | E219-K221 VanDerWaalsContact C-N 3.35Å; E219-K221 PolarHBondContact O-N 3.45Å; E219-I222 PolarHBondContact O-N 2.92Å; E219-N223 PolarHBondContact O-N 2.95Å |
| 220 | I | 48.8 | Very low | 45 | Very low | 137 Ų | 137 | 130.2 Ų | 130.2 | 70% | 0.703 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -63.8 | -39.2 | 174.7 | -60.1 | 176.3 | 0 | 0 | 0 | 111.2 | K224 | I220-K224 PolarHBondContact O-N 2.99Å |
| 221 | K | 44.5 | Very low | 44.3 | Very low | 124 Ų | 124 | 128.8 Ų | 128.8 | 54% | 0.539 | 65% | 0.647 | S | S | . | * | H | α-helix | trans | -71 | -34.2 | 176.3 | -79.6 | 172.5 | 179.3 | 161.4 | 0 | 112.6 | H218 E219 K224 I225 | H218-K221 PolarHBondContact O-N 2.9Å; E219-K221 VanDerWaalsContact C-N 3.35Å; E219-K221 PolarHBondContact O-N 3.45Å; K221-K224 PolarHBondContact O-N 3.43Å; K221-I225 VanDerWaalsContact O-CG1 3.29Å; K221-I225 WeakPolarHBondContact O-CG1 3.37Å; K221-I225 PolarHBondContact O-N 2.86Å |
| 222 | I | 46.2 | Very low | 43.7 | Very low | 83 Ų | 83 | 125.3 Ų | 125.3 | 43% | 0.426 | 64% | 0.635 | S | S | . | * | H | α-helix | trans | -63.4 | -43.8 | 178.9 | -76.2 | 164 | 0 | 0 | 0 | 111.2 | H218 E219 K224 I225 I226 | H218-I222 HydrophobicContact CB-CD1 4.49Å; H218-I222 VanDerWaalsContact O-CG1 3.26Å; H218-I222 WeakPolarHBondContact O-CG1 3.32Å; H218-I222 PolarHBondContact O-N 3.48Å; E219-I222 PolarHBondContact O-N 2.92Å; I222-K224 VanDerWaalsContact C-N 3.32Å; I222-K224 PolarHBondContact O-N 3.18Å; I222-I225 PolarHBondContact O-N 2.86Å; I222-I225 VanDerWaalsContact O-N 3.13Å; I222-I226 HydrophobicContact CG2-CD1 3.66Å; I222-I226 HydrophobicContact CG2-CG1 4.32Å; I222-I226 VanDerWaalsContact O-CG1 3.31Å; I222-I226 WeakPolarHBondContact O-CG1 3.49Å; I222-I226 PolarHBondContact O-N 3.03Å |
| 223 | N | 40.6 | Very low | 43.1 | Very low | 106 Ų | 106 | 123.4 Ų | 123.4 | 57% | 0.567 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -63.2 | -36.2 | 174.9 | -76.7 | -20.8 | 0 | 0 | 0 | 112.7 | E219 I225 I226 N227 | E219-N223 PolarHBondContact O-N 2.95Å; N223-I225 VanDerWaalsContact C-N 3.3Å; N223-I225 PolarHBondContact O-N 3.25Å; N223-I226 PolarHBondContact O-N 3.34Å; N223-N227 PolarHBondContact O-N 2.97Å |
| 224 | K | 41.1 | Very low | 42.7 | Very low | 159 Ų | 159 | 117 Ų | 117 | 69% | 0.691 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -69.9 | -26.5 | 175.3 | -154.8 | 168.7 | -171.1 | 173.4 | 0 | 113 | I220 K221 I222 | I220-K224 PolarHBondContact O-N 2.99Å; K221-K224 PolarHBondContact O-N 3.43Å; I222-K224 VanDerWaalsContact C-N 3.32Å; I222-K224 PolarHBondContact O-N 3.18Å |
| 225 | I | 44.7 | Very low | 42.2 | Very low | 85 Ų | 85 | 116.9 Ų | 116.9 | 44% | 0.436 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -82.2 | -34.9 | 174.3 | -68.6 | 165.4 | 0 | 0 | 0 | 111.5 | K221 I222 N223 N227 N228 N229 | K221-I225 VanDerWaalsContact O-CG1 3.29Å; K221-I225 WeakPolarHBondContact O-CG1 3.37Å; K221-I225 PolarHBondContact O-N 2.86Å; I222-I225 PolarHBondContact O-N 2.86Å; I222-I225 VanDerWaalsContact O-N 3.13Å; N223-I225 VanDerWaalsContact C-N 3.3Å; N223-I225 PolarHBondContact O-N 3.25Å; I225-N227 VanDerWaalsContact C-N 3.3Å; I225-N227 PolarHBondContact O-N 2.98Å; I225-N228 PolarHBondContact O-N 3.41Å; I225-N228 VanDerWaalsContact O-N 3.15Å; I225-N229 HydrophobicContact CG2-CB 4.43Å; I225-N229 VanDerWaalsContact CG2-ND2 3.35Å; I225-N229 WeakPolarHBondContact CG2-ND2 3.24Å; I225-N229 VanDerWaalsContact O-CB 3.31Å; I225-N229 WeakPolarHBondContact O-CB 3.49Å; I225-N229 PolarHBondContact O-N 3.25Å |
| 226 | I | 45.7 | Very low | 41.4 | Very low | 96 Ų | 96 | 115.3 Ų | 115.3 | 49% | 0.492 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -62.2 | -36.8 | 177.4 | -74.4 | 166.4 | 0 | 0 | 0 | 111.7 | I222 N223 | I222-I226 HydrophobicContact CG2-CD1 3.66Å; I222-I226 HydrophobicContact CG2-CG1 4.32Å; I222-I226 VanDerWaalsContact O-CG1 3.31Å; I222-I226 WeakPolarHBondContact O-CG1 3.49Å; I222-I226 PolarHBondContact O-N 3.03Å; N223-I226 PolarHBondContact O-N 3.34Å |
| 227 | N | 42 | Very low | 40.8 | Very low | 123 Ų | 123 | 115.7 Ų | 115.7 | 66% | 0.658 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -74.9 | -27.8 | 174.5 | -75.7 | -4.7 | 0 | 0 | 0 | 113.7 | N223 I225 | N223-N227 PolarHBondContact O-N 2.97Å; I225-N227 VanDerWaalsContact C-N 3.3Å; I225-N227 PolarHBondContact O-N 2.98Å |
| 228 | N | 41.4 | Very low | 40.2 | Very low | 107 Ų | 107 | 116 Ų | 116 | 57% | 0.572 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -96.2 | -13.9 | -177.6 | -76.3 | 10.2 | 0 | 0 | 0 | 114.6 | I225 | I225-N228 PolarHBondContact O-N 3.41Å; I225-N228 VanDerWaalsContact O-N 3.15Å |
| 229 | N | 36.7 | Very low | 39.5 | Very low | 119 Ų | 119 | 115.7 Ų | 115.7 | 64% | 0.636 | 62% | 0.616 | S | S | * | * | trans | -97.3 | 17.6 | 177.8 | -76.2 | 9.7 | 0 | 0 | 0 | 113.5 | I225 S231 | I225-N229 HydrophobicContact CG2-CB 4.43Å; I225-N229 VanDerWaalsContact CG2-ND2 3.35Å; I225-N229 WeakPolarHBondContact CG2-ND2 3.24Å; I225-N229 VanDerWaalsContact O-CB 3.31Å; I225-N229 WeakPolarHBondContact O-CB 3.49Å; I225-N229 PolarHBondContact O-N 3.25Å; N229-S231 PolarHBondContact O-N 3.31Å | ||
| 230 | Q | 38 | Very low | 39 | Very low | 137 Ų | 137 | 115 Ų | 115 | 64% | 0.64 | 62% | 0.616 | S | S | * | * | trans | -72 | 87.3 | 159.2 | -68.9 | -163.3 | 32.1 | 0 | 0 | 108.6 | S232 | Q230-S232 PolarHBondContact O-N 3.27Š| ||
| 231 | S | 34 | Very low | 38.3 | Very low | 117 Ų | 117 | 113.4 Ų | 113.4 | 82% | 0.818 | 62% | 0.618 | S | S | * | * | trans | -70.8 | 65.3 | -178.2 | 65 | 0 | 0 | 0 | 0 | 112.5 | N229 | N229-S231 PolarHBondContact O-N 3.31Š| ||
| 232 | S | 34.2 | Very low | 37.8 | Very low | 78 Ų | 78 | 113.5 Ų | 113.5 | 55% | 0.545 | 62% | 0.624 | S | S | . | * | trans | -64.1 | 140.3 | 156.2 | -57 | 0 | 0 | 0 | 0 | 108.4 | Q230 | Q230-S232 PolarHBondContact O-N 3.27Š| ||
| 233 | P | 32.7 | Very low | 37.1 | Very low | 117 Ų | 117 | 115.2 Ų | 115.2 | 76% | 0.76 | 63% | 0.634 | S | S | * | * | S | Bend | trans | -62.9 | 144.5 | 168.7 | 28.9 | -33.6 | 0 | 0 | 0 | 109.5 | ||
| 234 | I | 35.7 | Very low | 36.7 | Very low | 106 Ų | 106 | 115.9 Ų | 115.9 | 54% | 0.544 | 64% | 0.638 | S | S | . | * | trans | 72 | 83.1 | 176.6 | -50.5 | 164.9 | 0 | 0 | 0 | 114.2 | L236 | I234-L236 HydrophobicContact CG2-CB 4.4Å; I234-L236 HydrophobicContact CG2-CD1 3.68Å; I234-L236 HydrophobicContact CG2-CG 3.61Å; I234-L236 PolarHBondContact O-N 3.19Å | ||
| 235 | H | 34.7 | Very low | 36.4 | Very low | 112 Ų | 112 | 114.6 Ų | 114.6 | 52% | 0.519 | 64% | 0.639 | S | S | . | * | trans | -82.6 | 92.1 | 161.1 | -105.9 | -93.7 | 0 | 0 | 0 | 110.3 | F237 | H235-F237 PolarHBondContact O-N 3.13Š| ||
| 236 | L | 35.4 | Very low | 35.7 | Very low | 114 Ų | 114 | 117.7 Ų | 117.7 | 60% | 0.597 | 66% | 0.656 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.5 | 37.6 | -179.3 | -98.1 | 162.7 | 0 | 0 | 0 | 114.5 | I234 | I234-L236 HydrophobicContact CG2-CB 4.4Å; I234-L236 HydrophobicContact CG2-CD1 3.68Å; I234-L236 HydrophobicContact CG2-CG 3.61Å; I234-L236 PolarHBondContact O-N 3.19Å |
| 237 | F | 37.4 | Very low | 35.2 | Very low | 151 Ų | 151 | 120.8 Ų | 120.8 | 66% | 0.662 | 67% | 0.674 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -122.2 | -11 | -178.8 | -76.3 | -80.8 | 0 | 0 | 0 | 114.8 | H235 C239 L240 | H235-F237 PolarHBondContact O-N 3.13Å; F237-C239 PolarHBondContact O-N 3.37Å; F237-L240 HydrophobicContact CD1-CD1 4.14Å |
| 238 | S | 35.8 | Very low | 34.6 | Very low | 110 Ų | 110 | 122.8 Ų | 122.8 | 77% | 0.769 | 68% | 0.684 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.3 | -4.4 | 177.4 | -47.5 | 0 | 0 | 0 | 0 | 114.6 | ||
| 239 | C | 33.2 | Very low | 34.1 | Very low | 98 Ų | 98 | 129.3 Ų | 129.3 | 66% | 0.662 | 70% | 0.701 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.9 | 1.6 | -177 | -58 | 0 | 0 | 0 | 0 | 113.8 | F237 S241 | F237-C239 PolarHBondContact O-N 3.37Å; C239-S241 PolarHBondContact O-N 3.32Å |
| 240 | L | 36.4 | Very low | 33.7 | Very low | 135 Ų | 135 | 131.4 Ų | 131.4 | 71% | 0.707 | 71% | 0.711 | S | S | * | * | S | Bend | trans | -70.2 | 124 | 168.7 | -84 | 162.7 | 0 | 0 | 0 | 108.8 | F237 N242 | F237-L240 HydrophobicContact CD1-CD1 4.14Å; L240-N242 PolarHBondContact O-N 3.35Å; L240-N242 VanDerWaalsContact O-N 3.08Å |
| 241 | S | 33 | Very low | 33.4 | Very low | 105 Ų | 105 | 132.2 Ų | 132.2 | 73% | 0.734 | 72% | 0.719 | S | S | * | * | trans | -59.6 | 114.2 | -174.8 | -175 | 0 | 0 | 0 | 0 | 111 | C239 N243 | C239-S241 PolarHBondContact O-N 3.32Å; S241-N243 PolarHBondContact O-N 3.24Å | ||
| 242 | N | 34 | Very low | 33.1 | Very low | 126 Ų | 126 | 133.9 Ų | 133.9 | 67% | 0.674 | 72% | 0.719 | S | S | * | * | trans | -73.8 | 77.9 | 172 | -174.9 | 62.8 | 0 | 0 | 0 | 109.3 | L240 N244 | L240-N242 PolarHBondContact O-N 3.35Å; L240-N242 VanDerWaalsContact O-N 3.08Å; N242-N244 VanDerWaalsContact C-N 3.26Å; N242-N244 VanDerWaalsContact ND2-CG 3.27Å; N242-N244 PolarHBondContact ND2-ND2 3.18Å; N242-N244 PolarHBondContact ND2-OD1 3.41Å; N242-N244 PolarHBondContact O-N 3.46Å | ||
| 243 | N | 32.9 | Very low | 33 | Very low | 118 Ų | 118 | 140 Ų | 140 | 63% | 0.631 | 73% | 0.73 | S | S | * | * | trans | -75.5 | 76.1 | -171 | -160.1 | 11.9 | 0 | 0 | 0 | 110.6 | S241 N245 | S241-N243 PolarHBondContact O-N 3.24Å; N243-N245 PolarHBondContact O-N 3.33Å; N243-N245 PolarHBondContact OD1-ND2 2.9Å | ||
| 244 | N | 31.5 | Very low | 32.8 | Very low | 121 Ų | 121 | 141.2 Ų | 141.2 | 65% | 0.647 | 73% | 0.73 | S | S | * | * | trans | -67.4 | 49.9 | 178.3 | -84.7 | -2.7 | 0 | 0 | 0 | 112.8 | N242 N246 | N242-N244 VanDerWaalsContact C-N 3.26Å; N242-N244 VanDerWaalsContact ND2-CG 3.27Å; N242-N244 PolarHBondContact ND2-ND2 3.18Å; N242-N244 PolarHBondContact ND2-OD1 3.41Å; N242-N244 PolarHBondContact O-N 3.46Å; N244-N246 PolarHBondContact O-N 2.97Å; N244-N246 VanDerWaalsContact O-N 3.1Å | ||
| 245 | N | 34.1 | Very low | 32.9 | Very low | 132 Ų | 132 | 143 Ų | 143 | 71% | 0.706 | 74% | 0.739 | S | S | * | * | trans | -79.3 | 90.6 | 169 | -82.3 | -21.3 | 0 | 0 | 0 | 109.3 | N243 N247 | N243-N245 PolarHBondContact O-N 3.33Å; N243-N245 PolarHBondContact OD1-ND2 2.9Å; N245-N247 PolarHBondContact O-N 2.94Å | ||
