| 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 | 37 | Very low | 40.3 | Very low | 251 Ų | 251 | 146.1 Ų | 146.1 | 100% | 1.236 | 79% | 0.794 | S | S | * | * | 0 | 136.3 | 0 | -79.7 | 170.7 | 169.3 | 0 | 0 | 107.8 | |||||
| 2 | R | 34.1 | Very low | 40.7 | Very low | 245 Ų | 245 | 142.3 Ų | 142.3 | 93% | 0.925 | 77% | 0.773 | S | S | * | * | trans | -80.8 | 133.3 | -155.5 | -149.3 | 176.1 | -135 | 155.3 | 0 | 110.9 | T4 | R2-T4 PolarHBondContact O-N 3.43Š| ||
| 3 | S | 35.5 | Very low | 41.3 | Very low | 117 Ų | 117 | 145.8 Ų | 145.8 | 82% | 0.818 | 77% | 0.768 | S | S | * | * | trans | -54.3 | 124.1 | 175.9 | -62.9 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 4 | T | 40.6 | Very low | 42 | Very low | 138 Ų | 138 | 137.6 Ų | 137.6 | 85% | 0.847 | 74% | 0.736 | S | S | * | * | trans | -103 | 42.8 | 173.9 | 49.5 | 0 | 0 | 0 | 0 | 111.3 | R2 | R2-T4 PolarHBondContact O-N 3.43Š| ||
| 5 | A | 40.8 | Very low | 42.6 | Very low | 92 Ų | 92 | 135.1 Ų | 135.1 | 76% | 0.76 | 72% | 0.721 | S | S | * | * | trans | -116.7 | 23.2 | -176 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 6 | G | 36.4 | Very low | 43.1 | Very low | 50 Ų | 50 | 130.9 Ų | 130.9 | 52% | 0.515 | 70% | 0.698 | S | S | . | * | S | Bend | trans | -124.1 | 6.4 | -173.7 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||
| 7 | C | 39.3 | Very low | 43.6 | Very low | 104 Ų | 104 | 129.5 Ų | 129.5 | 70% | 0.703 | 68% | 0.682 | S | S | * | * | S | Bend | trans | -111.7 | -9.2 | -174.6 | -67.1 | 0 | 0 | 0 | 0 | 114.9 | ||
| 8 | E | 44 | Very low | 43.9 | Very low | 178 Ų | 178 | 125.8 Ų | 125.8 | 83% | 0.832 | 67% | 0.669 | S | S | * | * | S | Bend | trans | -96 | -16.9 | -179.4 | -81 | 177.4 | 101.4 | 0 | 0 | 114.1 | ||
| 9 | E | 43.7 | Very low | 44.1 | Very low | 168 Ų | 168 | 128.6 Ų | 128.6 | 79% | 0.785 | 67% | 0.669 | S | S | * | * | H | α-helix | trans | -85.4 | -24.1 | -178.1 | -106.7 | 179.9 | 139.3 | 0 | 0 | 114.2 | ||
| 10 | E | 44.9 | Very low | 44.6 | Very low | 152 Ų | 152 | 131.1 Ų | 131.1 | 71% | 0.71 | 67% | 0.669 | S | S | * | * | H | α-helix | trans | -76.6 | -29.4 | -178.9 | -69.3 | -171.2 | 121.8 | 0 | 0 | 112.8 | G14 | E10-G14 PolarHBondContact O-N 3.44Å |
| 11 | D | 47.4 | Very low | 44.9 | Very low | 112 Ų | 112 | 131.9 Ų | 131.9 | 60% | 0.599 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -72.1 | -37 | -179 | -72.1 | -29.9 | 0 | 0 | 0 | 112.5 | W13 G14 I15 | D11-W13 VanDerWaalsContact C-N 3.35Å; D11-W13 PolarHBondContact O-N 2.95Å; D11-G14 PolarHBondContact O-N 3.34Å; D11-I15 VanDerWaalsContact O-CG1 3.29Å; D11-I15 WeakPolarHBondContact O-CG1 3.26Å; D11-I15 PolarHBondContact O-N 3.37Å |
| 12 | D | 45 | Very low | 45.3 | Very low | 101 Ų | 101 | 125.5 Ų | 125.5 | 54% | 0.54 | 63% | 0.634 | S | S | . | * | H | α-helix | trans | -69.6 | -34 | 179.1 | -167.7 | 61.3 | 0 | 0 | 0 | 112.1 | N16 | D12-N16 WeakPolarHBondContact O-CB 3.2Å; D12-N16 PolarHBondContact O-N 2.94Å; D12-N16 PolarHBondContact O-ND2 3.32Å; D12-N16 PolarHBondContact OD2-ND2 2.94Å |
| 13 | W | 48.1 | Very low | 46.1 | Very low | 188 Ų | 188 | 118 Ų | 118 | 71% | 0.712 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -68.9 | -41.1 | 174.7 | -167.3 | 88.5 | 0 | 0 | 0 | 111.8 | D11 N16 Y17 | D11-W13 VanDerWaalsContact C-N 3.35Å; D11-W13 PolarHBondContact O-N 2.95Å; W13-N16 PolarHBondContact O-N 2.83Å; W13-Y17 HydrophobicContact CH2-CD2 4.31Å; W13-Y17 VanDerWaalsContact O-CB 3.26Å; W13-Y17 WeakPolarHBondContact O-CB 3.15Å; W13-Y17 PolarHBondContact O-N 2.68Å |
| 14 | G | 50.8 | Low | 46.7 | Very low | 31 Ų | 31 | 119.7 Ų | 119.7 | 32% | 0.32 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -63.3 | -41.6 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | E10 D11 S18 | E10-G14 PolarHBondContact O-N 3.44Å; D11-G14 PolarHBondContact O-N 3.34Å; G14-S18 WeakPolarHBondContact O-CB 3.45Å; G14-S18 PolarHBondContact O-N 2.84Å; G14-S18 PolarHBondContact O-OG 2.8Å |
| 15 | I | 51.2 | Low | 47.1 | Very low | 100 Ų | 100 | 117.1 Ų | 117.1 | 51% | 0.513 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -68.9 | -42.5 | 177.7 | -66.8 | 172.3 | 0 | 0 | 0 | 110.8 | D11 S18 R19 | D11-I15 VanDerWaalsContact O-CG1 3.29Å; D11-I15 WeakPolarHBondContact O-CG1 3.26Å; D11-I15 PolarHBondContact O-N 3.37Å; I15-S18 PolarHBondContact O-N 2.72Å; I15-R19 VanDerWaalsContact O-CB 3.29Å; I15-R19 WeakPolarHBondContact O-CB 3.14Å; I15-R19 PolarHBondContact O-N 3.41Å |
| 16 | N | 50.5 | Low | 47.1 | Very low | 67 Ų | 67 | 119.3 Ų | 119.3 | 36% | 0.358 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -66.7 | -38 | 176.4 | -91.3 | -55.3 | 0 | 0 | 0 | 112.7 | D12 W13 R20 | D12-N16 WeakPolarHBondContact O-CB 3.2Å; D12-N16 PolarHBondContact O-N 2.94Å; D12-N16 PolarHBondContact O-ND2 3.32Å; D12-N16 PolarHBondContact OD2-ND2 2.94Å; W13-N16 PolarHBondContact O-N 2.83Å; N16-R20 VanDerWaalsContact O-CB 3.25Å; N16-R20 WeakPolarHBondContact O-CB 3.2Å; N16-R20 PolarHBondContact O-N 3.33Å |
| 17 | Y | 52.6 | Low | 47.6 | Very low | 107 Ų | 107 | 121.6 Ų | 121.6 | 42% | 0.42 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -64.2 | -45.2 | 174.8 | -176.4 | -97.7 | 0 | 0 | 0 | 111.5 | W13 R20 R21 | W13-Y17 HydrophobicContact CH2-CD2 4.31Å; W13-Y17 VanDerWaalsContact O-CB 3.26Å; W13-Y17 WeakPolarHBondContact O-CB 3.15Å; W13-Y17 PolarHBondContact O-N 2.68Å; Y17-R20 PolarHBondContact O-N 2.94Å; Y17-R21 VanDerWaalsContact CE1-NE 3.26Å; Y17-R21 WeakPolarHBondContact O-CB 3.39Å; Y17-R21 PolarHBondContact O-N 3.07Å; Y17-R21 PolarHBondContact OH-NE 2.93Å; Y17-R21 PolarHBondContact OH-NH2 3.16Å |