| 246 | N | 31.3 | Very low | 32.9 | Very low | 149 Ų | 149 | 144.5 Ų | 144.5 | 80% | 0.797 | 75% | 0.751 | S | S | * | * | trans | -51.8 | 108.9 | 159.8 | -66.8 | -36.9 | 0 | 0 | 0 | 109.1 | N244 | N244-N246 PolarHBondContact O-N 2.97Å; N244-N246 VanDerWaalsContact O-N 3.1Å | ||
| 247 | N | 34.7 | Very low | 32.8 | Very low | 162 Ų | 162 | 148.1 Ų | 148.1 | 87% | 0.866 | 77% | 0.765 | S | S | * | * | trans | -170.8 | 134.9 | 146.7 | -98.6 | -40.7 | 0 | 0 | 0 | 112 | N245 R249 | N245-N247 PolarHBondContact O-N 2.94Å; N247-R249 PolarHBondContact O-N 3.43Å | ||
| 248 | N | 29.2 | Very low | 32.5 | Very low | 165 Ų | 165 | 147.9 Ų | 147.9 | 88% | 0.882 | 77% | 0.769 | S | S | * | * | trans | -72 | 118.3 | 178.5 | -63.7 | -47.8 | 0 | 0 | 0 | 111.1 | ||||
| 249 | R | 31.1 | Very low | 32.4 | Very low | 243 Ų | 243 | 150 Ų | 150 | 92% | 0.917 | 77% | 0.767 | S | S | * | * | trans | -161 | 148.2 | 147.8 | -116.2 | 161.6 | -176.6 | 168.8 | 0.9 | 113.1 | N247 | N247-R249 PolarHBondContact O-N 3.43Š| ||
| 250 | L | 28.8 | Very low | 32.2 | Very low | 164 Ų | 164 | 150.3 Ų | 150.3 | 86% | 0.859 | 77% | 0.77 | S | S | * | * | trans | -59.5 | 136.9 | 179.7 | -65 | 71.4 | 0 | 0 | 0 | 110.8 | ||||
| 251 | L | 31.7 | Very low | 31.9 | Very low | 153 Ų | 153 | 150.3 Ų | 150.3 | 80% | 0.801 | 78% | 0.775 | S | S | * | * | trans | -146.8 | 113.1 | 136.9 | -137.2 | 120.7 | 0 | 0 | 0 | 111.2 | ||||
| 252 | N | 26.6 | Very low | 31.8 | Very low | 152 Ų | 152 | 151.2 Ų | 151.2 | 81% | 0.813 | 78% | 0.777 | S | S | * | * | trans | -80.1 | 115.4 | 175 | 177.2 | 18.8 | 0 | 0 | 0 | 109.3 | ||||
| 253 | R | 32.8 | Very low | 31.6 | Very low | 208 Ų | 208 | 152.7 Ų | 152.7 | 79% | 0.785 | 78% | 0.781 | S | S | * | * | trans | -161.4 | 144.4 | 166.6 | -111 | 164.8 | -170.6 | -179.7 | 1.7 | 111.3 | ||||
| 254 | N | 29.2 | Very low | 31.7 | Very low | 142 Ų | 142 | 151.8 Ų | 151.8 | 76% | 0.759 | 78% | 0.782 | S | S | * | * | trans | -58 | 147.5 | -167 | -50.9 | 4.6 | 0 | 0 | 0 | 113.5 | ||||
| 255 | I | 37.3 | Very low | 31.5 | Very low | 143 Ų | 143 | 156.4 Ų | 156.4 | 73% | 0.733 | 79% | 0.792 | S | S | * | * | trans | -122.1 | 49.5 | 176.4 | -47.3 | 170.4 | 0 | 0 | 0 | 109 | I258 | I255-I258 HydrophobicContact CG2-CD1 4.11Š| ||
| 256 | D | 33.9 | Very low | 31.3 | Very low | 143 Ų | 143 | 159.7 Ų | 159.7 | 77% | 0.765 | 80% | 0.8 | S | S | * | * | trans | -108.4 | -5 | -178.8 | -63.8 | -66.3 | 0 | 0 | 0 | 113.2 | ||||
| 257 | E | 33.5 | Very low | 31.2 | Very low | 190 Ų | 190 | 156.8 Ų | 156.8 | 89% | 0.888 | 79% | 0.792 | S | S | * | * | trans | -117.7 | 77.6 | 179.7 | -68.1 | -169.3 | 127.8 | 0 | 0 | 112.1 | ||||
| 258 | I | 32 | Very low | 30.8 | Very low | 146 Ų | 146 | 157.9 Ų | 157.9 | 75% | 0.749 | 80% | 0.797 | S | S | * | * | trans | -127.6 | 84.5 | 164.8 | -54.5 | -178.6 | 0 | 0 | 0 | 108.8 | I255 S260 | I255-I258 HydrophobicContact CG2-CD1 4.11Å; I258-S260 PolarHBondContact O-N 2.83Å | ||
| 259 | Q | 32.3 | Very low | 30.9 | Very low | 156 Ų | 156 | 154.1 Ų | 154.1 | 73% | 0.729 | 78% | 0.784 | S | S | * | * | trans | -71.5 | 125 | 174.1 | -75.2 | -172 | -13 | 0 | 0 | 111.3 | V261 | Q259-V261 PolarHBondContact O-N 3.33Š| ||
| 260 | S | 30.1 | Very low | 30.7 | Very low | 104 Ų | 104 | 152.4 Ų | 152.4 | 73% | 0.727 | 79% | 0.786 | S | S | * | * | trans | -80 | 106.3 | 173.4 | 57.8 | 0 | 0 | 0 | 0 | 111.3 | I258 T262 | I258-S260 PolarHBondContact O-N 2.83Å; S260-T262 PolarHBondContact O-N 3.25Å; S260-T262 VanDerWaalsContact O-N 3.11Å | ||
| 261 | V | 29.5 | Very low | 30.6 | Very low | 135 Ų | 135 | 148.8 Ų | 148.8 | 82% | 0.818 | 77% | 0.774 | S | S | * | * | trans | -75 | 97.9 | 176.2 | -178.2 | 0 | 0 | 0 | 0 | 110.6 | Q259 M263 | Q259-V261 PolarHBondContact O-N 3.33Å; V261-M263 PolarHBondContact O-N 3.27Å | ||
| 262 | T | 31.5 | Very low | 30.4 | Very low | 124 Ų | 124 | 149.3 Ų | 149.3 | 76% | 0.761 | 78% | 0.777 | S | S | * | * | trans | -82.3 | 106.8 | 174 | 45.8 | 0 | 0 | 0 | 0 | 111.8 | S260 | S260-T262 PolarHBondContact O-N 3.25Å; S260-T262 VanDerWaalsContact O-N 3.11Å | ||
| 263 | M | 30.5 | Very low | 30.5 | Very low | 156 Ų | 156 | 147.2 Ų | 147.2 | 77% | 0.768 | 77% | 0.769 | S | S | * | * | trans | -64 | 125.8 | 171.5 | -85 | -87.3 | -79.1 | 0 | 0 | 112 | V261 Y265 | V261-M263 PolarHBondContact O-N 3.27Å; M263-Y265 PolarHBondContact O-N 3.11Å | ||
| 264 | P | 33.8 | Very low | 30.3 | Very low | 100 Ų | 100 | 143 Ų | 143 | 65% | 0.649 | 77% | 0.766 | S | S | * | * | trans | -77.1 | 108.4 | 175.3 | 30 | -32.8 | 0 | 0 | 0 | 111.1 | F266 | P264-F266 PolarHBondContact O-N 3.42Š| ||
| 265 | Y | 28.4 | Very low | 30.2 | Very low | 218 Ų | 218 | 142.7 Ų | 142.7 | 86% | 0.855 | 77% | 0.77 | S | S | * | * | trans | -68.8 | 102.2 | 172.8 | -107.1 | -89.4 | 0 | 0 | 0 | 111.1 | M263 S267 | M263-Y265 PolarHBondContact O-N 3.11Å; Y265-S267 VanDerWaalsContact C-N 3.29Å; Y265-S267 PolarHBondContact O-N 3.25Å | ||
| 266 | F | 28.3 | Very low | 29.9 | Very low | 200 Ų | 200 | 140.5 Ų | 140.5 | 88% | 0.877 | 77% | 0.767 | S | S | * | * | trans | -69 | 81.1 | 170.7 | -88.5 | -89.8 | 0 | 0 | 0 | 111.6 | P264 | P264-F266 PolarHBondContact O-N 3.42Š| ||
| 267 | S | 30.7 | Very low | 29.6 | Very low | 89 Ų | 89 | 139 Ų | 139 | 62% | 0.622 | 77% | 0.768 | S | S | * | * | trans | -86.1 | 129.7 | 163.1 | 60.8 | 0 | 0 | 0 | 0 | 110.3 | Y265 S269 | Y265-S267 VanDerWaalsContact C-N 3.29Å; Y265-S267 PolarHBondContact O-N 3.25Å; S267-S269 VanDerWaalsContact C-N 3.31Å; S267-S269 PolarHBondContact O-N 3.39Å | ||
| 268 | N | 26.5 | Very low | 29.5 | Very low | 185 Ų | 185 | 137 Ų | 137 | 99% | 0.989 | 77% | 0.769 | S | S | * | * | S | Bend | trans | -72.9 | 74.7 | -171.5 | -120.8 | -21.1 | 0 | 0 | 0 | 113.2 | ||
| 269 | S | 30.6 | Very low | 29.3 | Very low | 85 Ų | 85 | 138.9 Ų | 138.9 | 59% | 0.594 | 77% | 0.774 | S | S | * | * | S | Bend | trans | -155.3 | 123.3 | 170.5 | 58.8 | 0 | 0 | 0 | 0 | 110.9 | S267 C271 | S267-S269 VanDerWaalsContact C-N 3.31Å; S267-S269 PolarHBondContact O-N 3.39Å; S269-C271 PolarHBondContact O-N 2.93Å; S269-C271 VanDerWaalsContact O-N 3.12Å |
| 270 | Q | 26.6 | Very low | 29.2 | Very low | 208 Ų | 208 | 137.7 Ų | 137.7 | 97% | 0.972 | 77% | 0.772 | S | S | * | * | trans | -62.1 | 112.1 | 179.5 | -67.9 | 168.5 | -42.1 | 0 | 0 | 111.1 | ||||
| 271 | C | 27.2 | Very low | 29.2 | Very low | 87 Ų | 87 | 141.3 Ų | 141.3 | 59% | 0.588 | 78% | 0.775 | S | S | * | * | trans | -147.7 | 94.3 | 170.5 | -160.3 | 0 | 0 | 0 | 0 | 109.8 | S269 V273 | S269-C271 PolarHBondContact O-N 2.93Å; S269-C271 VanDerWaalsContact O-N 3.12Å; C271-V273 PolarHBondContact O-N 3.46Å | ||
| 272 | L | 27.8 | Very low | 29.3 | Very low | 165 Ų | 165 | 143 Ų | 143 | 86% | 0.864 | 78% | 0.777 | S | S | * | * | trans | -59.9 | 128.4 | 165 | -86.9 | 111.9 | 0 | 0 | 0 | 109.1 | ||||
| 273 | V | 28.5 | Very low | 29.1 | Very low | 108 Ų | 108 | 144.2 Ų | 144.2 | 66% | 0.655 | 78% | 0.779 | S | S | * | * | trans | -108.2 | 98 | 167.5 | 178.6 | 0 | 0 | 0 | 0 | 107.1 | C271 T275 | C271-V273 PolarHBondContact O-N 3.46Å; V273-T275 PolarHBondContact O-N 2.89Å | ||
| 274 | T | 27.7 | Very low | 29.1 | Very low | 118 Ų | 118 | 141.3 Ų | 141.3 | 72% | 0.724 | 78% | 0.775 | S | S | * | * | trans | -78.8 | 108.6 | 171.3 | 37.2 | 0 | 0 | 0 | 0 | 109.8 | S276 | T274-S276 PolarHBondContact O-N 3.16Š| ||
| 275 | T | 28.1 | Very low | 28.7 | Very low | 137 Ų | 137 | 143.7 Ų | 143.7 | 84% | 0.84 | 78% | 0.782 | S | S | * | * | trans | -78.2 | 111.4 | 165.6 | 47.8 | 0 | 0 | 0 | 0 | 109 | V273 | V273-T275 PolarHBondContact O-N 2.89Š| ||
| 276 | S | 30 | Very low | 28.6 | Very low | 96 Ų | 96 | 138 Ų | 138 | 67% | 0.671 | 77% | 0.773 | S | S | * | * | trans | -138.3 | 160.4 | 173.9 | 54.5 | 0 | 0 | 0 | 0 | 110.1 | T274 | T274-S276 PolarHBondContact O-N 3.16Š| ||
| 277 | S | 28.1 | Very low | 28.7 | Very low | 111 Ų | 111 | 136.9 Ų | 136.9 | 78% | 0.776 | 77% | 0.769 | S | S | * | * | trans | 56.2 | 73.9 | -177.1 | 62.4 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 278 | V | 30.6 | Very low | 28.7 | Very low | 150 Ų | 150 | 140.6 Ų | 140.6 | 91% | 0.909 | 78% | 0.781 | S | S | * | * | trans | -127.7 | 79.6 | 133.5 | -175.2 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 279 | H | 28.2 | Very low | 29 | Very low | 185 Ų | 185 | 139.4 Ų | 139.4 | 86% | 0.856 | 77% | 0.773 | S | S | * | * | trans | -93.7 | 103.7 | 165 | -110.7 | -65 | 0 | 0 | 0 | 107.2 | ||||
| 280 | D | 30.7 | Very low | 29.1 | Very low | 130 Ų | 130 | 140.5 Ų | 140.5 | 70% | 0.695 | 78% | 0.779 | S | S | * | * | 179.8 | 146.6 | 128 | -102.7 | -6.1 | 0 | 0 | 0 | 112.2 | |||||
| 281 | K | 29.4 | Very low | 29.2 | Very low | 180 Ų | 180 | 138.1 Ų | 138.1 | 78% | 0.783 | 77% | 0.771 | S | S | * | * | trans | 46.6 | 98.5 | 159.3 | -64.5 | 173.3 | -179.9 | 169.8 | 0 | 117.6 | ||||
| 282 | I | 32.1 | Very low | 29.5 | Very low | 170 Ų | 170 | 140.3 Ų | 140.3 | 87% | 0.872 | 78% | 0.782 | S | S | * | * | -173.9 | 160.3 | 100.8 | -93.1 | 155.3 | 0 | 0 | 0 | 110.6 | |||||
| 283 | N | 28 | Very low | 29.6 | Very low | 150 Ų | 150 | 137.1 Ų | 137.1 | 80% | 0.802 | 77% | 0.773 | S | S | * | * | trans | -68.8 | 171.4 | -173.4 | -86 | -26 | 0 | 0 | 0 | 115.7 | ||||
| 284 | S | 29.4 | Very low | 29.6 | Very low | 96 Ų | 96 | 138.8 Ų | 138.8 | 67% | 0.671 | 78% | 0.778 | S | S | * | * | trans | 79.8 | 108.3 | 152.5 | 58.5 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 285 | N | 26.5 | Very low | 29.7 | Very low | 150 Ų | 150 | 141.1 Ų | 141.1 | 80% | 0.802 | 79% | 0.787 | S | S | * | * | trans | 73.7 | 133.2 | 137.6 | -57.8 | -6.9 | 0 | 0 | 0 | 119.8 | ||||
| 286 | S | 26.9 | Very low | 29.8 | Very low | 97 Ų | 97 | 141.6 Ų | 141.6 | 68% | 0.678 | 78% | 0.782 | S | S | * | * | trans | 47.7 | 103.9 | 160 | 51.8 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 287 | F | 29.3 | Very low | 30 | Very low | 177 Ų | 177 | 143.1 Ų | 143.1 | 78% | 0.776 | 78% | 0.782 | S | S | * | * | -162.1 | 122.9 | 101.9 | -100.4 | -70 | 0 | 0 | 0 | 110 | L289 | F287-L289 PolarHBondContact O-N 2.86Š| |||
| 288 | L | 30.6 | Very low | 30 | Very low | 168 Ų | 168 | 144.9 Ų | 144.9 | 88% | 0.88 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -76.3 | 123.6 | 169.9 | -82.1 | 83.9 | 0 | 0 | 0 | 109.1 | ||