| 18 | S | 48.5 | Very low | 47.7 | Very low | 64 Ų | 64 | 123.4 Ų | 123.4 | 45% | 0.448 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -62.4 | -44.8 | 177.8 | -56.6 | 0 | 0 | 0 | 0 | 111.9 | G14 I15 R20 R21 L22 | G14-S18 WeakPolarHBondContact O-CB 3.45Å; G14-S18 PolarHBondContact O-N 2.84Å; G14-S18 PolarHBondContact O-OG 2.8Å; I15-S18 PolarHBondContact O-N 2.72Å; S18-R20 VanDerWaalsContact C-N 3.34Å; S18-R20 PolarHBondContact O-N 3.22Å; S18-R21 PolarHBondContact O-N 3.12Å; S18-L22 WeakPolarHBondContact O-CD1 3.27Å; S18-L22 PolarHBondContact O-N 3.27Å |
| 19 | R | 47.7 | Very low | 47.6 | Very low | 178 Ų | 178 | 119.9 Ų | 119.9 | 67% | 0.672 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -64.1 | -38.3 | 177.1 | -174 | 173.2 | -73.9 | -164.9 | -1.5 | 112 | I15 L22 S23 | I15-R19 VanDerWaalsContact O-CB 3.29Å; I15-R19 WeakPolarHBondContact O-CB 3.14Å; I15-R19 PolarHBondContact O-N 3.41Å; R19-L22 PolarHBondContact O-N 3.45Å; R19-S23 PolarHBondContact O-N 3.31Å; R19-S23 VanDerWaalsContact O-N 3.12Å; R19-S23 PolarHBondContact O-OG 3.5Å |
| 20 | R | 53.1 | Low | 47.7 | Very low | 178 Ų | 178 | 118.8 Ų | 118.8 | 67% | 0.672 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -74.2 | -29.5 | 177.1 | -155.5 | 178.7 | -68.9 | -170.3 | -0.5 | 112.7 | N16 Y17 S18 S23 Q24 | N16-R20 VanDerWaalsContact O-CB 3.25Å; N16-R20 WeakPolarHBondContact O-CB 3.2Å; N16-R20 PolarHBondContact O-N 3.33Å; Y17-R20 PolarHBondContact O-N 2.94Å; S18-R20 VanDerWaalsContact C-N 3.34Å; S18-R20 PolarHBondContact O-N 3.22Å; R20-S23 WeakPolarHBondContact CA-OG 2.9Å; R20-S23 PolarHBondContact O-OG 2.76Å; R20-S23 VanDerWaalsContact O-OG 3.08Å; R20-Q24 PolarHBondContact O-N 2.78Å |
| 21 | R | 51.7 | Low | 47.6 | Very low | 149 Ų | 149 | 119.3 Ų | 119.3 | 56% | 0.562 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -70.7 | -40 | 170.9 | -121.5 | -175.3 | -149.9 | -154.3 | 9.7 | 112.1 | Y17 S18 Q24 L25 | Y17-R21 VanDerWaalsContact CE1-NE 3.26Å; Y17-R21 WeakPolarHBondContact O-CB 3.39Å; Y17-R21 PolarHBondContact O-N 3.07Å; Y17-R21 PolarHBondContact OH-NE 2.93Å; Y17-R21 PolarHBondContact OH-NH2 3.16Å; S18-R21 PolarHBondContact O-N 3.12Å; R21-Q24 PolarHBondContact O-N 3.28Å; R21-L25 PolarHBondContact O-N 3.05Å |
| 22 | L | 45.3 | Very low | 47.5 | Very low | 116 Ų | 116 | 115.8 Ų | 115.8 | 61% | 0.607 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -64.4 | -40 | 175 | -106.5 | 91.9 | 0 | 0 | 0 | 111.9 | S18 R19 L25 | S18-L22 WeakPolarHBondContact O-CD1 3.27Å; S18-L22 PolarHBondContact O-N 3.27Å; R19-L22 PolarHBondContact O-N 3.45Å; L22-L25 PolarHBondContact O-N 3.47Å |
| 23 | S | 50.3 | Low | 47.1 | Very low | 89 Ų | 89 | 117 Ų | 117 | 62% | 0.622 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -74.8 | -24.1 | 179.4 | 59.3 | 0 | 0 | 0 | 0 | 113.9 | R19 R20 | R19-S23 PolarHBondContact O-N 3.31Å; R19-S23 VanDerWaalsContact O-N 3.12Å; R19-S23 PolarHBondContact O-OG 3.5Å; R20-S23 WeakPolarHBondContact CA-OG 2.9Å; R20-S23 PolarHBondContact O-OG 2.76Å; R20-S23 VanDerWaalsContact O-OG 3.08Å |
| 24 | Q | 48.4 | Very low | 46.8 | Very low | 151 Ų | 151 | 113.2 Ų | 113.2 | 71% | 0.706 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -81.7 | -11.5 | 173.7 | -83 | -131.5 | 6.4 | 0 | 0 | 114.8 | R20 R21 Q26 | R20-Q24 PolarHBondContact O-N 2.78Å; R21-Q24 PolarHBondContact O-N 3.28Å; Q24-Q26 PolarHBondContact O-N 3.49Å |
| 25 | L | 49.5 | Very low | 46.7 | Very low | 85 Ų | 85 | 115.6 Ų | 115.6 | 45% | 0.445 | 56% | 0.555 | S | S | . | * | S | Bend | trans | -73.5 | 80.3 | 166.8 | -74.4 | 161.6 | 0 | 0 | 0 | 108.8 | R21 L22 W30 | R21-L25 PolarHBondContact O-N 3.05Å; L22-L25 PolarHBondContact O-N 3.47Å; L25-W30 PolarHBondContact O-NE1 3.33Å |
| 26 | Q | 40.3 | Very low | 46.6 | Very low | 137 Ų | 137 | 114.6 Ų | 114.6 | 64% | 0.64 | 55% | 0.549 | S | S | * | . | trans | -42.4 | 150.4 | -179.2 | -86.5 | -167.7 | -76.4 | 0 | 0 | 114.6 | Q24 L28 K29 | Q24-Q26 PolarHBondContact O-N 3.49Å; Q26-L28 PolarHBondContact O-N 3.28Å; Q26-K29 PolarHBondContact O-N 3.13Å | ||
| 27 | P | 47.2 | Very low | 46.8 | Very low | 98 Ų | 98 | 114.4 Ų | 114.4 | 64% | 0.636 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -60.9 | -13.9 | -174.3 | 21.9 | -32.4 | 0 | 0 | 0 | 115.6 | K29 W30 | P27-K29 PolarHBondContact O-N 3.11Å; P27-W30 PolarHBondContact O-N 2.97Å |
| 28 | L | 41.8 | Very low | 46.8 | Very low | 142 Ų | 142 | 115.1 Ų | 115.1 | 74% | 0.743 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -67.8 | -32.7 | 177.9 | -90.5 | 101 | 0 | 0 | 0 | 113.6 | Q26 W30 | Q26-L28 PolarHBondContact O-N 3.28Å; L28-W30 VanDerWaalsContact C-N 3.34Å |
| 29 | K | 42.7 | Very low | 47 | Very low | 104 Ų | 104 | 116.3 Ų | 116.3 | 45% | 0.452 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -76.7 | -27.2 | 179.9 | -146.8 | -170.4 | 176.1 | -157.8 | 0 | 111.5 | Q26 P27 K31 G32 W33 | Q26-K29 PolarHBondContact O-N 3.13Å; P27-K29 PolarHBondContact O-N 3.11Å; K29-K31 VanDerWaalsContact C-N 3.33Å; K29-K31 PolarHBondContact O-N 3.25Å; K29-G32 PolarHBondContact O-N 3.33Å; K29-W33 PolarHBondContact O-N 2.82Å |
| 30 | W | 44.1 | Very low | 47.3 | Very low | 146 Ų | 146 | 112.4 Ų | 112.4 | 55% | 0.553 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -63.4 | -37.3 | 177.6 | -69.5 | 80.3 | 0 | 0 | 0 | 112 | L25 P27 L28 G32 W33 M34 | L25-W30 PolarHBondContact O-NE1 3.33Å; P27-W30 PolarHBondContact O-N 2.97Å; L28-W30 VanDerWaalsContact C-N 3.34Å; W30-G32 PolarHBondContact O-N 3.15Å; W30-W33 PolarHBondContact O-N 3.18Å; W30-M34 HydrophobicContact CB-CE 4.47Å; W30-M34 VanDerWaalsContact O-CB 3.3Å; W30-M34 WeakPolarHBondContact O-CB 3.17Å; W30-M34 PolarHBondContact O-N 3.48Å |