| 289 | L | 33.8 | Very low | 29.9 | Very low | 159 Ų | 159 | 146.4 Ų | 146.4 | 83% | 0.832 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -74.8 | 130.8 | 165.8 | -78.5 | 155.3 | 0 | 0 | 0 | 109.3 | F287 I291 | F287-L289 PolarHBondContact O-N 2.86Å; L289-I291 PolarHBondContact O-N 3.49Å |
| 290 | P | 32.7 | Very low | 29.9 | Very low | 108 Ų | 108 | 142 Ų | 142 | 70% | 0.701 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -69.6 | 122 | 177.2 | 27.7 | -33.2 | 0 | 0 | 0 | 110.5 | T292 | P290-T292 PolarHBondContact O-N 2.86Å; P290-T292 VanDerWaalsContact O-N 3.11Å |
| 291 | I | 28.9 | Very low | 30.1 | Very low | 159 Ų | 159 | 143.5 Ų | 143.5 | 82% | 0.815 | 78% | 0.776 | S | S | * | * | trans | -72.7 | 100.9 | 175.1 | -59 | 169.6 | 0 | 0 | 0 | 108.5 | L289 S293 | L289-I291 PolarHBondContact O-N 3.49Å; I291-S293 VanDerWaalsContact C-N 3.35Å; I291-S293 PolarHBondContact O-N 3.33Å; I291-S293 VanDerWaalsContact O-N 3.11Å | ||
| 292 | T | 33.4 | Very low | 30.2 | Very low | 132 Ų | 132 | 142.8 Ų | 142.8 | 81% | 0.81 | 78% | 0.775 | S | S | * | * | trans | -83.3 | 79.8 | 171.8 | 43.4 | 0 | 0 | 0 | 0 | 110.7 | P290 N294 | P290-T292 PolarHBondContact O-N 2.86Å; P290-T292 VanDerWaalsContact O-N 3.11Å; T292-N294 PolarHBondContact O-N 3.17Å | ||
| 293 | S | 28.5 | Very low | 30.1 | Very low | 98 Ų | 98 | 140.9 Ų | 140.9 | 69% | 0.685 | 77% | 0.766 | S | S | * | * | trans | -66.3 | 88.6 | 173.6 | 55.7 | 0 | 0 | 0 | 0 | 111.6 | I291 | I291-S293 VanDerWaalsContact C-N 3.35Å; I291-S293 PolarHBondContact O-N 3.33Å; I291-S293 VanDerWaalsContact O-N 3.11Å | ||
| 294 | N | 29.8 | Very low | 30.4 | Very low | 143 Ų | 143 | 140.8 Ų | 140.8 | 77% | 0.765 | 76% | 0.764 | S | S | * | * | trans | -161.3 | 76.4 | 161.1 | -103.2 | -26 | 0 | 0 | 0 | 111.9 | T292 | T292-N294 PolarHBondContact O-N 3.17Š| ||
| 295 | N | 29.8 | Very low | 30.5 | Very low | 168 Ų | 168 | 146.4 Ų | 146.4 | 90% | 0.898 | 77% | 0.772 | S | S | * | * | trans | -162.9 | 75.1 | 152.9 | -95.4 | -31.9 | 0 | 0 | 0 | 106.9 | I297 | N295-I297 PolarHBondContact O-N 3.45Š| ||
| 296 | I | 30.1 | Very low | 30.7 | Very low | 146 Ų | 146 | 143.2 Ų | 143.2 | 75% | 0.749 | 76% | 0.762 | S | S | * | * | trans | -77.2 | 109 | -179.2 | -66.7 | 176.7 | 0 | 0 | 0 | 108.9 | ||||
| 297 | I | 32.6 | Very low | 30.9 | Very low | 128 Ų | 128 | 144.8 Ų | 144.8 | 66% | 0.656 | 76% | 0.763 | S | S | * | * | trans | 42.9 | 98.3 | 141.2 | -49.9 | 174.6 | 0 | 0 | 0 | 115.6 | N295 H299 | N295-I297 PolarHBondContact O-N 3.45Å; I297-H299 PolarHBondContact O-N 3.44Å | ||
| 298 | D | 28.9 | Very low | 31.2 | Very low | 149 Ų | 149 | 143.7 Ų | 143.7 | 80% | 0.797 | 76% | 0.76 | S | S | * | * | S | Bend | trans | -62.1 | 127.8 | 152.2 | -95.9 | -46.9 | 0 | 0 | 0 | 109.8 | ||
| 299 | H | 29.3 | Very low | 31.2 | Very low | 182 Ų | 182 | 143.3 Ų | 143.3 | 84% | 0.843 | 75% | 0.754 | S | S | * | * | S | Bend | trans | 42.4 | 81.3 | 156.5 | -67.5 | -75 | 0 | 0 | 0 | 119 | I297 | I297-H299 PolarHBondContact O-N 3.44Š|
| 300 | S | 28.2 | Very low | 31.2 | Very low | 91 Ų | 91 | 142.9 Ų | 142.9 | 64% | 0.636 | 75% | 0.747 | S | S | * | * | trans | -162 | 167.5 | 140.3 | 53.2 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 301 | I | 33.5 | Very low | 31.2 | Very low | 163 Ų | 163 | 145.3 Ų | 145.3 | 84% | 0.836 | 75% | 0.749 | S | S | * | * | trans | 74.4 | 96.4 | 174.1 | -50.1 | 174.7 | 0 | 0 | 0 | 114.7 | ||||
| 302 | H | 31.9 | Very low | 31.2 | Very low | 164 Ų | 164 | 144.2 Ų | 144.2 | 76% | 0.759 | 74% | 0.744 | S | S | * | * | trans | -72.2 | 157.2 | 167.7 | -125.2 | -89.4 | 0 | 0 | 0 | 111.4 | ||||
| 303 | N | 31.1 | Very low | 31.1 | Very low | 131 Ų | 131 | 146.9 Ų | 146.9 | 70% | 0.701 | 74% | 0.744 | S | S | * | * | trans | 65 | 123.2 | 161.3 | -51.6 | -21.2 | 0 | 0 | 0 | 117.7 | ||||
| 304 | I | 33 | Very low | 31 | Very low | 148 Ų | 148 | 147.7 Ų | 147.7 | 76% | 0.759 | 75% | 0.747 | S | S | * | * | 179.5 | 117.6 | 104.5 | -94.1 | 166.6 | 0 | 0 | 0 | 109.4 | |||||
| 305 | Y | 31.5 | Very low | 31.1 | Very low | 213 Ų | 213 | 149.8 Ų | 149.8 | 84% | 0.835 | 76% | 0.755 | S | S | * | * | trans | 63.6 | 154.3 | 163.2 | -76.4 | -126 | 0 | 0 | 0 | 118.6 | ||||
| 306 | S | 31.1 | Very low | 30.9 | Very low | 84 Ų | 84 | 150.3 Ų | 150.3 | 59% | 0.587 | 75% | 0.749 | S | S | * | * | cis | -171.6 | 146.3 | -30.1 | 52.4 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 307 | N | 32.1 | Very low | 30.7 | Very low | 130 Ų | 130 | 150.1 Ų | 150.1 | 70% | 0.695 | 75% | 0.75 | S | S | * | * | trans | 73.7 | 133.2 | 157.6 | -68 | 35.7 | 0 | 0 | 0 | 121.5 | ||||
| 308 | E | 35 | Very low | 30.4 | Very low | 153 Ų | 153 | 149.3 Ų | 149.3 | 72% | 0.715 | 76% | 0.755 | S | S | * | * | trans | 62.5 | 96.6 | 143.9 | -68 | 152.2 | -124.6 | 0 | 0 | 117.5 | ||||
| 309 | E | 30.6 | Very low | 30.4 | Very low | 161 Ų | 161 | 151 Ų | 151 | 75% | 0.752 | 76% | 0.758 | S | S | * | * | 63.7 | 105.8 | 70.7 | -60.3 | -164.2 | 146.3 | 0 | 0 | 114 | |||||
| 310 | H | 33.2 | Very low | 30.2 | Very low | 150 Ų | 150 | 148.9 Ų | 148.9 | 69% | 0.694 | 75% | 0.753 | S | S | * | * | -179.4 | 146.3 | 101.5 | -94.1 | -71.7 | 0 | 0 | 0 | 113.2 | |||||
| 311 | H | 33.7 | Very low | 30.1 | Very low | 158 Ų | 158 | 151.6 Ų | 151.6 | 73% | 0.731 | 77% | 0.765 | S | S | * | * | trans | 39.8 | 110.8 | 155.1 | -58.1 | -56.3 | 0 | 0 | 0 | 122.8 | ||||
| 312 | L | 28.7 | Very low | 29.7 | Very low | 136 Ų | 136 | 148.4 Ų | 148.4 | 71% | 0.712 | 75% | 0.753 | S | S | * | * | 51.3 | 110.8 | 108.1 | -149.3 | 84.3 | 0 | 0 | 0 | 119 | |||||
| 313 | F | 30.2 | Very low | 29.4 | Very low | 188 Ų | 188 | 147.3 Ų | 147.3 | 83% | 0.825 | 75% | 0.751 | S | S | * | * | 178.3 | 132.9 | 118.4 | -99.6 | -67 | 0 | 0 | 0 | 111.8 | |||||
| 314 | P | 28 | Very low | 29.3 | Very low | 115 Ų | 115 | 146 Ų | 146 | 75% | 0.747 | 76% | 0.759 | S | S | * | * | trans | -102.7 | 121.4 | 176.9 | 34.8 | -28.5 | 0 | 0 | 0 | 113 | ||||
| 315 | M | 29.9 | Very low | 29 | Very low | 187 Ų | 187 | 144.4 Ų | 144.4 | 92% | 0.921 | 76% | 0.756 | S | S | * | * | trans | -141.3 | 139.9 | 168.2 | -90.4 | -109.2 | 174.5 | 0 | 0 | 114 | ||||
| 316 | K | 27.2 | Very low | 28.7 | Very low | 179 Ų | 179 | 141.8 Ų | 141.8 | 78% | 0.778 | 76% | 0.757 | S | S | * | * | trans | -33.2 | 142.1 | 177.4 | -74.6 | 167.5 | 169.1 | 176.1 | 0 | 119.5 | ||||
| 317 | D | 26.1 | Very low | 28.6 | Very low | 143 Ų | 143 | 144 Ų | 144 | 77% | 0.765 | 77% | 0.766 | S | S | * | * | 32.9 | 137.5 | 121.4 | -50.9 | -25 | 0 | 0 | 0 | 121.1 | |||||
| 318 | S | 26.2 | Very low | 28.4 | Very low | 110 Ų | 110 | 142.3 Ų | 142.3 | 77% | 0.769 | 77% | 0.765 | S | S | * | * | trans | 70.8 | 71.6 | 159.7 | -61.8 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 319 | Q | 27.2 | Very low | 28 | Very low | 184 Ų | 184 | 142.4 Ų | 142.4 | 86% | 0.86 | 77% | 0.77 | S | S | * | * | trans | -157.5 | 167 | 147.5 | -118 | 146.8 | 103.3 | 0 | 0 | 113.3 | ||||
| 320 | L | 26.6 | Very low | 28 | Very low | 139 Ų | 139 | 140.3 Ų | 140.3 | 73% | 0.728 | 77% | 0.773 | S | S | * | * | trans | 61.5 | 76.3 | 175.7 | -84.8 | 70.3 | 0 | 0 | 0 | 117.4 | ||||
| 321 | V | 25.4 | Very low | 27.8 | Very low | 147 Ų | 147 | 141 Ų | 141 | 89% | 0.891 | 78% | 0.782 | S | S | * | * | -69.5 | 111.4 | 114.8 | 171.9 | 0 | 0 | 0 | 0 | 106.9 | |||||
| 322 | T | 26 | Very low | 27.7 | Very low | 96 Ų | 96 | 140.8 Ų | 140.8 | 59% | 0.589 | 79% | 0.786 | S | S | * | * | trans | 176.9 | 119.4 | 150.7 | -80.3 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 323 | I | 25.7 | Very low | 27.7 | Very low | 141 Ų | 141 | 140.1 Ų | 140.1 | 72% | 0.723 | 79% | 0.793 | S | S | * | * | trans | 30.6 | 116.6 | 144.1 | -48.9 | 173.3 | 0 | 0 | 0 | 118.5 | T325 | I323-T325 HydrophobicContact CG2-CG2 4.48Å; I323-T325 WeakPolarHBondContact CG2-OG1 3.39Å | ||
| 324 | A | 27.9 | Very low | 27.7 | Very low | 105 Ų | 105 | 136.4 Ų | 136.4 | 87% | 0.868 | 79% | 0.788 | S | S | * | * | trans | -133.6 | 63.6 | 156.1 | 0 | 0 | 0 | 0 | 0 | 110.8 | N326 | A324-N326 PolarHBondContact O-N 3.5Š| ||
| 325 | T | 26.3 | Very low | 27.9 | Very low | 114 Ų | 114 | 138.5 Ų | 138.5 | 70% | 0.699 | 79% | 0.792 | S | S | * | * | trans | -87.4 | 101.3 | 172.7 | 47.2 | 0 | 0 | 0 | 0 | 111.1 | I323 | I323-T325 HydrophobicContact CG2-CG2 4.48Å; I323-T325 WeakPolarHBondContact CG2-OG1 3.39Å | ||
| 326 | N | 26.2 | Very low | 27.9 | Very low | 157 Ų | 157 | 136.8 Ų | 136.8 | 84% | 0.84 | 79% | 0.785 | S | S | * | * | trans | 176.7 | 132.4 | 158.4 | -85.3 | -28.8 | 0 | 0 | 0 | 103.8 | A324 | A324-N326 PolarHBondContact O-N 3.5Š| ||
| 327 | V | 29.4 | Very low | 28 | Very low | 130 Ų | 130 | 137.4 Ų | 137.4 | 79% | 0.788 | 78% | 0.784 | S | S | * | * | -153.9 | 106.9 | 54.6 | 164.2 | 0 | 0 | 0 | 0 | 106.1 | |||||
| 328 | S | 26.6 | Very low | 28.2 | Very low | 96 Ų | 96 | 140.7 Ų | 140.7 | 67% | 0.671 | 79% | 0.786 | S | S | * | * | 92.7 | 146.5 | 92.6 | 92.8 | 0 | 0 | 0 | 0 | 115 | |||||
| 329 | N | 27.1 | Very low | 28.5 | Very low | 154 Ų | 154 | 142 Ų | 142 | 82% | 0.824 | 78% | 0.784 | S | S | * | * | trans | 47.5 | 81.9 | 164.5 | -63.4 | -0.8 | 0 | 0 | 0 | 120 | ||||
| 330 | S | 31.2 | Very low | 29 | Very low | 117 Ų | 117 | 139.6 Ų | 139.6 | 82% | 0.818 | 78% | 0.776 | S | S | * | * | -167.2 | 154.1 | 120.6 | 43.4 | 0 | 0 | 0 | 0 | 112 | N332 | S330-N332 PolarHBondContact O-N 3.02Å; S330-N332 VanDerWaalsContact O-N 3.08Å | |||
| 331 | N | 28 | Very low | 29.5 | Very low | 165 Ų | 165 | 137.7 Ų | 137.7 | 88% | 0.882 | 77% | 0.771 | S | S | * | * | S | Bend | trans | -77.9 | 91.2 | -173.4 | -65.3 | -23.9 | 0 | 0 | 0 | 111.9 | ||
| 332 | N | 31.8 | Very low | 30 | Very low | 153 Ų | 153 | 137.4 Ų | 137.4 | 82% | 0.818 | 77% | 0.765 | S | S | * | * | trans | -162.6 | 100.4 | 160.2 | -94.1 | -40 | 0 | 0 | 0 | 109.8 | S330 P334 | S330-N332 PolarHBondContact O-N 3.02Å; S330-N332 VanDerWaalsContact O-N 3.08Å; N332-P334 VanDerWaalsContact O-CD 3.25Å; N332-P334 WeakPolarHBondContact O-CD 3.42Å | ||