| 31 | K | 43.1 | Very low | 47.3 | Very low | 163 Ų | 163 | 110.1 Ų | 110.1 | 71% | 0.709 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -58 | -45.4 | 175.3 | -102.3 | 178.9 | 175.1 | -179.4 | 0 | 112.6 | K29 M34 V35 | K29-K31 VanDerWaalsContact C-N 3.33Å; K29-K31 PolarHBondContact O-N 3.25Å; K31-M34 PolarHBondContact O-N 3.37Å; K31-V35 VanDerWaalsContact O-CG2 3.23Å; K31-V35 WeakPolarHBondContact O-CG2 3.48Å; K31-V35 PolarHBondContact O-N 2.99Å |
| 32 | G | 44.9 | Very low | 47.6 | Very low | 37 Ų | 37 | 105.8 Ų | 105.8 | 38% | 0.381 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -66.5 | -38.5 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | K29 W30 V35 I36 | K29-G32 PolarHBondContact O-N 3.33Å; W30-G32 PolarHBondContact O-N 3.15Å; G32-V35 PolarHBondContact O-N 2.74Å; G32-I36 WeakPolarHBondContact O-CD1 3.25Å; G32-I36 VanDerWaalsContact O-CG1 3.24Å; G32-I36 WeakPolarHBondContact O-CG1 3.01Å; G32-I36 PolarHBondContact O-N 2.84Å |
| 33 | W | 38.1 | Very low | 48 | Very low | 128 Ų | 128 | 104.6 Ų | 104.6 | 49% | 0.485 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -71.6 | -34.3 | 175.6 | -76.4 | 64.7 | 0 | 0 | 0 | 112.4 | K29 W30 V35 S37 L92 | K29-W33 PolarHBondContact O-N 2.82Å; W30-W33 PolarHBondContact O-N 3.18Å; W33-V35 VanDerWaalsContact C-N 3.35Å; W33-S37 WeakPolarHBondContact O-CB 3.36Å; W33-S37 PolarHBondContact O-N 2.96Å; W33-L92 HydrophobicContact CH2-CD2 3.99Å; W33-L92 HydrophobicContact CZ3-CD2 4.43Å |
| 34 | M | 41.4 | Very low | 48.4 | Very low | 107 Ų | 107 | 103.2 Ų | 103.2 | 53% | 0.527 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -65.3 | -40 | 173.3 | -126.9 | 175.6 | -86.2 | 0 | 0 | 110.9 | W30 K31 S37 Q38 | W30-M34 HydrophobicContact CB-CE 4.47Å; W30-M34 VanDerWaalsContact O-CB 3.3Å; W30-M34 WeakPolarHBondContact O-CB 3.17Å; W30-M34 PolarHBondContact O-N 3.48Å; K31-M34 PolarHBondContact O-N 3.37Å; M34-S37 PolarHBondContact O-N 2.92Å; M34-Q38 VanDerWaalsContact O-CB 3.3Å; M34-Q38 WeakPolarHBondContact O-CB 3.29Å; M34-Q38 WeakPolarHBondContact O-CG 3.21Å; M34-Q38 PolarHBondContact O-N 2.89Å |
| 35 | V | 49 | Very low | 48.8 | Very low | 82 Ų | 82 | 103.3 Ų | 103.3 | 50% | 0.497 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -68.2 | -45.9 | 176.5 | 171.6 | 0 | 0 | 0 | 0 | 110.8 | K31 G32 W33 S37 Q38 T39 | K31-V35 VanDerWaalsContact O-CG2 3.23Å; K31-V35 WeakPolarHBondContact O-CG2 3.48Å; K31-V35 PolarHBondContact O-N 2.99Å; G32-V35 PolarHBondContact O-N 2.74Å; W33-V35 VanDerWaalsContact C-N 3.35Å; V35-S37 VanDerWaalsContact C-N 3.32Å; V35-S37 PolarHBondContact O-N 2.62Å; V35-Q38 PolarHBondContact O-N 3.27Å; V35-T39 WeakPolarHBondContact O-CB 3.15Å; V35-T39 PolarHBondContact O-N 3.46Å; V35-T39 PolarHBondContact O-OG1 2.86Å |
| 36 | I | 47.4 | Very low | 49.2 | Very low | 78 Ų | 78 | 107.2 Ų | 107.2 | 40% | 0.4 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -63.3 | -41.4 | 175.8 | -65.4 | 161.5 | 0 | 0 | 0 | 110.4 | G32 T39 L40 | G32-I36 WeakPolarHBondContact O-CD1 3.25Å; G32-I36 VanDerWaalsContact O-CG1 3.24Å; G32-I36 WeakPolarHBondContact O-CG1 3.01Å; G32-I36 PolarHBondContact O-N 2.84Å; I36-T39 PolarHBondContact O-N 3.44Å; I36-L40 HydrophobicContact CG2-CD1 3.86Å; I36-L40 HydrophobicContact CG2-CG 4.35Å; I36-L40 VanDerWaalsContact O-CB 3.29Å; I36-L40 WeakPolarHBondContact O-CB 3.34Å; I36-L40 WeakPolarHBondContact O-CG 3.42Å; I36-L40 PolarHBondContact O-N 2.98Å |
| 37 | S | 54.7 | Low | 49.8 | Very low | 63 Ų | 63 | 102.1 Ų | 102.1 | 44% | 0.441 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -62.1 | -44.6 | 174.5 | -172.4 | 0 | 0 | 0 | 0 | 111.7 | W33 M34 V35 Q41 | W33-S37 WeakPolarHBondContact O-CB 3.36Å; W33-S37 PolarHBondContact O-N 2.96Å; M34-S37 PolarHBondContact O-N 2.92Å; V35-S37 VanDerWaalsContact C-N 3.32Å; V35-S37 PolarHBondContact O-N 2.62Å; S37-Q41 WeakPolarHBondContact O-CB 3.44Å; S37-Q41 PolarHBondContact O-N 3.45Å |
| 38 | Q | 53 | Low | 50.2 | Low | 123 Ų | 123 | 101.3 Ų | 101.3 | 58% | 0.575 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -66.6 | -38 | 177.2 | -84.9 | 178.1 | -8.4 | 0 | 0 | 112.2 | M34 V35 Q41 A42 | M34-Q38 VanDerWaalsContact O-CB 3.3Å; M34-Q38 WeakPolarHBondContact O-CB 3.29Å; M34-Q38 WeakPolarHBondContact O-CG 3.21Å; M34-Q38 PolarHBondContact O-N 2.89Å; V35-Q38 PolarHBondContact O-N 3.27Å; Q38-Q41 PolarHBondContact O-N 2.65Å; Q38-A42 WeakPolarHBondContact O-CB 3.23Å; Q38-A42 PolarHBondContact O-N 3.41Å |
| 39 | T | 54 | Low | 50.9 | Low | 88 Ų | 88 | 98.8 Ų | 98.8 | 54% | 0.54 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -70 | -41.1 | 179 | -43.4 | 0 | 0 | 0 | 0 | 110.5 | V35 I36 A42 Y43 | V35-T39 WeakPolarHBondContact O-CB 3.15Å; V35-T39 PolarHBondContact O-N 3.46Å; V35-T39 PolarHBondContact O-OG1 2.86Å; I36-T39 PolarHBondContact O-N 3.44Å; T39-A42 PolarHBondContact O-N 2.84Å; T39-Y43 VanDerWaalsContact O-CB 3.23Å; T39-Y43 WeakPolarHBondContact O-CB 3.26Å; T39-Y43 PolarHBondContact O-N 2.97Å |
| 40 | L | 52.8 | Low | 51.5 | Low | 97 Ų | 97 | 98.1 Ų | 98.1 | 51% | 0.508 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -65.5 | -39.7 | 172 | -73.2 | 173 | 0 | 0 | 0 | 111.8 | I36 Y43 V44 | I36-L40 HydrophobicContact CG2-CD1 3.86Å; I36-L40 HydrophobicContact CG2-CG 4.35Å; I36-L40 VanDerWaalsContact O-CB 3.29Å; I36-L40 WeakPolarHBondContact O-CB 3.34Å; I36-L40 WeakPolarHBondContact O-CG 3.42Å; I36-L40 PolarHBondContact O-N 2.98Å; L40-Y43 PolarHBondContact O-N 3.25Å; L40-V44 WeakPolarHBondContact O-CB 3.16Å; L40-V44 WeakPolarHBondContact O-CG2 3.4Å; L40-V44 PolarHBondContact O-N 3.19Å |