| 333 | S | 28 | Very low | 30.4 | Very low | 122 Ų | 122 | 136.4 Ų | 136.4 | 85% | 0.853 | 77% | 0.766 | S | S | * | * | trans | -79.9 | 115.4 | -173.6 | -56.3 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 334 | P | 30.3 | Very low | 30.6 | Very low | 111 Ų | 111 | 136.6 Ų | 136.6 | 72% | 0.721 | 77% | 0.768 | S | S | * | * | trans | -76.2 | 127.9 | 167.5 | 31.6 | -32.5 | 0 | 0 | 0 | 110 | N332 I336 | N332-P334 VanDerWaalsContact O-CD 3.25Å; N332-P334 WeakPolarHBondContact O-CD 3.42Å; P334-I336 PolarHBondContact O-N 2.93Å; P334-I336 VanDerWaalsContact O-N 3.1Å | ||
| 335 | L | 32 | Very low | 31.3 | Very low | 159 Ų | 159 | 137.2 Ų | 137.2 | 83% | 0.832 | 76% | 0.763 | S | S | * | * | trans | -65.8 | 107.6 | 176.6 | -92.6 | 151.3 | 0 | 0 | 0 | 110.9 | Y337 | L335-Y337 PolarHBondContact O-N 3.32Š| ||
| 336 | I | 29.9 | Very low | 32.1 | Very low | 150 Ų | 150 | 140.8 Ų | 140.8 | 77% | 0.769 | 77% | 0.772 | S | S | * | * | trans | -73.3 | 95.1 | 176.5 | -57.5 | 175 | 0 | 0 | 0 | 109.1 | P334 R338 | P334-I336 PolarHBondContact O-N 2.93Å; P334-I336 VanDerWaalsContact O-N 3.1Å; I336-R338 VanDerWaalsContact C-N 3.3Å; I336-R338 PolarHBondContact O-N 3.07Å | ||
| 337 | Y | 31.2 | Very low | 33.1 | Very low | 193 Ų | 193 | 137.7 Ų | 137.7 | 76% | 0.757 | 76% | 0.755 | S | S | * | * | trans | -69 | 86.1 | 168.5 | -95.1 | -92 | 0 | 0 | 0 | 110.8 | L335 | L335-Y337 PolarHBondContact O-N 3.32Š| ||
| 338 | R | 29.3 | Very low | 35.3 | Very low | 211 Ų | 211 | 134.5 Ų | 134.5 | 80% | 0.796 | 74% | 0.738 | S | S | * | * | trans | -65.3 | 159 | 152.1 | -80.1 | 179.5 | 166.4 | 165.6 | -4.6 | 109.2 | I336 | I336-R338 VanDerWaalsContact C-N 3.3Å; I336-R338 PolarHBondContact O-N 3.07Å | ||
| 339 | N | 31.7 | Very low | 37.3 | Very low | 138 Ų | 138 | 137.8 Ų | 137.8 | 74% | 0.738 | 74% | 0.743 | S | S | * | * | trans | 74.7 | 78.1 | 179.9 | -49.7 | -6 | 0 | 0 | 0 | 114.1 | P341 | N339-P341 VanDerWaalsContact C-CD 3.43Š| ||
| 340 | I | 39.5 | Very low | 39.3 | Very low | 134 Ų | 134 | 136.6 Ų | 136.6 | 69% | 0.687 | 73% | 0.732 | S | S | * | * | trans | -118.9 | 55.4 | 163.2 | -41.8 | 175.3 | 0 | 0 | 0 | 112.1 | A343 | I340-A343 HydrophobicContact CG2-CB 4Š| ||
| 341 | P | 36.6 | Very low | 41.2 | Very low | 98 Ų | 98 | 133 Ų | 133 | 64% | 0.636 | 70% | 0.702 | S | S | * | * | S | Bend | trans | -92.2 | -37.8 | 151.9 | -11.3 | 28.9 | 0 | 0 | 0 | 112.2 | N339 A343 | N339-P341 VanDerWaalsContact C-CD 3.43Å; P341-A343 PolarHBondContact O-N 3.42Å |
| 342 | D | 35.5 | Very low | 43.3 | Very low | 142 Ų | 142 | 131 Ų | 131 | 76% | 0.759 | 69% | 0.687 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.7 | 9.1 | -162.9 | -49.8 | -65.4 | 0 | 0 | 0 | 114.4 | ||
| 343 | A | 34.1 | Very low | 45.2 | Very low | 74 Ų | 74 | 129.2 Ų | 129.2 | 61% | 0.612 | 67% | 0.674 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.8 | -1.2 | -173.1 | 0 | 0 | 0 | 0 | 0 | 114.7 | I340 P341 | I340-A343 HydrophobicContact CG2-CB 4Å; P341-A343 PolarHBondContact O-N 3.42Å |
| 344 | L | 30.8 | Very low | 47.4 | Very low | 146 Ų | 146 | 127 Ų | 127 | 76% | 0.764 | 65% | 0.652 | S | S | * | * | S | Bend | trans | -79.3 | 129.2 | 165.6 | -95.5 | 75.7 | 0 | 0 | 0 | 109.3 | Q346 | L344-Q346 PolarHBondContact O-N 3.34Š|
| 345 | P | 42.5 | Very low | 49.4 | Very low | 117 Ų | 117 | 125 Ų | 125 | 76% | 0.76 | 64% | 0.635 | S | S | * | * | trans | -66.1 | 109.3 | 173.8 | 27.5 | -33.1 | 0 | 0 | 0 | 109.4 | L347 | P345-L347 PolarHBondContact O-N 2.87Š| ||
| 346 | Q | 41.8 | Very low | 51.4 | Low | 189 Ų | 189 | 119.7 Ų | 119.7 | 88% | 0.883 | 61% | 0.614 | S | S | * | * | P | Polyproline II helix | trans | -58 | 123.1 | 170.8 | -66.8 | -175.4 | 1.9 | 0 | 0 | 108.8 | L344 C348 | L344-Q346 PolarHBondContact O-N 3.34Å; Q346-C348 PolarHBondContact O-N 3.29Å |
| 347 | L | 47.1 | Very low | 53.6 | Low | 92 Ų | 92 | 116.9 Ų | 116.9 | 48% | 0.482 | 60% | 0.597 | S | S | . | * | P | Polyproline II helix | trans | -58.9 | 126.7 | 169.7 | -100.8 | 69.1 | 0 | 0 | 0 | 108.2 | P345 H351 L355 | P345-L347 PolarHBondContact O-N 2.87Å; L347-H351 HydrophobicContact CD2-CB 4.33Å; L347-H351 HydrophobicContact CG-CB 4.26Å; L347-L355 HydrophobicContact CD2-CD1 3.48Å; L347-L355 VanDerWaalsContact CD2-CD1 3.48Å |
| 348 | C | 76.6 | Confident | 55.2 | Low | 64 Ų | 64 | 113.3 Ų | 113.3 | 43% | 0.432 | 59% | 0.587 | S | S | . | * | P | Polyproline II helix | trans | -62.2 | 148.5 | 172.5 | 70.1 | 0 | 0 | 0 | 0 | 109.6 | Q346 H350 H351 Q352 | Q346-C348 PolarHBondContact O-N 3.29Å; C348-H350 PolarHBondContact O-N 3.31Å; C348-H351 PolarHBondContact O-N 3.27Å; C348-Q352 PolarHBondContact O-N 2.81Å; C348-Q352 VanDerWaalsContact O-N 3.08Å |
| 349 | Q | 69.3 | Low | 57 | Low | 165 Ų | 165 | 110.5 Ų | 110.5 | 77% | 0.771 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -51.4 | -35.3 | -176.1 | -71 | 178.1 | -26.8 | 0 | 0 | 112.7 | Q352 H353 | Q349-Q352 PolarHBondContact O-N 2.82Å; Q349-H353 WeakPolarHBondContact O-CB 3.47Å; Q349-H353 PolarHBondContact O-N 3.21Å |
| 350 | H | 67.6 | Low | 58.7 | Low | 128 Ų | 128 | 109.2 Ų | 109.2 | 59% | 0.593 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -62.2 | -42.1 | 175.1 | -177.9 | 64.4 | 0 | 0 | 0 | 113.3 | C348 H353 L354 | C348-H350 PolarHBondContact O-N 3.31Å; H350-H353 PolarHBondContact O-N 3.41Å; H350-L354 WeakPolarHBondContact O-CG 3.34Å; H350-L354 PolarHBondContact O-N 3.29Å |
| 351 | H | 70.8 | Confident | 59.7 | Low | 42 Ų | 42 | 109.3 Ų | 109.3 | 19% | 0.194 | 57% | 0.565 | C | S | . | * | H | α-helix | trans | -71.1 | -35.2 | 177.3 | -142.8 | 91.5 | 0 | 0 | 0 | 111.8 | L347 C348 L354 L355 | L347-H351 HydrophobicContact CD2-CB 4.33Å; L347-H351 HydrophobicContact CG-CB 4.26Å; C348-H351 PolarHBondContact O-N 3.27Å; H351-L354 PolarHBondContact O-N 3.13Å; H351-L355 PolarHBondContact O-N 2.67Å; H351-L355 VanDerWaalsContact O-N 3.09Å |
| 352 | Q | 72 | Confident | 60.5 | Low | 123 Ų | 123 | 111 Ų | 111 | 58% | 0.575 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -65.3 | -39.6 | 173.8 | -154.9 | 172.2 | 20.1 | 0 | 0 | 111.3 | C348 Q349 L355 A356 | C348-Q352 PolarHBondContact O-N 2.81Å; C348-Q352 VanDerWaalsContact O-N 3.08Å; Q349-Q352 PolarHBondContact O-N 2.82Å; Q352-L355 PolarHBondContact O-N 2.86Å; Q352-A356 PolarHBondContact O-N 3.08Å; Q352-A356 VanDerWaalsContact O-N 3.09Å |
| 353 | H | 73.8 | Confident | 61.6 | Low | 115 Ų | 115 | 110.9 Ų | 110.9 | 53% | 0.532 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -70.6 | -37 | 176.5 | -161.6 | -18.6 | 0 | 0 | 0 | 112.9 | Q349 H350 A356 Q357 | Q349-H353 WeakPolarHBondContact O-CB 3.47Å; Q349-H353 PolarHBondContact O-N 3.21Å; H350-H353 PolarHBondContact O-N 3.41Å; H353-A356 PolarHBondContact O-N 3.17Å; H353-Q357 PolarHBondContact O-N 2.94Å |
| 354 | L | 72.2 | Confident | 62.6 | Low | 75 Ų | 75 | 115.2 Ų | 115.2 | 39% | 0.393 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -64 | -41.2 | 173 | -79.5 | 168.5 | 0 | 0 | 0 | 112.2 | H350 H351 Q357 Q358 | H350-L354 WeakPolarHBondContact O-CG 3.34Å; H350-L354 PolarHBondContact O-N 3.29Å; H351-L354 PolarHBondContact O-N 3.13Å; L354-Q357 PolarHBondContact O-N 2.98Å; L354-Q358 PolarHBondContact O-N 3.31Å; L354-Q358 VanDerWaalsContact O-N 3.07Å |
| 355 | L | 73.2 | Confident | 63.4 | Low | 71 Ų | 71 | 116.4 Ų | 116.4 | 37% | 0.372 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -63.8 | -41.7 | 174.2 | -77.8 | 168.3 | 0 | 0 | 0 | 111.7 | L347 H351 Q352 Q357 Q358 Y359 | L347-L355 HydrophobicContact CD2-CD1 3.48Å; L347-L355 VanDerWaalsContact CD2-CD1 3.48Å; H351-L355 PolarHBondContact O-N 2.67Å; H351-L355 VanDerWaalsContact O-N 3.09Å; Q352-L355 PolarHBondContact O-N 2.86Å; L355-Q357 PolarHBondContact O-N 3.41Å; L355-Q358 PolarHBondContact O-N 3.2Å; L355-Y359 WeakPolarHBondContact O-CD2 3.2Å; L355-Y359 PolarHBondContact O-N 3.4Å |
| 356 | A | 74.9 | Confident | 63.2 | Low | 46 Ų | 46 | 118.3 Ų | 118.3 | 38% | 0.38 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -57.1 | -47.8 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | Q352 H353 Q358 Y359 E360 | Q352-A356 PolarHBondContact O-N 3.08Å; Q352-A356 VanDerWaalsContact O-N 3.09Å; H353-A356 PolarHBondContact O-N 3.17Å; A356-Q358 VanDerWaalsContact C-N 3.33Å; A356-Q358 PolarHBondContact O-N 3.36Å; A356-Y359 PolarHBondContact O-N 3.13Å; A356-Y359 VanDerWaalsContact O-N 3.08Å; A356-E360 WeakPolarHBondContact O-CG 3.49Å; A356-E360 PolarHBondContact O-N 3.2Å |
| 357 | Q | 74.5 | Confident | 62.9 | Low | 92 Ų | 92 | 115.4 Ų | 115.4 | 43% | 0.43 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -61.5 | -36 | 177.2 | -74.1 | -179.2 | -16.4 | 0 | 0 | 113.3 | H353 L354 L355 E360 Q361 | H353-Q357 PolarHBondContact O-N 2.94Å; L354-Q357 PolarHBondContact O-N 2.98Å; L355-Q357 PolarHBondContact O-N 3.41Å; Q357-E360 PolarHBondContact O-N 3.39Å; Q357-Q361 WeakPolarHBondContact O-CG 3.31Å; Q357-Q361 PolarHBondContact O-N 3.35Å |
| 358 | Q | 65.8 | Low | 62.2 | Low | 117 Ų | 117 | 120 Ų | 120 | 55% | 0.547 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -66.8 | -36.9 | 173.5 | -71.4 | -153.9 | -81.6 | 0 | 0 | 112.7 | L354 L355 A356 Q362 | L354-Q358 PolarHBondContact O-N 3.31Å; L354-Q358 VanDerWaalsContact O-N 3.07Å; L355-Q358 PolarHBondContact O-N 3.2Å; A356-Q358 VanDerWaalsContact C-N 3.33Å; A356-Q358 PolarHBondContact O-N 3.36Å; Q358-Q362 WeakPolarHBondContact O-CG 3.44Å; Q358-Q362 PolarHBondContact O-N 3.42Å |
| 359 | Y | 66.6 | Low | 60.3 | Low | 152 Ų | 152 | 126.5 Ų | 126.5 | 60% | 0.596 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -68.1 | -41.6 | 174.9 | -89.7 | -76.4 | 0 | 0 | 0 | 112 | L355 A356 Q362 Q363 | L355-Y359 WeakPolarHBondContact O-CD2 3.2Å; L355-Y359 PolarHBondContact O-N 3.4Å; A356-Y359 PolarHBondContact O-N 3.13Å; A356-Y359 VanDerWaalsContact O-N 3.08Å; Y359-Q362 PolarHBondContact O-N 2.98Å; Y359-Q363 WeakPolarHBondContact O-CG 3.37Å; Y359-Q363 PolarHBondContact O-N 2.92Å |
| 360 | E | 67.9 | Low | 58.7 | Low | 111 Ų | 111 | 127.7 Ų | 127.7 | 52% | 0.519 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -60 | -45.8 | 175.1 | -70 | 176 | 139.6 | 0 | 0 | 111.8 | A356 Q357 Q362 Q363 Q364 | A356-E360 WeakPolarHBondContact O-CG 3.49Å; A356-E360 PolarHBondContact O-N 3.2Å; Q357-E360 PolarHBondContact O-N 3.39Å; E360-Q362 VanDerWaalsContact C-N 3.31Å; E360-Q362 PolarHBondContact O-N 2.84Å; E360-Q363 PolarHBondContact O-N 2.82Å; E360-Q364 WeakPolarHBondContact O-CG 3.11Å; E360-Q364 PolarHBondContact O-N 2.95Å; E360-Q364 VanDerWaalsContact O-N 3.08Å |
| 361 | Q | 59.5 | Low | 57 | Low | 137 Ų | 137 | 127.1 Ų | 127.1 | 64% | 0.64 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -63.8 | -31.8 | 177.3 | -75 | -173.7 | 1.1 | 0 | 0 | 113.5 | Q357 | Q357-Q361 WeakPolarHBondContact O-CG 3.31Å; Q357-Q361 PolarHBondContact O-N 3.35Å |
| 362 | Q | 54.4 | Low | 55.4 | Low | 134 Ų | 134 | 134.5 Ų | 134.5 | 63% | 0.626 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -74.4 | -34.5 | 175 | -73 | -175.7 | 24 | 0 | 0 | 112.5 | Q358 Y359 E360 | Q358-Q362 WeakPolarHBondContact O-CG 3.44Å; Q358-Q362 PolarHBondContact O-N 3.42Å; Y359-Q362 PolarHBondContact O-N 2.98Å; E360-Q362 VanDerWaalsContact C-N 3.31Å; E360-Q362 PolarHBondContact O-N 2.84Å |
| 363 | Q | 58.4 | Low | 53.6 | Low | 139 Ų | 139 | 134.1 Ų | 134.1 | 65% | 0.65 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -71.2 | -34.6 | 177.1 | -70 | -178.1 | 23.2 | 0 | 0 | 112.4 | Y359 E360 Q365 Q366 | Y359-Q363 WeakPolarHBondContact O-CG 3.37Å; Y359-Q363 PolarHBondContact O-N 2.92Å; E360-Q363 PolarHBondContact O-N 2.82Å; Q363-Q365 PolarHBondContact O-N 3.46Å; Q363-Q365 VanDerWaalsContact O-N 3.08Å; Q363-Q366 PolarHBondContact O-N 3.01Å |
| 364 | Q | 55.1 | Low | 52 | Low | 165 Ų | 165 | 134.4 Ų | 134.4 | 77% | 0.771 | 68% | 0.676 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.6 | -4.8 | 177.7 | -71.1 | -177.8 | 10.5 | 0 | 0 | 114.9 | E360 | E360-Q364 WeakPolarHBondContact O-CG 3.11Å; E360-Q364 PolarHBondContact O-N 2.95Å; E360-Q364 VanDerWaalsContact O-N 3.08Å |
| 365 | Q | 46.8 | Very low | 49.9 | Very low | 171 Ų | 171 | 138.5 Ų | 138.5 | 80% | 0.799 | 70% | 0.697 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -102 | 7.4 | 174.2 | -64.1 | -167.8 | 5.8 | 0 | 0 | 114.3 | Q363 | Q363-Q365 PolarHBondContact O-N 3.46Å; Q363-Q365 VanDerWaalsContact O-N 3.08Å |
| 366 | Q | 38.2 | Very low | 47.8 | Very low | 156 Ų | 156 | 141.8 Ų | 141.8 | 73% | 0.729 | 71% | 0.714 | S | S | * | * | S | Bend | trans | -104.2 | 131.5 | 172.4 | -69 | -167.9 | -10.6 | 0 | 0 | 112 | Q363 | Q363-Q366 PolarHBondContact O-N 3.01Š|
| 367 | P | 36.8 | Very low | 45.6 | Very low | 128 Ų | 128 | 145.5 Ų | 145.5 | 83% | 0.831 | 73% | 0.732 | S | S | * | * | trans | -59.6 | 144.5 | 168.1 | -23.6 | 34.9 | 0 | 0 | 0 | 112.1 | ||||
| 368 | Q | 31.4 | Very low | 43.2 | Very low | 189 Ų | 189 | 148.8 Ų | 148.8 | 88% | 0.883 | 75% | 0.751 | S | S | * | * | trans | -61.9 | 139.1 | -170.2 | -60.9 | 172.4 | -9.3 | 0 | 0 | 114.2 | ||||
| 369 | Q | 36.2 | Very low | 41.3 | Very low | 200 Ų | 200 | 149 Ų | 149 | 94% | 0.935 | 76% | 0.76 | S | S | * | * | trans | -149.3 | 158.1 | 141 | -111.9 | 166.6 | 25.5 | 0 | 0 | 110.8 | ||||
| 370 | Q | 35.8 | Very low | 39.4 | Very low | 191 Ų | 191 | 149 Ų | 149 | 89% | 0.893 | 77% | 0.771 | S | S | * | * | trans | -83.3 | 167.4 | -150 | -89.1 | 178.1 | -38.8 | 0 | 0 | 116.7 | ||||
| 371 | P | 33.2 | Very low | 37.5 | Very low | 115 Ų | 115 | 149.5 Ų | 149.5 | 75% | 0.747 | 78% | 0.781 | S | S | * | * | trans | -105.3 | 163 | -156.8 | 40 | -36.3 | 0 | 0 | 0 | 116 | ||||
| 372 | Q | 35.9 | Very low | 35.9 | Very low | 197 Ų | 197 | 152.3 Ų | 152.3 | 92% | 0.921 | 80% | 0.797 | S | S | * | * | trans | -154.4 | 125.4 | 154.1 | -110.9 | 175.5 | 24 | 0 | 0 | 111.7 | ||||
| 373 | P | 35.2 | Very low | 34.7 | Very low | 115 Ų | 115 | 155.7 Ų | 155.7 | 75% | 0.747 | 81% | 0.809 | S | S | * | * | trans | -115.7 | 177.9 | 172.1 | 40.8 | -32.1 | 0 | 0 | 0 | 112.4 | ||||
| 374 | P | 39.9 | Very low | 33.2 | Very low | 122 Ų | 122 | 159 Ų | 159 | 79% | 0.792 | 82% | 0.816 | S | S | * | * | cis | -129.6 | -164.7 | -36.7 | 37.8 | -21.3 | 0 | 0 | 0 | 111.5 | ||||
| 375 | L | 27.5 | Very low | 32 | Very low | 160 Ų | 160 | 156.6 Ų | 156.6 | 84% | 0.838 | 81% | 0.809 | S | S | * | * | trans | 135 | 160.3 | 140.7 | -159.9 | 64.9 | 0 | 0 | 0 | 114.3 | ||||
| 376 | I | 30.7 | Very low | 31.2 | Very low | 140 Ų | 140 | 157.8 Ų | 157.8 | 72% | 0.718 | 81% | 0.806 | S | S | * | * | trans | 84.9 | 80.1 | 169.1 | -45.6 | -175.9 | 0 | 0 | 0 | 116.6 | ||||
| 377 | T | 27 | Very low | 30.8 | Very low | 125 Ų | 125 | 156.7 Ų | 156.7 | 77% | 0.767 | 81% | 0.805 | S | S | * | * | 57.7 | 124.3 | 120.3 | -45.4 | 0 | 0 | 0 | 0 | 120.9 | |||||
| 378 | I | 25 | Very low | 30.5 | Very low | 161 Ų | 161 | 158.7 Ų | 158.7 | 83% | 0.826 | 80% | 0.801 | S | S | * | * | trans | -79.8 | 113.7 | 170.5 | -57.5 | 157.5 | 0 | 0 | 0 | 110 | ||||
| 379 | T | 24.9 | Very low | 30.4 | Very low | 121 Ų | 121 | 155 Ų | 155 | 74% | 0.742 | 79% | 0.791 | S | S | * | * | trans | 170.1 | 109.6 | 136.8 | 37.3 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 380 | D | 27.7 | Very low | 30.1 | Very low | 152 Ų | 152 | 152.9 Ų | 152.9 | 81% | 0.813 | 79% | 0.786 | S | S | * | * | -169.1 | 159 | 127.4 | -126 | -41.3 | 0 | 0 | 0 | 115.5 | |||||
| 381 | T | 27 | Very low | 29.9 | Very low | 121 Ų | 121 | 149.5 Ų | 149.5 | 74% | 0.742 | 78% | 0.779 | S | S | * | * | trans | -27.5 | 157.4 | 174.1 | 46.5 | 0 | 0 | 0 | 0 | 121.9 | K383 | T381-K383 PolarHBondContact O-N 3.41Å; T381-K383 VanDerWaalsContact O-N 3.13Å | ||
| 382 | M | 26.5 | Very low | 29.8 | Very low | 196 Ų | 196 | 149.6 Ų | 149.6 | 97% | 0.966 | 78% | 0.779 | S | S | * | * | trans | -50.4 | 106.4 | 175.5 | -57.3 | 177.4 | -172.7 | 0 | 0 | 114.1 | ||||
| 383 | K | 28.9 | Very low | 29.6 | Very low | 205 Ų | 205 | 151.3 Ų | 151.3 | 89% | 0.891 | 78% | 0.777 | S | S | * | * | trans | -104.1 | 106.9 | 166.5 | -126.5 | 165.4 | -170.8 | 165.9 | 0 | 112.3 | T381 N385 | T381-K383 PolarHBondContact O-N 3.41Å; T381-K383 VanDerWaalsContact O-N 3.13Å; K383-N385 VanDerWaalsContact C-N 3.34Å; K383-N385 PolarHBondContact O-N 3.21Å | ||
| 384 | R | 28 | Very low | 29.5 | Very low | 209 Ų | 209 | 155.8 Ų | 155.8 | 79% | 0.789 | 79% | 0.785 | S | S | * | * | trans | -69.6 | 74.2 | -172 | -168.8 | -171.9 | -158.3 | 169 | 7.7 | 112.6 | R386 | R384-R386 VanDerWaalsContact C-N 3.33Å; R384-R386 PolarHBondContact O-N 3.13Å | ||
| 385 | N | 28.6 | Very low | 28.9 | Very low | 115 Ų | 115 | 159.1 Ų | 159.1 | 62% | 0.615 | 79% | 0.787 | S | S | * | * | trans | -72.2 | 81.7 | -176.1 | -164.8 | -1.5 | 0 | 0 | 0 | 113.3 | K383 N387 | K383-N385 VanDerWaalsContact C-N 3.34Å; K383-N385 PolarHBondContact O-N 3.21Å; N385-N387 VanDerWaalsContact C-N 3.27Å; N385-N387 PolarHBondContact O-N 3.04Å | ||
| 386 | R | 31.8 | Very low | 29 | Very low | 195 Ų | 195 | 160 Ų | 160 | 74% | 0.736 | 79% | 0.787 | S | S | * | * | trans | -74.6 | 76.3 | 164.6 | -75.7 | 179.1 | 166.4 | 173.2 | -5.4 | 109.9 | R384 | R384-R386 VanDerWaalsContact C-N 3.33Å; R384-R386 PolarHBondContact O-N 3.13Å | ||
| 387 | N | 29.8 | Very low | 28.8 | Very low | 133 Ų | 133 | 158.7 Ų | 158.7 | 71% | 0.711 | 79% | 0.786 | S | S | * | * | trans | -178.4 | 94.6 | 150.6 | -93.6 | -20.3 | 0 | 0 | 0 | 111 | N385 | N385-N387 VanDerWaalsContact C-N 3.27Å; N385-N387 PolarHBondContact O-N 3.04Å | ||
| 388 | F | 30.4 | Very low | 28.9 | Very low | 171 Ų | 171 | 159.6 Ų | 159.6 | 75% | 0.75 | 79% | 0.785 | S | S | * | * | trans | -133.3 | 70.7 | 161.3 | -90.4 | -74 | 0 | 0 | 0 | 110.3 | ||||
| 389 | T | 27.7 | Very low | 29 | Very low | 110 Ų | 110 | 157 Ų | 157 | 68% | 0.675 | 78% | 0.777 | S | S | * | * | trans | -58.7 | 163.4 | 142.7 | 41.4 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 390 | N | 30.1 | Very low | 29.1 | Very low | 156 Ų | 156 | 156.9 Ų | 156.9 | 83% | 0.834 | 78% | 0.778 | S | S | * | * | trans | 69.6 | 59.8 | -179.8 | -53.4 | -17.5 | 0 | 0 | 0 | 116.1 | ||||
| 391 | V | 31.7 | Very low | 29.1 | Very low | 121 Ų | 121 | 154.8 Ų | 154.8 | 73% | 0.733 | 77% | 0.771 | S | S | * | * | trans | -99.4 | 127 | 149.1 | 179.7 | 0 | 0 | 0 | 0 | 107.8 | R393 | V391-R393 PolarHBondContact O-N 2.97Å; V391-R393 VanDerWaalsContact O-N 3.12Å | ||
| 392 | P | 31.4 | Very low | 29.4 | Very low | 117 Ų | 117 | 154.6 Ų | 154.6 | 76% | 0.76 | 77% | 0.769 | S | S | * | * | trans | -68.5 | 112.1 | -175 | 26.5 | -34 | 0 | 0 | 0 | 111.2 | F394 | P392-F394 PolarHBondContact O-N 3.37Š| ||
| 393 | R | 30.9 | Very low | 29.5 | Very low | 232 Ų | 232 | 151.9 Ų | 151.9 | 88% | 0.875 | 76% | 0.759 | S | S | * | * | trans | -63.3 | 125 | 165.5 | -75.8 | -173 | 177.8 | -176 | 1.7 | 108.8 | V391 K395 | V391-R393 PolarHBondContact O-N 2.97Å; V391-R393 VanDerWaalsContact O-N 3.12Å; R393-K395 PolarHBondContact O-N 2.93Å | ||
| 394 | F | 33.1 | Very low | 29.5 | Very low | 210 Ų | 210 | 150.9 Ų | 150.9 | 92% | 0.921 | 76% | 0.755 | S | S | * | * | trans | -54.2 | 113.2 | 159.3 | -99.7 | -95.4 | 0 | 0 | 0 | 108.6 | P392 Q396 | P392-F394 PolarHBondContact O-N 3.37Å; F394-Q396 VanDerWaalsContact C-N 3.34Å; F394-Q396 PolarHBondContact O-N 3.35Å | ||
| 395 | K | 28.6 | Very low | 29.7 | Very low | 192 Ų | 192 | 147.7 Ų | 147.7 | 84% | 0.835 | 75% | 0.753 | S | S | * | * | trans | -72 | 91.8 | 170.4 | -71.1 | -174.9 | 179.4 | -179.3 | 0 | 108.3 | R393 T397 | R393-K395 PolarHBondContact O-N 2.93Å; K395-T397 VanDerWaalsContact C-N 3.3Å; K395-T397 PolarHBondContact O-N 3.28Å | ||
| 396 | Q | 28.8 | Very low | 29.9 | Very low | 177 Ų | 177 | 150.8 Ų | 150.8 | 83% | 0.827 | 76% | 0.764 | S | S | * | * | trans | -67.4 | 97.8 | 155.8 | -81.9 | -173.1 | -47.4 | 0 | 0 | 107.5 | F394 I398 | F394-Q396 VanDerWaalsContact C-N 3.34Å; F394-Q396 PolarHBondContact O-N 3.35Å; Q396-I398 VanDerWaalsContact C-N 3.34Å; Q396-I398 PolarHBondContact O-N 2.96Å | ||
| 397 | T | 26.5 | Very low | 29.8 | Very low | 114 Ų | 114 | 149.3 Ų | 149.3 | 70% | 0.699 | 77% | 0.77 | S | S | * | * | trans | -67.4 | 93 | 173 | -55.9 | 0 | 0 | 0 | 0 | 109 | K395 T399 | K395-T397 VanDerWaalsContact C-N 3.3Å; K395-T397 PolarHBondContact O-N 3.28Å; T397-T399 HydrophobicContact CG2-CG2 4.36Å | ||
| 398 | I | 29.5 | Very low | 29.8 | Very low | 144 Ų | 144 | 151.6 Ų | 151.6 | 74% | 0.738 | 77% | 0.774 | S | S | * | * | trans | -85.1 | 105.1 | 161.3 | -56.9 | 175.4 | 0 | 0 | 0 | 105.6 | Q396 P400 | Q396-I398 VanDerWaalsContact C-N 3.34Å; Q396-I398 PolarHBondContact O-N 2.96Å; I398-P400 WeakPolarHBondContact O-CD 3.46Å | ||