| 41 | Q | 54.2 | Low | 51.9 | Low | 130 Ų | 130 | 94 Ų | 94 | 61% | 0.607 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -70.2 | -37.2 | 178.6 | -167.5 | 173.4 | -10.4 | 0 | 0 | 111.5 | S37 Q38 Y45 | S37-Q41 WeakPolarHBondContact O-CB 3.44Å; S37-Q41 PolarHBondContact O-N 3.45Å; Q38-Q41 PolarHBondContact O-N 2.65Å; Q41-Y45 VanDerWaalsContact O-CB 3.25Å; Q41-Y45 WeakPolarHBondContact O-CB 3.24Å; Q41-Y45 PolarHBondContact O-N 3.31Å |
| 42 | A | 56.4 | Low | 52.5 | Low | 58 Ų | 58 | 92.5 Ų | 92.5 | 48% | 0.479 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -67.2 | -38.5 | 170.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | Q38 T39 Y45 Y46 | Q38-A42 WeakPolarHBondContact O-CB 3.23Å; Q38-A42 PolarHBondContact O-N 3.41Å; T39-A42 PolarHBondContact O-N 2.84Å; A42-Y45 PolarHBondContact O-N 3.38Å; A42-Y46 VanDerWaalsContact O-CB 3.24Å; A42-Y46 WeakPolarHBondContact O-CB 3.3Å; A42-Y46 PolarHBondContact O-N 3.43Å |
| 43 | Y | 55.5 | Low | 52.9 | Low | 91 Ų | 91 | 93 Ų | 93 | 36% | 0.357 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -67.4 | -41.4 | 175 | -178.8 | -96.8 | 0 | 0 | 0 | 111.8 | T39 L40 Y46 C47 T165 | T39-Y43 VanDerWaalsContact O-CB 3.23Å; T39-Y43 WeakPolarHBondContact O-CB 3.26Å; T39-Y43 PolarHBondContact O-N 2.97Å; L40-Y43 PolarHBondContact O-N 3.25Å; Y43-Y46 PolarHBondContact O-N 2.74Å; Y43-C47 VanDerWaalsContact CE1-SG 3.52Å; Y43-C47 VanDerWaalsContact O-CB 3.31Å; Y43-C47 WeakPolarHBondContact O-CB 3.38Å; Y43-C47 PolarHBondContact O-N 3.2Å; Y43-C47 PolarHBondContact O-SG 3.38Å; Y43-T165 HydrophobicContact CE2-CG2 3.96Å; Y43-T165 WeakPolarHBondContact OH-CG2 3.44Å |
| 44 | V | 57.7 | Low | 53.6 | Low | 60 Ų | 60 | 91.3 Ų | 91.3 | 36% | 0.364 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -63.9 | -44.5 | 173.1 | 168.9 | 0 | 0 | 0 | 0 | 110 | L40 Y46 C47 I48 | L40-V44 WeakPolarHBondContact O-CB 3.16Å; L40-V44 WeakPolarHBondContact O-CG2 3.4Å; L40-V44 PolarHBondContact O-N 3.19Å; V44-Y46 PolarHBondContact O-N 3.43Å; V44-C47 PolarHBondContact O-N 2.89Å; V44-I48 HydrophobicContact CG1-CD1 3.64Å; V44-I48 HydrophobicContact CG1-CG1 4.37Å; V44-I48 WeakPolarHBondContact O-CB 3.25Å; V44-I48 WeakPolarHBondContact O-CD1 3.3Å; V44-I48 WeakPolarHBondContact O-CG1 3.06Å; V44-I48 PolarHBondContact O-N 3.42Å |
| 45 | Y | 56.4 | Low | 54 | Low | 153 Ų | 153 | 87.9 Ų | 87.9 | 60% | 0.6 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -61.9 | -43.4 | 175.6 | -175.5 | -101.4 | 0 | 0 | 0 | 111.9 | Q41 A42 I48 H49 | Q41-Y45 VanDerWaalsContact O-CB 3.25Å; Q41-Y45 WeakPolarHBondContact O-CB 3.24Å; Q41-Y45 PolarHBondContact O-N 3.31Å; A42-Y45 PolarHBondContact O-N 3.38Å; Y45-I48 PolarHBondContact O-N 3.42Å; Y45-H49 VanDerWaalsContact O-CB 3.23Å; Y45-H49 WeakPolarHBondContact O-CB 3.39Å; Y45-H49 PolarHBondContact O-N 3.06Å |
| 46 | Y | 58.5 | Low | 53.9 | Low | 166 Ų | 166 | 86.6 Ų | 86.6 | 65% | 0.651 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -66.6 | -39.7 | 176.6 | -162.3 | -91.4 | 0 | 0 | 0 | 111.8 | A42 Y43 V44 H49 L50 | A42-Y46 VanDerWaalsContact O-CB 3.24Å; A42-Y46 WeakPolarHBondContact O-CB 3.3Å; A42-Y46 PolarHBondContact O-N 3.43Å; Y43-Y46 PolarHBondContact O-N 2.74Å; V44-Y46 PolarHBondContact O-N 3.43Å; Y46-H49 PolarHBondContact O-N 3.49Å; Y46-L50 WeakPolarHBondContact O-CB 3.47Å; Y46-L50 PolarHBondContact O-N 3.03Å |
| 47 | C | 53.6 | Low | 54 | Low | 31 Ų | 31 | 88.5 Ų | 88.5 | 21% | 0.209 | 46% | 0.455 | C | S | . | . | H | α-helix | trans | -63.6 | -43.1 | 173.4 | -70.5 | 0 | 0 | 0 | 0 | 111.6 | Y43 V44 L50 L51 | Y43-C47 VanDerWaalsContact CE1-SG 3.52Å; Y43-C47 VanDerWaalsContact O-CB 3.31Å; Y43-C47 WeakPolarHBondContact O-CB 3.38Å; Y43-C47 PolarHBondContact O-N 3.2Å; Y43-C47 PolarHBondContact O-SG 3.38Å; V44-C47 PolarHBondContact O-N 2.89Å; C47-L50 PolarHBondContact O-N 3.45Å; C47-L51 VanDerWaalsContact O-CB 3.24Å; C47-L51 WeakPolarHBondContact O-CB 3.25Å; C47-L51 PolarHBondContact O-N 3.46Å |
| 48 | I | 55.6 | Low | 53.3 | Low | 81 Ų | 81 | 91.2 Ų | 91.2 | 42% | 0.415 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -63.8 | -46.6 | 176.2 | -69.2 | 164.5 | 0 | 0 | 0 | 110 | V44 Y45 L50 L51 E52 | V44-I48 HydrophobicContact CG1-CD1 3.64Å; V44-I48 HydrophobicContact CG1-CG1 4.37Å; V44-I48 WeakPolarHBondContact O-CB 3.25Å; V44-I48 WeakPolarHBondContact O-CD1 3.3Å; V44-I48 WeakPolarHBondContact O-CG1 3.06Å; V44-I48 PolarHBondContact O-N 3.42Å; Y45-I48 PolarHBondContact O-N 3.42Å; I48-L50 VanDerWaalsContact C-N 3.34Å; I48-L50 PolarHBondContact O-N 3.38Å; I48-L51 CarbonylContact O-C 3.52Å; I48-L51 WeakPolarHBondContact O-CB 3.26Å; I48-L51 PolarHBondContact O-N 3.12Å; I48-L51 VanDerWaalsContact O-N 3.17Å; I48-E52 WeakPolarHBondContact O-CB 3.21Å; I48-E52 PolarHBondContact O-N 2.94Å |
| 49 | H | 56 | Low | 52.8 | Low | 89 Ų | 89 | 91.4 Ų | 91.4 | 41% | 0.412 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -68.8 | -31.6 | -179.4 | -154.5 | -67.2 | 0 | 0 | 0 | 112.3 | Y45 Y46 E52 T53 | Y45-H49 VanDerWaalsContact O-CB 3.23Å; Y45-H49 WeakPolarHBondContact O-CB 3.39Å; Y45-H49 PolarHBondContact O-N 3.06Å; Y46-H49 PolarHBondContact O-N 3.49Å; H49-E52 PolarHBondContact O-N 3.46Å; H49-T53 WeakPolarHBondContact O-CB 3.3Å; H49-T53 WeakPolarHBondContact O-CG2 3.34Å; H49-T53 PolarHBondContact O-N 3.3Å; H49-T53 PolarHBondContact O-OG1 3.08Å |