| 399 | T | 26.8 | Very low | 29.8 | Very low | 107 Ų | 107 | 150.3 Ų | 150.3 | 66% | 0.656 | 77% | 0.772 | S | S | * | * | trans | -74.7 | 113.5 | 176.5 | 11.6 | 0 | 0 | 0 | 0 | 110.3 | T397 | T397-T399 HydrophobicContact CG2-CG2 4.36Š| ||
| 400 | P | 26.5 | Very low | 29.8 | Very low | 118 Ų | 118 | 152.6 Ų | 152.6 | 77% | 0.766 | 78% | 0.78 | S | S | * | * | trans | -106.4 | 64.9 | -179.7 | 35.3 | -19.2 | 0 | 0 | 0 | 109.5 | I398 | I398-P400 WeakPolarHBondContact O-CD 3.46Š| ||
| 401 | T | 28.4 | Very low | 29.8 | Very low | 108 Ų | 108 | 153.9 Ų | 153.9 | 66% | 0.663 | 78% | 0.778 | S | S | * | * | trans | -134.7 | 71.7 | -170 | 54.5 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 402 | T | 33.5 | Very low | 29.7 | Very low | 116 Ų | 116 | 153 Ų | 153 | 71% | 0.712 | 78% | 0.778 | S | S | * | * | trans | -111 | 63.9 | 161.5 | 53.2 | 0 | 0 | 0 | 0 | 109.4 | F404 | T402-F404 VanDerWaalsContact C-N 3.33Å; T402-F404 HydrophobicContact CG2-CE2 4.29Å; T402-F404 PolarHBondContact O-N 3.32Å; T402-F404 VanDerWaalsContact O-N 3.11Å | ||
| 403 | N | 29.2 | Very low | 29.6 | Very low | 139 Ų | 139 | 154.5 Ų | 154.5 | 74% | 0.743 | 78% | 0.778 | S | S | * | * | trans | -79.9 | 83.5 | 172.4 | -169.9 | 20.8 | 0 | 0 | 0 | 108.9 | N405 | N403-N405 PolarHBondContact O-N 3.43Š| ||
| 404 | F | 28.7 | Very low | 29.7 | Very low | 184 Ų | 184 | 149.7 Ų | 149.7 | 81% | 0.807 | 77% | 0.774 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.5 | 88.9 | -179.6 | -77.7 | -82.2 | 0 | 0 | 0 | 111 | T402 | T402-F404 VanDerWaalsContact C-N 3.33Å; T402-F404 HydrophobicContact CG2-CE2 4.29Å; T402-F404 PolarHBondContact O-N 3.32Å; T402-F404 VanDerWaalsContact O-N 3.11Å |
| 405 | N | 30.7 | Very low | 29.6 | Very low | 142 Ų | 142 | 146.8 Ų | 146.8 | 76% | 0.759 | 77% | 0.768 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -153.6 | -20.9 | 165.5 | -99.3 | -33.2 | 0 | 0 | 0 | 115.2 | N403 | N403-N405 PolarHBondContact O-N 3.43Š|
| 406 | E | 32.7 | Very low | 29.4 | Very low | 180 Ų | 180 | 142.7 Ų | 142.7 | 84% | 0.841 | 76% | 0.764 | S | S | * | * | S | Bend | trans | -125.4 | 76 | -174.4 | -67.4 | -175.1 | 119.2 | 0 | 0 | 113.4 | ||
| 407 | L | 30.4 | Very low | 29.6 | Very low | 164 Ų | 164 | 143.4 Ų | 143.4 | 86% | 0.859 | 76% | 0.764 | S | S | * | * | trans | -161.4 | 59.1 | 155.3 | -117.4 | 161.8 | 0 | 0 | 0 | 112.7 | ||||
| 408 | F | 29.4 | Very low | 29.8 | Very low | 182 Ų | 182 | 143.9 Ų | 143.9 | 80% | 0.798 | 76% | 0.763 | S | S | * | * | trans | -65.8 | 156.5 | 157.6 | -103.3 | -94.9 | 0 | 0 | 0 | 110.4 | ||||
| 409 | M | 30.5 | Very low | 30 | Very low | 144 Ų | 144 | 144.9 Ų | 144.9 | 71% | 0.709 | 76% | 0.764 | S | S | * | * | trans | 60.2 | 88.7 | 175.2 | -44.4 | -49.1 | -179.1 | 0 | 0 | 114.4 | ||||
| 410 | N | 28.2 | Very low | 30.3 | Very low | 158 Ų | 158 | 144.5 Ų | 144.5 | 85% | 0.845 | 77% | 0.766 | S | S | * | * | -173.3 | 164.4 | 76.6 | -92.9 | -58.8 | 0 | 0 | 0 | 113.4 | |||||
| 411 | K | 29.7 | Very low | 30.8 | Very low | 183 Ų | 183 | 144 Ų | 144 | 80% | 0.796 | 77% | 0.765 | S | S | * | * | trans | 82.8 | 65.6 | 155.4 | -150.1 | 175.4 | -170.3 | 174.7 | 0 | 119 | ||||
| 412 | S | 30.9 | Very low | 31.1 | Very low | 103 Ų | 103 | 145.3 Ų | 145.3 | 72% | 0.72 | 77% | 0.768 | S | S | * | * | -62.2 | 139.4 | 121.1 | 47.3 | 0 | 0 | 0 | 0 | 107.9 | |||||
| 413 | I | 29 | Very low | 31.2 | Very low | 148 Ų | 148 | 147.1 Ų | 147.1 | 76% | 0.759 | 77% | 0.768 | S | S | * | * | cis | 58.1 | 62.3 | 41.5 | -44.8 | -179.3 | 0 | 0 | 0 | 110.4 | ||||
| 414 | T | 32.3 | Very low | 31.3 | Very low | 131 Ų | 131 | 147.8 Ų | 147.8 | 80% | 0.804 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -82.2 | 145.2 | 149.8 | 30 | 0 | 0 | 0 | 0 | 109.4 | ||
| 415 | D | 30.7 | Very low | 31.7 | Very low | 149 Ų | 149 | 147.1 Ų | 147.1 | 80% | 0.797 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -69.7 | 161.2 | -175.3 | -63.3 | -79.6 | 0 | 0 | 0 | 114.3 | F417 | D415-F417 PolarHBondContact O-N 2.79Š|
| 416 | S | 25.9 | Very low | 31.8 | Very low | 106 Ų | 106 | 146.5 Ų | 146.5 | 74% | 0.741 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -64.6 | 120.4 | 173.5 | 52.8 | 0 | 0 | 0 | 0 | 112.4 | ||
| 417 | F | 32 | Very low | 32 | Very low | 191 Ų | 191 | 145.1 Ų | 145.1 | 84% | 0.838 | 77% | 0.768 | S | S | * | * | trans | -153.8 | 119.8 | 149.2 | -107.8 | -69.8 | 0 | 0 | 0 | 113.2 | D415 | D415-F417 PolarHBondContact O-N 2.79Š| ||
| 418 | N | 30.9 | Very low | 32.2 | Very low | 124 Ų | 124 | 143.1 Ų | 143.1 | 66% | 0.663 | 76% | 0.758 | S | S | * | * | trans | 61.9 | 134.8 | 150.9 | -75.6 | -5.9 | 0 | 0 | 0 | 123.8 | ||||
| 419 | Q | 33 | Very low | 32.7 | Very low | 166 Ų | 166 | 140.8 Ų | 140.8 | 78% | 0.776 | 75% | 0.754 | S | S | * | * | trans | 82 | 103.4 | 139.1 | -73.6 | 175.6 | 10.6 | 0 | 0 | 121.6 | ||||
| 420 | S | 33.5 | Very low | 33.1 | Very low | 98 Ų | 98 | 139.7 Ų | 139.7 | 69% | 0.685 | 75% | 0.751 | S | S | * | * | 89.3 | 114.5 | 119.5 | -56.2 | 0 | 0 | 0 | 0 | 121.3 | |||||
| 421 | S | 37.8 | Very low | 33.6 | Very low | 107 Ų | 107 | 137.9 Ų | 137.9 | 75% | 0.748 | 74% | 0.741 | S | S | * | * | trans | 68.9 | 149.7 | 134.9 | 57 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 422 | L | 33.8 | Very low | 34.1 | Very low | 137 Ų | 137 | 135.4 Ų | 135.4 | 72% | 0.717 | 74% | 0.737 | S | S | * | * | cis | -162.5 | 158.6 | -9.5 | -112.9 | 166.4 | 0 | 0 | 0 | 109.7 | ||||
| 423 | Q | 35.6 | Very low | 34.5 | Very low | 154 Ų | 154 | 136.8 Ų | 136.8 | 72% | 0.72 | 74% | 0.736 | S | S | * | * | trans | 58.5 | 132.4 | 158.7 | -75.6 | 151.4 | -6.5 | 0 | 0 | 118.7 | ||||
| 424 | I | 31.2 | Very low | 34.8 | Very low | 152 Ų | 152 | 136.5 Ų | 136.5 | 78% | 0.779 | 74% | 0.736 | S | S | * | * | cis | 75.5 | 114.4 | 38.1 | -54.2 | 162.6 | 0 | 0 | 0 | 113.7 | ||||
| 425 | I | 37.4 | Very low | 35.1 | Very low | 171 Ų | 171 | 138.2 Ų | 138.2 | 88% | 0.877 | 74% | 0.737 | S | S | * | * | trans | -168.8 | 157.6 | 133 | -99.5 | 155.9 | 0 | 0 | 0 | 109.4 | ||||
| 426 | N | 33.1 | Very low | 35.2 | Very low | 129 Ų | 129 | 136.9 Ų | 136.9 | 69% | 0.69 | 74% | 0.735 | S | S | * | * | trans | -138.6 | 152.5 | -169.6 | 179.6 | 35.3 | 0 | 0 | 0 | 109.8 | ||||
| 427 | N | 35.9 | Very low | 35.7 | Very low | 151 Ų | 151 | 137.5 Ų | 137.5 | 81% | 0.807 | 74% | 0.736 | S | S | * | * | trans | 169.8 | 171.4 | 156.9 | -92.4 | -20.3 | 0 | 0 | 0 | 112.8 | ||||
| 428 | N | 36.3 | Very low | 36.1 | Very low | 122 Ų | 122 | 133.6 Ų | 133.6 | 65% | 0.652 | 73% | 0.73 | S | S | * | * | -167 | 167.8 | -71.2 | -140 | 18.5 | 0 | 0 | 0 | 110.4 | |||||
| 429 | N | 38.6 | Very low | 36.1 | Very low | 132 Ų | 132 | 134.7 Ų | 134.7 | 71% | 0.706 | 74% | 0.735 | S | S | * | * | trans | 69.2 | 154.2 | 167.8 | -50.8 | -4.5 | 0 | 0 | 0 | 115 | ||||
| 430 | N | 39.4 | Very low | 36.1 | Very low | 122 Ų | 122 | 133.9 Ų | 133.9 | 65% | 0.652 | 73% | 0.733 | S | S | * | * | cis | -162.2 | -175.3 | -7.9 | -112.8 | 29.5 | 0 | 0 | 0 | 106.9 | ||||
| 431 | D | 39.3 | Very low | 36.1 | Very low | 120 Ų | 120 | 135.6 Ų | 135.6 | 64% | 0.642 | 73% | 0.734 | S | S | * | * | cis | -152.9 | 127.4 | 0.4 | -111.2 | -51.1 | 0 | 0 | 0 | 105.7 | ||||
| 432 | N | 39.7 | Very low | 35.9 | Very low | 131 Ų | 131 | 138.9 Ų | 138.9 | 70% | 0.701 | 74% | 0.738 | S | S | * | * | 83.7 | 136.7 | 90.3 | -90.7 | -37.2 | 0 | 0 | 0 | 119.9 | |||||
| 433 | N | 39.4 | Very low | 35.8 | Very low | 132 Ų | 132 | 137.5 Ų | 137.5 | 71% | 0.706 | 74% | 0.737 | S | S | * | * | trans | 90 | 100.6 | 156 | -57.9 | -34.5 | 0 | 0 | 0 | 123.7 | ||||
| 434 | N | 34.5 | Very low | 35.7 | Very low | 141 Ų | 141 | 138 Ų | 138 | 75% | 0.754 | 74% | 0.743 | S | S | * | * | 40.4 | 124 | 125 | -52.5 | -22 | 0 | 0 | 0 | 120.5 | |||||
| 435 | M | 38.9 | Very low | 35.6 | Very low | 167 Ų | 167 | 137.8 Ų | 137.8 | 82% | 0.823 | 74% | 0.744 | S | S | * | * | -174.7 | 158.3 | 64.7 | -85.6 | -156.8 | 178.2 | 0 | 0 | 114.1 | |||||
| 436 | T | 33 | Very low | 35.1 | Very low | 122 Ų | 122 | 134 Ų | 134 | 75% | 0.748 | 73% | 0.732 | S | S | * | * | trans | 51.3 | 124.8 | 151.8 | 50.3 | 0 | 0 | 0 | 0 | 123.3 | ||||
| 437 | P | 37.3 | Very low | 34.9 | Very low | 118 Ų | 118 | 136.1 Ų | 136.1 | 77% | 0.766 | 74% | 0.738 | S | S | * | * | trans | -87.9 | -173.5 | 157.9 | 42.3 | -37.2 | 0 | 0 | 0 | 110.8 | ||||
| 438 | P | 39.1 | Very low | 34.5 | Very low | 110 Ų | 110 | 136.2 Ų | 136.2 | 71% | 0.714 | 73% | 0.733 | S | S | * | * | cis | -144.8 | -169.6 | 14.2 | 43.7 | -22.9 | 0 | 0 | 0 | 118 | ||||
| 439 | L | 31.7 | Very low | 34.3 | Very low | 147 Ų | 147 | 139.8 Ų | 139.8 | 77% | 0.77 | 74% | 0.739 | S | S | * | * | trans | 108.1 | 130.4 | 142.5 | -134 | 83.5 | 0 | 0 | 0 | 120.8 | ||||
| 440 | M | 33.2 | Very low | 33.8 | Very low | 148 Ų | 148 | 144.7 Ų | 144.7 | 73% | 0.729 | 75% | 0.748 | S | S | * | * | trans | 67.4 | 124.1 | 153.1 | -89.7 | 179.9 | 170.6 | 0 | 0 | 123.1 | ||||
| 441 | N | 33.1 | Very low | 33.4 | Very low | 135 Ų | 135 | 145 Ų | 145 | 72% | 0.722 | 75% | 0.754 | S | S | * | * | trans | 70.3 | 144.2 | 142.3 | -59.4 | -0.3 | 0 | 0 | 0 | 118.4 | ||||
| 442 | E | 32.8 | Very low | 33.2 | Very low | 176 Ų | 176 | 146.9 Ų | 146.9 | 82% | 0.822 | 76% | 0.763 | S | S | * | * | cis | -144.1 | 176.1 | -0.3 | -119.7 | -156.2 | 109.7 | 0 | 0 | 110.2 | ||||
| 443 | P | 33.2 | Very low | 33 | Very low | 107 Ų | 107 | 147.2 Ų | 147.2 | 70% | 0.695 | 77% | 0.77 | S | S | * | * | trans | -98 | 140.3 | -158.4 | 36.7 | -36.6 | 0 | 0 | 0 | 117 | ||||
| 444 | I | 32.9 | Very low | 33.2 | Very low | 164 Ų | 164 | 143.6 Ų | 143.6 | 84% | 0.841 | 76% | 0.763 | S | S | * | * | trans | -135 | 100.6 | 165 | -59 | -176.2 | 0 | 0 | 0 | 112.2 | ||||
| 445 | N | 28.2 | Very low | 33.6 | Very low | 149 Ų | 149 | 145 Ų | 145 | 80% | 0.797 | 77% | 0.766 | S | S | * | * | trans | 58 | 153 | 137 | -118 | -23 | 0 | 0 | 0 | 124.7 | ||||
| 446 | S | 27.7 | Very low | 34.1 | Very low | 92 Ų | 92 | 142 Ų | 142 | 64% | 0.643 | 76% | 0.761 | S | S | * | * | trans | 67.6 | 97.7 | 153.6 | 46 | 0 | 0 | 0 | 0 | 122.6 | ||||