| 50 | L | 55.3 | Low | 52.4 | Low | 89 Ų | 89 | 94.1 Ų | 94.1 | 47% | 0.466 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -70.4 | -39.4 | 171.4 | -172.7 | 66.8 | 0 | 0 | 0 | 111 | Y46 C47 I48 E52 T53 L54 | Y46-L50 WeakPolarHBondContact O-CB 3.47Å; Y46-L50 PolarHBondContact O-N 3.03Å; C47-L50 PolarHBondContact O-N 3.45Å; I48-L50 VanDerWaalsContact C-N 3.34Å; I48-L50 PolarHBondContact O-N 3.38Å; L50-E52 VanDerWaalsContact C-N 3.27Å; L50-E52 PolarHBondContact O-N 3.21Å; L50-T53 WeakPolarHBondContact CA-OG1 3.36Å; L50-T53 PolarHBondContact O-N 2.94Å; L50-T53 PolarHBondContact O-OG1 3.22Å; L50-L54 HydrophobicContact CG-CD1 4.45Å; L50-L54 WeakPolarHBondContact O-CB 3.33Å; L50-L54 WeakPolarHBondContact O-CD1 3.4Å; L50-L54 WeakPolarHBondContact O-CG 3.38Å; L50-L54 PolarHBondContact O-N 2.88Å |
| 51 | L | 53 | Low | 52.3 | Low | 59 Ų | 59 | 94.1 Ų | 94.1 | 31% | 0.309 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -68.9 | -26.4 | 174.6 | -156.9 | 74.1 | 0 | 0 | 0 | 112.3 | C47 I48 P55 T74 F77 | C47-L51 VanDerWaalsContact O-CB 3.24Å; C47-L51 WeakPolarHBondContact O-CB 3.25Å; C47-L51 PolarHBondContact O-N 3.46Å; I48-L51 CarbonylContact O-C 3.52Å; I48-L51 WeakPolarHBondContact O-CB 3.26Å; I48-L51 PolarHBondContact O-N 3.12Å; I48-L51 VanDerWaalsContact O-N 3.17Å; L51-P55 WeakPolarHBondContact O-CD 3.08Å; L51-P55 WeakPolarHBondContact O-CG 3.23Å; L51-T74 HydrophobicContact CD2-CG2 3.64Å; L51-T74 HydrophobicContact CG-CG2 4.09Å; L51-F77 HydrophobicContact CD2-CD1 4.29Å |
| 52 | E | 55 | Low | 52.1 | Low | 132 Ų | 132 | 90 Ų | 90 | 62% | 0.617 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -82.8 | -28.8 | 175.4 | -166.6 | 174.8 | -178.9 | 0 | 0 | 112.6 | I48 H49 L50 P55 | I48-E52 WeakPolarHBondContact O-CB 3.21Å; I48-E52 PolarHBondContact O-N 2.94Å; H49-E52 PolarHBondContact O-N 3.46Å; L50-E52 VanDerWaalsContact C-N 3.27Å; L50-E52 PolarHBondContact O-N 3.21Å; E52-P55 WeakPolarHBondContact O-CD 3.21Å; E52-P55 WeakPolarHBondContact O-CG 3.37Å |
| 53 | T | 54 | Low | 51.8 | Low | 47 Ų | 47 | 90.9 Ų | 90.9 | 29% | 0.288 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -88.6 | -22.7 | 175.8 | 47.8 | 0 | 0 | 0 | 0 | 114.1 | H49 L50 S56 I57 | H49-T53 WeakPolarHBondContact O-CB 3.3Å; H49-T53 WeakPolarHBondContact O-CG2 3.34Å; H49-T53 PolarHBondContact O-N 3.3Å; H49-T53 PolarHBondContact O-OG1 3.08Å; L50-T53 WeakPolarHBondContact CA-OG1 3.36Å; L50-T53 PolarHBondContact O-N 2.94Å; L50-T53 PolarHBondContact O-OG1 3.22Å; T53-S56 PolarHBondContact O-N 3.5Å; T53-S56 PolarHBondContact O-OG 2.83Å; T53-I57 WeakPolarHBondContact O-CG1 3.29Å; T53-I57 PolarHBondContact O-N 3.49Å; T53-I57 VanDerWaalsContact O-N 3.16Å |
| 54 | L | 52.8 | Low | 51.4 | Low | 93 Ų | 93 | 90.6 Ų | 90.6 | 49% | 0.487 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -54.5 | -45.2 | 169.7 | -93.7 | 158.4 | 0 | 0 | 0 | 114 | L50 S56 I57 F58 | L50-L54 HydrophobicContact CG-CD1 4.45Å; L50-L54 WeakPolarHBondContact O-CB 3.33Å; L50-L54 WeakPolarHBondContact O-CD1 3.4Å; L50-L54 WeakPolarHBondContact O-CG 3.38Å; L50-L54 PolarHBondContact O-N 2.88Å; L54-S56 VanDerWaalsContact C-N 3.34Å; L54-S56 PolarHBondContact O-N 3.29Å; L54-I57 PolarHBondContact O-N 3.37Å; L54-F58 PolarHBondContact O-N 3.31Å; L54-F58 VanDerWaalsContact O-N 3.14Å |
| 55 | P | 50 | Low | 51 | Low | 36 Ų | 36 | 94.4 Ų | 94.4 | 23% | 0.234 | 52% | 0.522 | C | S | . | . | H | α-helix | trans | -57.4 | -44.6 | 174.7 | -13.9 | 11.9 | 0 | 0 | 0 | 112.5 | L51 E52 I57 F58 E59 L70 | L51-P55 WeakPolarHBondContact O-CD 3.08Å; L51-P55 WeakPolarHBondContact O-CG 3.23Å; E52-P55 WeakPolarHBondContact O-CD 3.21Å; E52-P55 WeakPolarHBondContact O-CG 3.37Å; P55-I57 PolarHBondContact O-N 2.77Å; P55-F58 PolarHBondContact O-N 3.37Å; P55-E59 WeakPolarHBondContact O-CB 3.07Å; P55-E59 PolarHBondContact O-N 3.36Å; P55-L70 HydrophobicContact CB-CD2 3.55Å; P55-L70 HydrophobicContact CG-CD2 3.58Å |
| 56 | S | 45.3 | Very low | 50.9 | Low | 55 Ų | 55 | 89.7 Ų | 89.7 | 39% | 0.385 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -71.2 | -32.3 | -175.8 | 64.6 | 0 | 0 | 0 | 0 | 112.7 | T53 L54 N60 | T53-S56 PolarHBondContact O-N 3.5Å; T53-S56 PolarHBondContact O-OG 2.83Å; L54-S56 VanDerWaalsContact C-N 3.34Å; L54-S56 PolarHBondContact O-N 3.29Å; S56-N60 PolarHBondContact O-N 3.34Å; S56-N60 PolarHBondContact O-ND2 2.97Å |
| 57 | I | 49.1 | Very low | 50.5 | Low | 118 Ų | 118 | 88.4 Ų | 88.4 | 61% | 0.605 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -68.6 | -37 | 172.8 | -63.6 | 168.7 | 0 | 0 | 0 | 110.9 | T53 L54 P55 | T53-I57 WeakPolarHBondContact O-CG1 3.29Å; T53-I57 PolarHBondContact O-N 3.49Å; T53-I57 VanDerWaalsContact O-N 3.16Å; L54-I57 PolarHBondContact O-N 3.37Å; P55-I57 PolarHBondContact O-N 2.77Å |
| 58 | F | 40.6 | Very low | 50.4 | Low | 119 Ų | 119 | 97.8 Ų | 97.8 | 52% | 0.522 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -79.2 | -31.8 | 179.8 | -142.9 | -113.6 | 0 | 0 | 0 | 112.6 | L54 P55 N60 S61 A62 L66 | L54-F58 PolarHBondContact O-N 3.31Å; L54-F58 VanDerWaalsContact O-N 3.14Å; P55-F58 PolarHBondContact O-N 3.37Å; F58-N60 VanDerWaalsContact C-N 3.35Å; F58-S61 WeakPolarHBondContact O-CB 3.14Å; F58-S61 PolarHBondContact O-N 3.49Å; F58-A62 PolarHBondContact O-N 3Å; F58-L66 HydrophobicContact CD1-CD1 3.29Å; F58-L66 HydrophobicContact CD1-CD2 3.8Å; F58-L66 HydrophobicContact CD1-CG 4.1Å; F58-L66 HydrophobicContact CE1-CD1 3.63Å; F58-L66 HydrophobicContact CE1-CD2 3.69Å; F58-L66 HydrophobicContact CE1-CG 4.28Å; F58-L66 HydrophobicContact CG-CD1 4.39Å |
| 59 | E | 43 | Very low | 50.3 | Low | 127 Ų | 127 | 96.6 Ų | 96.6 | 59% | 0.593 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -67.4 | -32.7 | 176.3 | -170.9 | 162.2 | -178.4 | 0 | 0 | 112.4 | P55 S61 | P55-E59 WeakPolarHBondContact O-CB 3.07Å; P55-E59 PolarHBondContact O-N 3.36Å; E59-S61 PolarHBondContact O-N 2.91Å |
| 60 | N | 46.2 | Very low | 50.2 | Low | 146 Ų | 146 | 95.3 Ų | 95.3 | 78% | 0.781 | 53% | 0.532 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.7 | -14.3 | 170.9 | -72.9 | -48.8 | 0 | 0 | 0 | 113.4 | S56 F58 | S56-N60 PolarHBondContact O-N 3.34Å; S56-N60 PolarHBondContact O-ND2 2.97Å; F58-N60 VanDerWaalsContact C-N 3.35Å |
| 61 | S | 50.2 | Low | 50.1 | Low | 97 Ų | 97 | 96.9 Ų | 96.9 | 68% | 0.678 | 54% | 0.539 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -102.3 | -23.7 | -177.8 | 177.3 | 0 | 0 | 0 | 0 | 114.2 | F58 E59 | F58-S61 WeakPolarHBondContact O-CB 3.14Å; F58-S61 PolarHBondContact O-N 3.49Å; E59-S61 PolarHBondContact O-N 2.91Å |
| 62 | A | 49 | Very low | 50.2 | Low | 42 Ų | 42 | 97.5 Ų | 97.5 | 35% | 0.347 | 55% | 0.546 | S | S | . | . | S | Bend | trans | -148.2 | 109.8 | -172.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | F58 G64 L66 | F58-A62 PolarHBondContact O-N 3Å; A62-G64 PolarHBondContact O-N 3.42Å; A62-G64 VanDerWaalsContact O-N 3.17Å; A62-L66 HydrophobicContact CB-CD1 3.79Å |
| 63 | G | 50.1 | Low | 50.1 | Low | 78 Ų | 78 | 93.8 Ų | 93.8 | 80% | 0.804 | 53% | 0.528 | S | S | * | . | trans | -49.2 | 117.2 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | M65 | G63-M65 VanDerWaalsContact C-N 3.35Å; G63-M65 PolarHBondContact O-N 3.2Å | ||
| 64 | G | 49 | Very low | 50.1 | Low | 85 Ų | 85 | 94.1 Ų | 94.1 | 88% | 0.876 | 53% | 0.53 | S | S | * | . | S | Bend | trans | 72.6 | -9.5 | 144.2 | 0 | 0 | 0 | 0 | 0 | 120.1 | A62 | A62-G64 PolarHBondContact O-N 3.42Å; A62-G64 VanDerWaalsContact O-N 3.17Å |
| 65 | M | 47.8 | Very low | 50.2 | Low | 139 Ų | 139 | 95.5 Ų | 95.5 | 69% | 0.685 | 54% | 0.537 | S | S | * | . | trans | -107.2 | 3.2 | -170.7 | -134.1 | 179.2 | 65.5 | 0 | 0 | 116 | G63 | G63-M65 VanDerWaalsContact C-N 3.35Å; G63-M65 PolarHBondContact O-N 3.2Å | ||
| 66 | L | 55 | Low | 50.7 | Low | 54 Ų | 54 | 96.6 Ų | 96.6 | 28% | 0.283 | 55% | 0.546 | S | S | . | . | S | Bend | trans | -99.1 | -19.1 | -167.3 | -80.2 | 152.2 | 0 | 0 | 0 | 116 | F58 A62 R68 D69 L70 | F58-L66 HydrophobicContact CD1-CD1 3.29Å; F58-L66 HydrophobicContact CD1-CD2 3.8Å; F58-L66 HydrophobicContact CD1-CG 4.1Å; F58-L66 HydrophobicContact CE1-CD1 3.63Å; F58-L66 HydrophobicContact CE1-CD2 3.69Å; F58-L66 HydrophobicContact CE1-CG 4.28Å; F58-L66 HydrophobicContact CG-CD1 4.39Å; A62-L66 HydrophobicContact CB-CD1 3.79Å; L66-R68 VanDerWaalsContact C-N 3.3Å; L66-R68 PolarHBondContact O-N 2.8Å; L66-D69 PolarHBondContact O-N 3.01Å; L66-L70 PolarHBondContact O-N 3.11Å; L66-L70 VanDerWaalsContact O-N 3.1Å |
| 67 | L | 50.1 | Low | 51.1 | Low | 140 Ų | 140 | 95.6 Ų | 95.6 | 73% | 0.733 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -62.8 | -35.1 | -174.5 | -158.2 | 75.7 | 0 | 0 | 0 | 113.2 | ||
| 68 | R | 52.2 | Low | 51.3 | Low | 228 Ų | 228 | 97.8 Ų | 97.8 | 86% | 0.86 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -77.3 | -26.1 | 179 | -77.4 | -174.8 | 174.2 | -152 | -1.3 | 113.9 | L66 | L66-R68 VanDerWaalsContact C-N 3.3Å; L66-R68 PolarHBondContact O-N 2.8Å |
| 69 | D | 52.8 | Low | 52.3 | Low | 56 Ų | 56 | 95.6 Ų | 95.6 | 30% | 0.299 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -90 | -18.2 | -179 | -83.9 | -16.3 | 0 | 0 | 0 | 112.3 | L66 P72 F73 K183 | L66-D69 PolarHBondContact O-N 3.01Å; D69-P72 WeakPolarHBondContact O-CD 3.29Å; D69-P72 WeakPolarHBondContact O-CG 3.34Å; D69-F73 WeakPolarHBondContact O-CD2 3.28Å; D69-K183 IonicContact OD1-NZ 2.58Å; D69-K183 PolarHBondContact OD1-NZ 2.98Å; D69-K183 IonicContact OD2-NZ 2.73Å; D69-K183 PolarHBondContact OD2-NZ 3.17Å |
| 70 | L | 52.9 | Low | 53.1 | Low | 61 Ų | 61 | 95.2 Ų | 95.2 | 32% | 0.319 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -84.6 | -33.3 | 178.8 | -142.2 | 72.4 | 0 | 0 | 0 | 113.8 | P55 L66 F73 T74 | P55-L70 HydrophobicContact CB-CD2 3.55Å; P55-L70 HydrophobicContact CG-CD2 3.58Å; L66-L70 PolarHBondContact O-N 3.11Å; L66-L70 VanDerWaalsContact O-N 3.1Å; L70-F73 WeakPolarHBondContact O-CB 3.31Å; L70-F73 PolarHBondContact O-N 2.88Å; L70-T74 PolarHBondContact O-N 2.8Å; L70-T74 PolarHBondContact O-OG1 3.48Å; L70-T74 VanDerWaalsContact O-OG1 3.06Å |
| 71 | M | 54.5 | Low | 53.6 | Low | 123 Ų | 123 | 91 Ų | 91 | 61% | 0.606 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -50.1 | -45.5 | 176.3 | -92.6 | -163.9 | 75.8 | 0 | 0 | 115.2 | F73 T74 L75 | M71-F73 VanDerWaalsContact C-N 3.28Å; M71-F73 PolarHBondContact O-N 2.8Å; M71-T74 PolarHBondContact O-OG1 2.93Å; M71-L75 WeakPolarHBondContact O-CB 3.48Å; M71-L75 PolarHBondContact O-N 2.94Å |
| 72 | P | 55.4 | Low | 54.4 | Low | 72 Ų | 72 | 90.4 Ų | 90.4 | 47% | 0.468 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -70.8 | -22.8 | 178.1 | 26.1 | -33.7 | 0 | 0 | 0 | 113.1 | D69 S76 | D69-P72 WeakPolarHBondContact O-CD 3.29Å; D69-P72 WeakPolarHBondContact O-CG 3.34Å; P72-S76 WeakPolarHBondContact O-CB 3.31Å; P72-S76 PolarHBondContact O-N 2.89Å |