| 447 | Q | 28.1 | Very low | 35 | Very low | 173 Ų | 173 | 141.1 Ų | 141.1 | 81% | 0.808 | 76% | 0.755 | S | S | * | * | 84.7 | 153.9 | 128.9 | -60.3 | -166.8 | 13.5 | 0 | 0 | 122.9 | |||||
| 448 | Q | 29.2 | Very low | 35.4 | Very low | 152 Ų | 152 | 138.3 Ų | 138.3 | 71% | 0.71 | 74% | 0.742 | S | S | * | * | trans | 91.5 | 144.3 | 153.6 | -79.4 | -179.3 | 33.7 | 0 | 0 | 122 | ||||
| 449 | Y | 31.5 | Very low | 36.1 | Very low | 197 Ų | 197 | 137.1 Ų | 137.1 | 77% | 0.773 | 73% | 0.733 | S | S | * | * | trans | 52.7 | 96.7 | 173.7 | -68.7 | -71.6 | 0 | 0 | 0 | 122.2 | ||||
| 450 | R | 27.3 | Very low | 37.1 | Very low | 235 Ų | 235 | 133 Ų | 133 | 89% | 0.887 | 72% | 0.721 | S | S | * | * | trans | -60 | 134.2 | 146.3 | -77.3 | 176.8 | 166 | -178.6 | -4.1 | 110.9 | ||||
| 451 | T | 30.6 | Very low | 38.6 | Very low | 129 Ų | 129 | 130.8 Ų | 130.8 | 79% | 0.791 | 72% | 0.715 | S | S | * | * | trans | -119.1 | 84.5 | 165.1 | 32.9 | 0 | 0 | 0 | 0 | 111 | ||||
| 452 | I | 36.7 | Very low | 40.3 | Very low | 160 Ų | 160 | 129.3 Ų | 129.3 | 82% | 0.821 | 71% | 0.711 | S | S | * | * | trans | -136.8 | 90.5 | 167.9 | -55.6 | 174.2 | 0 | 0 | 0 | 108.3 | ||||
| 453 | T | 35.6 | Very low | 42.1 | Very low | 137 Ų | 137 | 127.3 Ų | 127.3 | 84% | 0.84 | 70% | 0.703 | S | S | * | * | trans | -142.8 | 150 | -178.5 | 42.3 | 0 | 0 | 0 | 0 | 111 | ||||
| 454 | G | 42.1 | Very low | 43.8 | Very low | 56 Ų | 56 | 125.2 Ų | 125.2 | 58% | 0.577 | 70% | 0.695 | S | S | * | * | S | Bend | trans | 111 | -70.5 | 166.6 | 0 | 0 | 0 | 0 | 0 | 117.2 | S456 T457 | G454-S456 PolarHBondContact O-N 3.34Å; G454-T457 PolarHBondContact O-OG1 3.11Å |
| 455 | Q | 43.4 | Very low | 45.5 | Very low | 172 Ų | 172 | 120.3 Ų | 120.3 | 80% | 0.804 | 68% | 0.678 | S | S | * | * | H | α-helix | trans | -72.1 | -22.2 | -153.1 | -67.2 | -177.9 | -12.3 | 0 | 0 | 117.6 | T459 | Q455-T459 PolarHBondContact O-OG1 3Å |
| 456 | S | 49.7 | Very low | 47.5 | Very low | 103 Ų | 103 | 115.5 Ų | 115.5 | 72% | 0.72 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -76.1 | -36.6 | -172.7 | -162.7 | 0 | 0 | 0 | 0 | 113.4 | G454 A460 | G454-S456 PolarHBondContact O-N 3.34Å; S456-A460 PolarHBondContact O-N 3.14Å |
| 457 | T | 51 | Low | 49.5 | Very low | 103 Ų | 103 | 114 Ų | 114 | 63% | 0.632 | 65% | 0.652 | S | S | * | * | H | α-helix | trans | -71.7 | -41.5 | -177.6 | 43 | 0 | 0 | 0 | 0 | 112.7 | G454 T459 A460 V461 | G454-T457 PolarHBondContact O-OG1 3.11Å; T457-T459 VanDerWaalsContact C-N 3.35Å; T457-T459 PolarHBondContact O-N 3.25Å; T457-A460 PolarHBondContact O-N 3.02Å; T457-V461 WeakPolarHBondContact O-CG2 3.41Å; T457-V461 PolarHBondContact O-N 3.45Å |
| 458 | A | 46.7 | Very low | 51.4 | Low | 59 Ų | 59 | 108.7 Ų | 108.7 | 49% | 0.488 | 64% | 0.638 | S | S | . | * | H | α-helix | trans | -58.7 | -46.2 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | A460 V461 V462 | A458-A460 VanDerWaalsContact C-N 3.33Å; A458-A460 PolarHBondContact O-N 3.42Å; A458-V461 PolarHBondContact O-N 2.94Å; A458-V462 WeakPolarHBondContact O-CG2 3.45Å; A458-V462 PolarHBondContact O-N 3.33Å |
| 459 | T | 54.4 | Low | 53.4 | Low | 85 Ų | 85 | 104 Ų | 104 | 52% | 0.521 | 63% | 0.626 | S | S | . | * | H | α-helix | trans | -60.3 | -40.7 | 178.1 | -52.6 | 0 | 0 | 0 | 0 | 112.1 | Q455 T457 M463 | Q455-T459 PolarHBondContact O-OG1 3Å; T457-T459 VanDerWaalsContact C-N 3.35Å; T457-T459 PolarHBondContact O-N 3.25Å; T459-M463 WeakPolarHBondContact O-CB 3.3Å; T459-M463 PolarHBondContact O-N 3.21Å; T459-M463 VanDerWaalsContact O-N 3.14Å |
| 460 | A | 52.9 | Low | 55.3 | Low | 62 Ų | 62 | 100.2 Ų | 100.2 | 51% | 0.512 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -66.4 | -42 | 177 | 0 | 0 | 0 | 0 | 0 | 112.7 | S456 T457 A458 M463 A464 | S456-A460 PolarHBondContact O-N 3.14Å; T457-A460 PolarHBondContact O-N 3.02Å; A458-A460 VanDerWaalsContact C-N 3.33Å; A458-A460 PolarHBondContact O-N 3.42Å; A460-M463 PolarHBondContact O-N 3.47Å; A460-A464 WeakPolarHBondContact O-CB 3.42Å; A460-A464 PolarHBondContact O-N 3.26Å |
| 461 | V | 62.7 | Low | 57.1 | Low | 101 Ų | 101 | 92.1 Ų | 92.1 | 61% | 0.612 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -64.6 | -45.8 | 178.6 | 171.3 | 0 | 0 | 0 | 0 | 111.4 | T457 A458 M463 A464 A465 | T457-V461 WeakPolarHBondContact O-CG2 3.41Å; T457-V461 PolarHBondContact O-N 3.45Å; A458-V461 PolarHBondContact O-N 2.94Å; V461-M463 VanDerWaalsContact C-N 3.32Å; V461-M463 PolarHBondContact O-N 2.6Å; V461-A464 PolarHBondContact O-N 3.5Å; V461-A465 WeakPolarHBondContact O-CB 3.49Å; V461-A465 PolarHBondContact O-N 2.86Å |
| 462 | V | 70.3 | Confident | 58.8 | Low | 104 Ų | 104 | 89.1 Ų | 89.1 | 63% | 0.63 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -61.8 | -41 | 177.4 | 173.7 | 0 | 0 | 0 | 0 | 111.3 | A458 A465 A466 | A458-V462 WeakPolarHBondContact O-CG2 3.45Å; A458-V462 PolarHBondContact O-N 3.33Å; V462-A465 PolarHBondContact O-N 2.79Å; V462-A466 WeakPolarHBondContact O-CB 3.26Å; V462-A466 PolarHBondContact O-N 3.46Å |
| 463 | M | 70.6 | Confident | 60.1 | Low | 133 Ų | 133 | 88.1 Ų | 88.1 | 66% | 0.655 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -69.2 | -35.2 | 179.1 | -161.4 | 175.7 | -61.7 | 0 | 0 | 112.7 | T459 A460 V461 A467 | T459-M463 WeakPolarHBondContact O-CB 3.3Å; T459-M463 PolarHBondContact O-N 3.21Å; T459-M463 VanDerWaalsContact O-N 3.14Å; A460-M463 PolarHBondContact O-N 3.47Å; V461-M463 VanDerWaalsContact C-N 3.32Å; V461-M463 PolarHBondContact O-N 2.6Å; M463-A467 WeakPolarHBondContact O-CB 3.3Å; M463-A467 PolarHBondContact O-N 2.89Å; M463-A467 VanDerWaalsContact O-N 3.08Å |
| 464 | A | 67.6 | Low | 61.1 | Low | 63 Ų | 63 | 84.9 Ų | 84.9 | 52% | 0.521 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -67.5 | -43.2 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | A460 V461 A467 A468 | A460-A464 WeakPolarHBondContact O-CB 3.42Å; A460-A464 PolarHBondContact O-N 3.26Å; V461-A464 PolarHBondContact O-N 3.5Å; A464-A467 PolarHBondContact O-N 2.75Å; A464-A468 PolarHBondContact O-N 3.07Å |
| 465 | A | 69.7 | Low | 61.5 | Low | 61 Ų | 61 | 86.9 Ų | 86.9 | 50% | 0.504 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -62.5 | -42.9 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | V461 V462 A467 A468 A469 | V461-A465 WeakPolarHBondContact O-CB 3.49Å; V461-A465 PolarHBondContact O-N 2.86Å; V462-A465 PolarHBondContact O-N 2.79Å; A465-A467 PolarHBondContact O-N 2.77Å; A465-A468 PolarHBondContact O-N 3.44Å; A465-A469 PolarHBondContact O-N 3.28Å |
| 466 | A | 70.5 | Confident | 62 | Low | 48 Ų | 48 | 84 Ų | 84 | 40% | 0.397 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -62.1 | -41.4 | 175 | 0 | 0 | 0 | 0 | 0 | 112.3 | V462 A469 I470 | V462-A466 WeakPolarHBondContact O-CB 3.26Å; V462-A466 PolarHBondContact O-N 3.46Å; A466-A469 PolarHBondContact O-N 3Å; A466-I470 WeakPolarHBondContact O-CG1 3.34Å; A466-I470 PolarHBondContact O-N 2.81Å; A466-I470 VanDerWaalsContact O-N 3.09Å |
| 467 | A | 68.6 | Low | 61.8 | Low | 60 Ų | 60 | 86.1 Ų | 86.1 | 50% | 0.496 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -63.5 | -40.5 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | M463 A464 A465 I470 A471 | M463-A467 WeakPolarHBondContact O-CB 3.3Å; M463-A467 PolarHBondContact O-N 2.89Å; M463-A467 VanDerWaalsContact O-N 3.08Å; A464-A467 PolarHBondContact O-N 2.75Å; A465-A467 PolarHBondContact O-N 2.77Å; A467-I470 PolarHBondContact O-N 2.9Å; A467-A471 WeakPolarHBondContact O-CB 3.42Å; A467-A471 PolarHBondContact O-N 2.91Å |
| 468 | A | 68.5 | Low | 61.2 | Low | 62 Ų | 62 | 87.2 Ų | 87.2 | 51% | 0.512 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -64.9 | -42.4 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | A464 A465 I470 A471 A472 | A464-A468 PolarHBondContact O-N 3.07Å; A465-A468 PolarHBondContact O-N 3.44Å; A468-I470 PolarHBondContact O-N 3.01Å; A468-A471 PolarHBondContact O-N 2.96Å; A468-A472 PolarHBondContact O-N 2.93Å |
| 469 | A | 71.3 | Confident | 60.7 | Low | 55 Ų | 55 | 93.6 Ų | 93.6 | 46% | 0.455 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -62.8 | -42 | 177 | 0 | 0 | 0 | 0 | 0 | 112.5 | A465 A466 A472 Q473 | A465-A469 PolarHBondContact O-N 3.28Å; A466-A469 PolarHBondContact O-N 3Å; A469-A472 PolarHBondContact O-N 2.82Å; A469-Q473 PolarHBondContact O-N 3.4Å; A469-Q473 VanDerWaalsContact O-N 3.12Å |
| 470 | I | 71.6 | Confident | 59.8 | Low | 116 Ų | 116 | 95.4 Ų | 95.4 | 60% | 0.595 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -66.3 | -39.7 | 176.2 | -66.8 | 166.2 | 0 | 0 | 0 | 110.9 | A466 A467 A468 A472 Q473 A474 | A466-I470 WeakPolarHBondContact O-CG1 3.34Å; A466-I470 PolarHBondContact O-N 2.81Å; A466-I470 VanDerWaalsContact O-N 3.09Å; A467-I470 PolarHBondContact O-N 2.9Å; A468-I470 PolarHBondContact O-N 3.01Å; I470-A472 VanDerWaalsContact C-N 3.35Å; I470-A472 PolarHBondContact O-N 3.09Å; I470-Q473 PolarHBondContact O-N 3.12Å; I470-A474 WeakPolarHBondContact O-CB 3.38Å; I470-A474 PolarHBondContact O-N 2.89Å |
| 471 | A | 64.4 | Low | 59.1 | Low | 66 Ų | 66 | 100 Ų | 100 | 55% | 0.545 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -63.5 | -38.8 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | A467 A468 A474 S475 | A467-A471 WeakPolarHBondContact O-CB 3.42Å; A467-A471 PolarHBondContact O-N 2.91Å; A468-A471 PolarHBondContact O-N 2.96Å; A471-A474 PolarHBondContact O-N 2.93Å; A471-S475 PolarHBondContact O-N 3.19Å |
| 472 | A | 65.8 | Low | 57.8 | Low | 65 Ų | 65 | 102.4 Ų | 102.4 | 54% | 0.537 | 63% | 0.63 | S | S | . | * | H | α-helix | trans | -63.8 | -43.9 | 175 | 0 | 0 | 0 | 0 | 0 | 112.2 | A468 A469 I470 S475 | A468-A472 PolarHBondContact O-N 2.93Å; A469-A472 PolarHBondContact O-N 2.82Å; I470-A472 VanDerWaalsContact C-N 3.35Å; I470-A472 PolarHBondContact O-N 3.09Å; A472-S475 WeakPolarHBondContact O-CB 3.16Å; A472-S475 PolarHBondContact O-N 3.03Å |
| 473 | Q | 65.4 | Low | 56.2 | Low | 139 Ų | 139 | 103.2 Ų | 103.2 | 65% | 0.65 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -71 | -29.8 | 177.7 | -69.9 | -176.4 | -5.9 | 0 | 0 | 113.5 | A469 I470 S475 T476 | A469-Q473 PolarHBondContact O-N 3.4Å; A469-Q473 VanDerWaalsContact O-N 3.12Å; I470-Q473 PolarHBondContact O-N 3.12Å; Q473-S475 PolarHBondContact O-N 2.86Å; Q473-T476 PolarHBondContact O-N 3.36Å; Q473-T476 PolarHBondContact O-OG1 3.31Å; Q473-T476 VanDerWaalsContact O-OG1 3.11Å |