| 73 | F | 51.4 | Low | 55.3 | Low | 53 Ų | 53 | 90.9 Ų | 90.9 | 23% | 0.232 | 50% | 0.497 | C | S | . | . | H | α-helix | trans | -73 | -47.2 | 175.9 | -81.2 | -83.6 | 0 | 0 | 0 | 112 | D69 L70 M71 L75 S76 F77 I179 | D69-F73 WeakPolarHBondContact O-CD2 3.28Å; L70-F73 WeakPolarHBondContact O-CB 3.31Å; L70-F73 PolarHBondContact O-N 2.88Å; M71-F73 VanDerWaalsContact C-N 3.28Å; M71-F73 PolarHBondContact O-N 2.8Å; F73-L75 VanDerWaalsContact C-N 3.27Å; F73-L75 PolarHBondContact O-N 2.95Å; F73-S76 PolarHBondContact O-N 3.43Å; F73-F77 WeakPolarHBondContact O-CB 3.29Å; F73-F77 PolarHBondContact O-N 2.71Å; F73-I179 HydrophobicContact CD1-CD1 4.14Å; F73-I179 HydrophobicContact CE1-CD1 3.38Å; F73-I179 HydrophobicContact CE1-CG1 4.47Å; F73-I179 HydrophobicContact CE2-CB 4.47Å; F73-I179 HydrophobicContact CE2-CD1 4.06Å; F73-I179 HydrophobicContact CE2-CG2 4.02Å; F73-I179 HydrophobicContact CZ-CB 3.76Å; F73-I179 HydrophobicContact CZ-CD1 3.33Å; F73-I179 HydrophobicContact CZ-CG1 4.12Å; F73-I179 HydrophobicContact CZ-CG2 3.81Å |
| 74 | T | 54.7 | Low | 56 | Low | 55 Ų | 55 | 92.8 Ų | 92.8 | 34% | 0.337 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -61.2 | -37.3 | 176 | 20 | 0 | 0 | 0 | 0 | 111.8 | L51 L70 M71 | L51-T74 HydrophobicContact CD2-CG2 3.64Å; L51-T74 HydrophobicContact CG-CG2 4.09Å; L70-T74 PolarHBondContact O-N 2.8Å; L70-T74 PolarHBondContact O-OG1 3.48Å; L70-T74 VanDerWaalsContact O-OG1 3.06Å; M71-T74 PolarHBondContact O-OG1 2.93Å |
| 75 | L | 55.3 | Low | 56.5 | Low | 121 Ų | 121 | 91.5 Ų | 91.5 | 63% | 0.634 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -76 | -38.3 | 177.9 | -116.8 | 145.7 | 0 | 0 | 0 | 113.6 | M71 F73 P79 | M71-L75 WeakPolarHBondContact O-CB 3.48Å; M71-L75 PolarHBondContact O-N 2.94Å; F73-L75 VanDerWaalsContact C-N 3.27Å; F73-L75 PolarHBondContact O-N 2.95Å; L75-P79 WeakPolarHBondContact O-CD 3.38Å |
| 76 | S | 59.5 | Low | 57.2 | Low | 59 Ų | 59 | 90 Ų | 90 | 41% | 0.413 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -74.9 | -25.1 | 179.8 | -175.6 | 0 | 0 | 0 | 0 | 112.9 | P72 F73 P79 F80 | P72-S76 WeakPolarHBondContact O-CB 3.31Å; P72-S76 PolarHBondContact O-N 2.89Å; F73-S76 PolarHBondContact O-N 3.43Å; S76-P79 WeakPolarHBondContact O-CD 3.35Å; S76-P79 WeakPolarHBondContact O-CG 3.33Å; S76-F80 WeakPolarHBondContact O-CD2 3.48Å |
| 77 | F | 54.3 | Low | 57.7 | Low | 34 Ų | 34 | 92.9 Ų | 92.9 | 15% | 0.149 | 47% | 0.471 | C | S | . | . | H | α-helix | trans | -80.4 | -34 | -177.4 | -168.2 | -122.9 | 0 | 0 | 0 | 113 | L51 F73 F80 F81 V172 | L51-F77 HydrophobicContact CD2-CD1 4.29Å; F73-F77 WeakPolarHBondContact O-CB 3.29Å; F73-F77 PolarHBondContact O-N 2.71Å; F77-F80 PolarHBondContact O-N 2.89Å; F77-F80 VanDerWaalsContact O-N 3.16Å; F77-F81 AromaticContact CD1-CD2 3.66Å; F77-F81 HydrophobicContact CD1-CD2 3.66Å; F77-F81 AromaticContact CD1-CE2 3.56Å; F77-F81 HydrophobicContact CD1-CE2 3.56Å; F77-F81 HydrophobicContact CD1-CG 4.42Å; F77-F81 HydrophobicContact CD1-CZ 4.05Å; F77-F81 HydrophobicContact CD2-CD2 4Å; F77-F81 AromaticContact CD2-CE2 3.73Å; F77-F81 HydrophobicContact CD2-CE2 3.73Å; F77-F81 AromaticContact CE1-CD2 3.6Å; F77-F81 HydrophobicContact CE1-CD2 3.6Å; F77-F81 AromaticContact CE1-CE1 4Å; F77-F81 HydrophobicContact CE1-CE1 4Å; F77-F81 AromaticContact CE1-CE2 3Å; F77-F81 HydrophobicContact CE1-CE2 3Å; F77-F81 HydrophobicContact CE1-CG 4.37Å; F77-F81 AromaticContact CE1-CZ 3.14Å; F77-F81 HydrophobicContact CE1-CZ 3.14Å; F77-F81 AromaticContact CE2-CD2 3.9Å; F77-F81 HydrophobicContact CE2-CD2 3.9Å; F77-F81 AromaticContact CE2-CE2 3.15Å; F77-F81 HydrophobicContact CE2-CE2 3.15Å; F77-F81 AromaticContact CE2-CZ 3.92Å; F77-F81 HydrophobicContact CE2-CZ 3.92Å; F77-F81 AromaticContact CG-CD2 3.92Å; F77-F81 HydrophobicContact CG-CD2 3.92Å; F77-F81 AromaticContact CG-CE2 3.93Å; F77-F81 HydrophobicContact CG-CE2 3.93Å; F77-F81 AromaticContact CZ-CD2 3.78Å; F77-F81 HydrophobicContact CZ-CD2 3.78Å; F77-F81 HydrophobicContact CZ-CE1 4.32Å; F77-F81 AromaticContact CZ-CE2 2.82Å; F77-F81 HydrophobicContact CZ-CE2 2.82Å; F77-F81 AromaticContact CZ-CZ 3.11Å; F77-F81 HydrophobicContact CZ-CZ 3.11Å; F77-F81 WeakPolarHBondContact O-CD2 3.34Å; F77-F81 PolarHBondContact O-N 3.49Å; F77-F81 VanDerWaalsContact O-N 3.12Å; F77-V172 HydrophobicContact CD2-CG2 3.99Å; F77-V172 HydrophobicContact CE1-CG2 4.44Å; F77-V172 HydrophobicContact CE2-CB 4.46Å; F77-V172 HydrophobicContact CE2-CG2 3.06Å; F77-V172 HydrophobicContact CZ-CG2 3.29Å |
| 78 | W | 52.4 | Low | 58.3 | Low | 165 Ų | 165 | 89 Ų | 89 | 63% | 0.625 | 46% | 0.455 | S | S | * | . | H | α-helix | trans | -51.6 | -47.3 | 178.3 | -145.4 | -52.4 | 0 | 0 | 0 | 114.7 | F80 F81 I82 | W78-F80 PolarHBondContact O-N 3.44Å; W78-F81 PolarHBondContact O-N 2.88Å; W78-I82 WeakPolarHBondContact O-CG1 3.35Å; W78-I82 PolarHBondContact O-N 3.01Å |
| 79 | P | 62.9 | Low | 58.6 | Low | 72 Ų | 72 | 84.5 Ų | 84.5 | 47% | 0.468 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -67.3 | -32.7 | 178.8 | 23.4 | -33.4 | 0 | 0 | 0 | 113.5 | L75 S76 F81 A83 | L75-P79 WeakPolarHBondContact O-CD 3.38Å; S76-P79 WeakPolarHBondContact O-CD 3.35Å; S76-P79 WeakPolarHBondContact O-CG 3.33Å; P79-F81 VanDerWaalsContact C-N 3.34Å; P79-A83 VanDerWaalsContact O-CB 3.24Å; P79-A83 WeakPolarHBondContact O-CB 3.14Å; P79-A83 PolarHBondContact O-N 3.31Å |
| 80 | F | 58.9 | Low | 58.8 | Low | 120 Ų | 120 | 87.5 Ų | 87.5 | 53% | 0.526 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -67.9 | -37.2 | 174.9 | -77.3 | -84.1 | 0 | 0 | 0 | 111.7 | S76 F77 W78 A83 H84 | S76-F80 WeakPolarHBondContact O-CD2 3.48Å; F77-F80 PolarHBondContact O-N 2.89Å; F77-F80 VanDerWaalsContact O-N 3.16Å; W78-F80 PolarHBondContact O-N 3.44Å; F80-A83 PolarHBondContact O-N 3.47Å; F80-H84 VanDerWaalsContact O-CB 3.31Å; F80-H84 WeakPolarHBondContact O-CB 3.31Å; F80-H84 PolarHBondContact O-N 2.97Å |