| 474 | A | 56.8 | Low | 54.5 | Low | 70 Ų | 70 | 104.7 Ų | 104.7 | 58% | 0.579 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -65.6 | -22.3 | 174.4 | 0 | 0 | 0 | 0 | 0 | 113 | I470 A471 | I470-A474 WeakPolarHBondContact O-CB 3.38Å; I470-A474 PolarHBondContact O-N 2.89Å; A471-A474 PolarHBondContact O-N 2.93Å |
| 475 | S | 50.4 | Low | 53.1 | Low | 97 Ų | 97 | 108.3 Ų | 108.3 | 68% | 0.678 | 66% | 0.658 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.1 | -21.2 | -179.2 | -159.2 | 0 | 0 | 0 | 0 | 113.8 | A471 A472 Q473 | A471-S475 PolarHBondContact O-N 3.19Å; A472-S475 WeakPolarHBondContact O-CB 3.16Å; A472-S475 PolarHBondContact O-N 3.03Å; Q473-S475 PolarHBondContact O-N 2.86Å |
| 476 | T | 52.9 | Low | 51.5 | Low | 112 Ų | 112 | 112.3 Ų | 112.3 | 69% | 0.687 | 68% | 0.676 | S | S | * | * | S | Bend | trans | -95 | 1 | -171.5 | 56.1 | 0 | 0 | 0 | 0 | 114.8 | Q473 | Q473-T476 PolarHBondContact O-N 3.36Å; Q473-T476 PolarHBondContact O-OG1 3.31Å; Q473-T476 VanDerWaalsContact O-OG1 3.11Å |
| 477 | L | 44.7 | Very low | 49.9 | Very low | 147 Ų | 147 | 114.7 Ų | 114.7 | 77% | 0.77 | 69% | 0.69 | S | S | * | * | S | Bend | trans | -115.6 | 31.3 | -169.8 | -80.9 | 167.9 | 0 | 0 | 0 | 115.3 | ||
| 478 | T | 39.3 | Very low | 48.4 | Very low | 126 Ų | 126 | 120.9 Ų | 120.9 | 77% | 0.773 | 71% | 0.711 | S | S | * | * | trans | -136.8 | 76.2 | 171.7 | 47.9 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 479 | K | 37.2 | Very low | 46.9 | Very low | 193 Ų | 193 | 124 Ų | 124 | 84% | 0.839 | 72% | 0.718 | S | S | * | * | trans | -147.4 | 112.1 | 155.7 | -124.3 | 173.7 | -174.6 | 178.5 | 0 | 113.5 | ||||
| 480 | T | 34.2 | Very low | 45.3 | Very low | 124 Ų | 124 | 129.4 Ų | 129.4 | 76% | 0.761 | 74% | 0.737 | S | S | * | * | trans | 47.4 | 114.3 | 147.2 | 54 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 481 | N | 38.5 | Very low | 43.5 | Very low | 159 Ų | 159 | 130.4 Ų | 130.4 | 85% | 0.85 | 74% | 0.744 | S | S | * | * | trans | -147.2 | 139.2 | 131.2 | -108.8 | -21.1 | 0 | 0 | 0 | 111.2 | ||||
| 482 | N | 35.4 | Very low | 42.2 | Very low | 150 Ų | 150 | 132.3 Ų | 132.3 | 80% | 0.802 | 75% | 0.753 | S | S | * | * | trans | 54.6 | 122 | 173.4 | -66.5 | 0.1 | 0 | 0 | 0 | 120.4 | ||||
| 483 | P | 35.9 | Very low | 40.9 | Very low | 121 Ų | 121 | 134.5 Ų | 134.5 | 79% | 0.786 | 76% | 0.76 | S | S | * | * | trans | -91.3 | 157.6 | 158.5 | 37.3 | -31.9 | 0 | 0 | 0 | 111.6 | ||||
| 484 | L | 36.8 | Very low | 39.5 | Very low | 165 Ų | 165 | 134.8 Ų | 134.8 | 86% | 0.864 | 77% | 0.766 | S | S | * | * | trans | -155.7 | 148.1 | 150.9 | -144.5 | 77.3 | 0 | 0 | 0 | 112.7 | ||||
| 485 | N | 37.4 | Very low | 38.6 | Very low | 139 Ų | 139 | 137.4 Ų | 137.4 | 74% | 0.743 | 78% | 0.78 | S | S | * | * | trans | -27.1 | 132.8 | 172.9 | -54.8 | -23.4 | 0 | 0 | 0 | 117.3 | ||||
| 486 | T | 36.2 | Very low | 38 | Very low | 144 Ų | 144 | 139.4 Ų | 139.4 | 88% | 0.883 | 78% | 0.783 | S | S | * | * | -150.6 | 138 | 104.4 | -18.3 | 0 | 0 | 0 | 0 | 111.1 | |||||
| 487 | S | 36.4 | Very low | 37.2 | Very low | 98 Ų | 98 | 142 Ų | 142 | 69% | 0.685 | 79% | 0.792 | S | S | * | * | trans | -86.5 | 148.5 | 176 | 50.1 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 488 | M | 37.4 | Very low | 36.7 | Very low | 190 Ų | 190 | 142.3 Ų | 142.3 | 94% | 0.936 | 79% | 0.787 | S | S | * | * | trans | -140.3 | 127.4 | 149.1 | -161 | 165.6 | -72.2 | 0 | 0 | 109.1 | ||||
| 489 | I | 36.1 | Very low | 36.9 | Very low | 129 Ų | 129 | 143.9 Ų | 143.9 | 66% | 0.662 | 79% | 0.789 | S | S | * | * | trans | -105.5 | 131.3 | -170.3 | -61.8 | 159.2 | 0 | 0 | 0 | 108.7 | ||||
| 490 | I | 39.1 | Very low | 37 | Very low | 167 Ų | 167 | 140.9 Ų | 140.9 | 86% | 0.856 | 78% | 0.782 | S | S | * | * | trans | -140.9 | 118.2 | 153.8 | -59.7 | -175.3 | 0 | 0 | 0 | 107.7 | ||||
| 491 | D | 32.4 | Very low | 37.1 | Very low | 137 Ų | 137 | 142.7 Ų | 142.7 | 73% | 0.733 | 78% | 0.782 | S | S | * | * | trans | -81.6 | 148.7 | 173.5 | -72.2 | -74.5 | 0 | 0 | 0 | 112.7 | ||||
| 492 | S | 38.8 | Very low | 37.2 | Very low | 106 Ų | 106 | 140.6 Ų | 140.6 | 74% | 0.741 | 78% | 0.777 | S | S | * | * | trans | -158.6 | 76.2 | 150.4 | 53.2 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 493 | T | 38.6 | Very low | 37.3 | Very low | 112 Ų | 112 | 141.6 Ų | 141.6 | 69% | 0.687 | 77% | 0.774 | S | S | * | * | trans | 46.5 | 121.7 | 135.6 | 57.8 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 494 | N | 35.1 | Very low | 37.6 | Very low | 145 Ų | 145 | 142.5 Ų | 142.5 | 78% | 0.775 | 78% | 0.777 | S | S | * | * | trans | 74.9 | 91.6 | 134.4 | -55.8 | -9.1 | 0 | 0 | 0 | 120.2 | ||||
| 495 | S | 38.7 | Very low | 37.6 | Very low | 125 Ų | 125 | 142.3 Ų | 142.3 | 87% | 0.874 | 78% | 0.776 | S | S | * | * | trans | -135.3 | 100 | 134.3 | 53.6 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 496 | L | 36.3 | Very low | 37.9 | Very low | 139 Ų | 139 | 144.3 Ų | 144.3 | 73% | 0.728 | 78% | 0.78 | S | S | * | * | trans | -85.4 | 134.2 | 175.6 | -78.8 | 157.8 | 0 | 0 | 0 | 110.4 | F498 | L496-F498 HydrophobicContact CD2-CE2 4.17Š| ||
| 497 | L | 36.7 | Very low | 38 | Very low | 167 Ų | 167 | 145 Ų | 145 | 87% | 0.874 | 77% | 0.773 | S | S | * | * | trans | -154.5 | 130.8 | 149.2 | -127.6 | 154.3 | 0 | 0 | 0 | 110.8 | ||||
| 498 | F | 34 | Very low | 38 | Very low | 153 Ų | 153 | 145.2 Ų | 145.2 | 67% | 0.671 | 77% | 0.771 | S | S | * | * | trans | -92.5 | 156.6 | -176.2 | -72.7 | -106.6 | 0 | 0 | 0 | 112.2 | L496 | L496-F498 HydrophobicContact CD2-CE2 4.17Š| ||
| 499 | I | 44.2 | Very low | 37.9 | Very low | 159 Ų | 159 | 142.1 Ų | 142.1 | 82% | 0.815 | 76% | 0.758 | S | S | * | * | trans | -174.1 | 98.5 | 138.3 | -90.4 | 144.5 | 0 | 0 | 0 | 104.1 | ||||
| 500 | N | 39.9 | Very low | 37.9 | Very low | 130 Ų | 130 | 143.8 Ų | 143.8 | 70% | 0.695 | 77% | 0.768 | S | S | * | * | 74.7 | 108.5 | 79.3 | -74.5 | 10.2 | 0 | 0 | 0 | 114.3 | |||||
| 501 | E | 35.9 | Very low | 37.9 | Very low | 162 Ų | 162 | 141.5 Ų | 141.5 | 76% | 0.757 | 76% | 0.757 | S | S | * | * | trans | -69 | 163.8 | 156.7 | -146.2 | -176.2 | -148.4 | 0 | 0 | 109.5 | ||||
| 502 | P | 40.5 | Very low | 38.4 | Very low | 115 Ų | 115 | 141.7 Ų | 141.7 | 75% | 0.747 | 76% | 0.758 | S | S | * | * | -150.5 | 174.6 | 92.8 | 40.2 | -23.3 | 0 | 0 | 0 | 115.7 | |||||
| 503 | K | 37.3 | Very low | 38.6 | Very low | 171 Ų | 171 | 144.7 Ų | 144.7 | 74% | 0.743 | 76% | 0.764 | S | S | * | * | trans | -84.2 | 156.7 | 164.1 | -63.4 | 171.8 | -180 | 170.6 | 0 | 111.8 | ||||
| 504 | T | 40.9 | Very low | 38.9 | Very low | 139 Ų | 139 | 146.2 Ų | 146.2 | 85% | 0.853 | 77% | 0.768 | S | S | * | * | trans | -139.8 | 145.9 | 158.2 | 28.8 | 0 | 0 | 0 | 0 | 111 | ||||
| 505 | I | 38.5 | Very low | 39.1 | Very low | 161 Ų | 161 | 144.4 Ų | 144.4 | 83% | 0.826 | 77% | 0.766 | S | S | * | * | trans | -142.2 | 102.5 | 175.9 | -61.2 | 174.2 | 0 | 0 | 0 | 107.8 | ||||
| 506 | E | 42.2 | Very low | 39.2 | Very low | 181 Ų | 181 | 146.5 Ų | 146.5 | 85% | 0.846 | 76% | 0.762 | S | S | * | * | trans | -159.7 | 158.7 | 174.3 | -77.2 | -169.1 | 174.6 | 0 | 0 | 108.8 | ||||
| 507 | Q | 38.3 | Very low | 39.5 | Very low | 158 Ų | 158 | 146.9 Ų | 146.9 | 74% | 0.738 | 76% | 0.764 | S | S | * | * | cis | -158.7 | 145.5 | -43 | -138.9 | -179.4 | -88.7 | 0 | 0 | 110.2 | ||||
| 508 | T | 37.2 | Very low | 39.5 | Very low | 104 Ų | 104 | 145.3 Ų | 145.3 | 64% | 0.638 | 76% | 0.756 | S | S | * | * | trans | 11.8 | 139.5 | 156.2 | 52.2 | 0 | 0 | 0 | 0 | 124.3 | ||||
| 509 | N | 34.5 | Very low | 40.1 | Very low | 125 Ų | 125 | 144 Ų | 144 | 67% | 0.668 | 76% | 0.76 | S | S | * | * | trans | 76.8 | 119.1 | 141.1 | -69.2 | 27.7 | 0 | 0 | 0 | 122.8 | ||||
| 510 | L | 37.7 | Very low | 40 | Very low | 163 Ų | 163 | 149.8 Ų | 149.8 | 85% | 0.853 | 78% | 0.779 | S | S | * | * | -171.5 | 110.5 | 121.8 | -122.2 | 62.6 | 0 | 0 | 0 | 105.3 | |||||
| 511 | D | 39.3 | Very low | 40 | Very low | 119 Ų | 119 | 150.8 Ų | 150.8 | 64% | 0.636 | 78% | 0.784 | S | S | * | * | 76.4 | 128.1 | 64.8 | -64.3 | -40.3 | 0 | 0 | 0 | 114.3 | |||||
| 512 | D | 41.6 | Very low | 40.3 | Very low | 141 Ų | 141 | 150.2 Ų | 150.2 | 75% | 0.754 | 79% | 0.785 | S | S | * | * | trans | 48.1 | 123.6 | 169 | -69.7 | -34.2 | 0 | 0 | 0 | 122.2 | ||||
| 513 | I | 44.1 | Very low | 40.2 | Very low | 169 Ų | 169 | 152.1 Ų | 152.1 | 87% | 0.867 | 79% | 0.787 | S | S | * | * | -161.2 | 130.1 | 104.4 | -97.4 | 156.6 | 0 | 0 | 0 | 110.3 | |||||
| 514 | N | 43 | Very low | 40.4 | Very low | 144 Ų | 144 | 151 Ų | 151 | 77% | 0.77 | 79% | 0.79 | S | S | * | * | trans | -86.3 | 137 | 168.1 | -79.7 | -70.8 | 0 | 0 | 0 | 110.7 | ||||
| 515 | C | 40.1 | Very low | 40.4 | Very low | 108 Ų | 108 | 151.8 Ų | 151.8 | 73% | 0.73 | 79% | 0.786 | S | S | * | * | trans | -169.6 | 115.7 | 136 | -104.4 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 516 | E | 42.1 | Very low | 40.5 | Very low | 168 Ų | 168 | 151.1 Ų | 151.1 | 79% | 0.785 | 78% | 0.783 | S | S | * | * | 88 | 91.2 | 84.5 | -166.1 | 167.2 | -151.3 | 0 | 0 | 109.8 | |||||
| 517 | L | 41.2 | Very low | 40.4 | Very low | 148 Ų | 148 | 149 Ų | 149 | 78% | 0.775 | 78% | 0.778 | S | S | * | * | 77.8 | 125.4 | 61 | -167.8 | 77.1 | 0 | 0 | 0 | 112.5 | |||||
| 518 | L | 38 | Very low | 40.5 | Very low | 134 Ų | 134 | 148.3 Ų | 148.3 | 70% | 0.702 | 78% | 0.782 | S | S | * | * | trans | 68.1 | 113.5 | 163.6 | -76.1 | 162.8 | 0 | 0 | 0 | 120.6 | ||||
| 519 | T | 45.9 | Very low | 40.8 | Very low | 124 Ų | 124 | 152 Ų | 152 | 76% | 0.761 | 79% | 0.794 | S | S | * | * | trans | 59.5 | 96.3 | 138.3 | 54.9 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 520 | K | 42.5 | Very low | 41.4 | Very low | 281 Ų | 281 | 154.5 Ų | 154.5 | 100% | 1.222 | 81% | 0.805 | S | S | * | * | -151.5 | 0 | 108.8 | -122.4 | 172.4 | -176 | 173.1 | 0 | 112.4 |
Retrieved 520 of 520 residues in 189.4 ms
(Link to these results)