| 81 | F | 58.1 | Low | 59 | Low | 57 Ų | 57 | 88 Ų | 88 | 25% | 0.25 | 47% | 0.468 | C | S | . | . | H | α-helix | trans | -66.8 | -46 | 175.8 | -90.2 | -111 | 0 | 0 | 0 | 111.8 | F77 W78 P79 A83 H84 C85 C168 | F77-F81 AromaticContact CD1-CD2 3.66Å; F77-F81 HydrophobicContact CD1-CD2 3.66Å; F77-F81 AromaticContact CD1-CE2 3.56Å; F77-F81 HydrophobicContact CD1-CE2 3.56Å; F77-F81 HydrophobicContact CD1-CG 4.42Å; F77-F81 HydrophobicContact CD1-CZ 4.05Å; F77-F81 HydrophobicContact CD2-CD2 4Å; F77-F81 AromaticContact CD2-CE2 3.73Å; F77-F81 HydrophobicContact CD2-CE2 3.73Å; F77-F81 AromaticContact CE1-CD2 3.6Å; F77-F81 HydrophobicContact CE1-CD2 3.6Å; F77-F81 AromaticContact CE1-CE1 4Å; F77-F81 HydrophobicContact CE1-CE1 4Å; F77-F81 AromaticContact CE1-CE2 3Å; F77-F81 HydrophobicContact CE1-CE2 3Å; F77-F81 HydrophobicContact CE1-CG 4.37Å; F77-F81 AromaticContact CE1-CZ 3.14Å; F77-F81 HydrophobicContact CE1-CZ 3.14Å; F77-F81 AromaticContact CE2-CD2 3.9Å; F77-F81 HydrophobicContact CE2-CD2 3.9Å; F77-F81 AromaticContact CE2-CE2 3.15Å; F77-F81 HydrophobicContact CE2-CE2 3.15Å; F77-F81 AromaticContact CE2-CZ 3.92Å; F77-F81 HydrophobicContact CE2-CZ 3.92Å; F77-F81 AromaticContact CG-CD2 3.92Å; F77-F81 HydrophobicContact CG-CD2 3.92Å; F77-F81 AromaticContact CG-CE2 3.93Å; F77-F81 HydrophobicContact CG-CE2 3.93Å; F77-F81 AromaticContact CZ-CD2 3.78Å; F77-F81 HydrophobicContact CZ-CD2 3.78Å; F77-F81 HydrophobicContact CZ-CE1 4.32Å; F77-F81 AromaticContact CZ-CE2 2.82Å; F77-F81 HydrophobicContact CZ-CE2 2.82Å; F77-F81 AromaticContact CZ-CZ 3.11Å; F77-F81 HydrophobicContact CZ-CZ 3.11Å; F77-F81 WeakPolarHBondContact O-CD2 3.34Å; F77-F81 PolarHBondContact O-N 3.49Å; F77-F81 VanDerWaalsContact O-N 3.12Å; W78-F81 PolarHBondContact O-N 2.88Å; P79-F81 VanDerWaalsContact C-N 3.34Å; F81-A83 VanDerWaalsContact C-N 3.35Å; F81-H84 PolarHBondContact O-N 2.91Å; F81-C85 VanDerWaalsContact O-CB 3.32Å; F81-C85 WeakPolarHBondContact O-CB 3.24Å; F81-C85 PolarHBondContact O-N 3.4Å; F81-C85 PolarHBondContact O-SG 3.42Å; F81-C168 WeakPolarHBondContact CZ-SG 3.21Å |
| 82 | I | 65.6 | Low | 59 | Low | 85 Ų | 85 | 87 Ų | 87 | 44% | 0.436 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -61 | -47 | 175.3 | -68.8 | 173.1 | 0 | 0 | 0 | 110 | W78 H84 C85 L86 | W78-I82 WeakPolarHBondContact O-CG1 3.35Å; W78-I82 PolarHBondContact O-N 3.01Å; I82-H84 PolarHBondContact O-N 3.31Å; I82-C85 PolarHBondContact O-N 2.93Å; I82-L86 HydrophobicContact CG2-CD1 3.75Å; I82-L86 HydrophobicContact CG2-CG 4.24Å; I82-L86 WeakPolarHBondContact O-CB 3.41Å; I82-L86 VanDerWaalsContact O-CG 3.25Å; I82-L86 WeakPolarHBondContact O-CG 3.16Å; I82-L86 PolarHBondContact O-N 2.99Å |
| 83 | A | 67.7 | Low | 58.9 | Low | 52 Ų | 52 | 87.2 Ų | 87.2 | 43% | 0.43 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -60.3 | -45 | 179.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | P79 F80 F81 L86 L87 | P79-A83 VanDerWaalsContact O-CB 3.24Å; P79-A83 WeakPolarHBondContact O-CB 3.14Å; P79-A83 PolarHBondContact O-N 3.31Å; F80-A83 PolarHBondContact O-N 3.47Å; F81-A83 VanDerWaalsContact C-N 3.35Å; A83-L86 PolarHBondContact O-N 2.87Å; A83-L87 WeakPolarHBondContact O-CB 3.43Å; A83-L87 PolarHBondContact O-N 3.31Å |
| 84 | H | 66.1 | Low | 58.9 | Low | 118 Ų | 118 | 87.8 Ų | 87.8 | 55% | 0.546 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -66.6 | -38.7 | 178.7 | -169.7 | -86.9 | 0 | 0 | 0 | 112.6 | F80 F81 I82 L87 S88 | F80-H84 VanDerWaalsContact O-CB 3.31Å; F80-H84 WeakPolarHBondContact O-CB 3.31Å; F80-H84 PolarHBondContact O-N 2.97Å; F81-H84 PolarHBondContact O-N 2.91Å; I82-H84 PolarHBondContact O-N 3.31Å; H84-L87 PolarHBondContact O-N 3.25Å; H84-S88 VanDerWaalsContact O-CB 3.31Å; H84-S88 WeakPolarHBondContact O-CB 3.2Å; H84-S88 PolarHBondContact O-N 3.49Å; H84-S88 PolarHBondContact O-OG 3.32Å |
| 85 | C | 58.9 | Low | 58.7 | Low | 58 Ų | 58 | 93.3 Ų | 93.3 | 39% | 0.392 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -63.3 | -46 | 174.1 | -75.1 | 0 | 0 | 0 | 0 | 111.6 | F81 I82 S88 Q89 | F81-C85 VanDerWaalsContact O-CB 3.32Å; F81-C85 WeakPolarHBondContact O-CB 3.24Å; F81-C85 PolarHBondContact O-N 3.4Å; F81-C85 PolarHBondContact O-SG 3.42Å; I82-C85 PolarHBondContact O-N 2.93Å; C85-S88 PolarHBondContact O-N 3.07Å; C85-Q89 WeakPolarHBondContact O-CG 3.25Å; C85-Q89 PolarHBondContact O-N 2.68Å |
| 86 | L | 62.6 | Low | 58.1 | Low | 106 Ų | 106 | 89.3 Ų | 89.3 | 56% | 0.555 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -65.1 | -41.7 | 177.3 | -68 | 174.9 | 0 | 0 | 0 | 111.8 | I82 A83 Q89 L90 | I82-L86 HydrophobicContact CG2-CD1 3.75Å; I82-L86 HydrophobicContact CG2-CG 4.24Å; I82-L86 WeakPolarHBondContact O-CB 3.41Å; I82-L86 VanDerWaalsContact O-CG 3.25Å; I82-L86 WeakPolarHBondContact O-CG 3.16Å; I82-L86 PolarHBondContact O-N 2.99Å; A83-L86 PolarHBondContact O-N 2.87Å; L86-Q89 PolarHBondContact O-N 3.45Å; L86-L90 WeakPolarHBondContact O-CB 3.45Å; L86-L90 PolarHBondContact O-N 3.01Å |
| 87 | L | 64.6 | Low | 57.3 | Low | 116 Ų | 116 | 93.1 Ų | 93.1 | 61% | 0.607 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -65.4 | -40 | 177.6 | -132.7 | 85.5 | 0 | 0 | 0 | 112 | A83 H84 L90 S91 | A83-L87 WeakPolarHBondContact O-CB 3.43Å; A83-L87 PolarHBondContact O-N 3.31Å; H84-L87 PolarHBondContact O-N 3.25Å; L87-L90 PolarHBondContact O-N 3.03Å; L87-S91 VanDerWaalsContact O-CB 3.28Å; L87-S91 WeakPolarHBondContact O-CB 3.38Å; L87-S91 PolarHBondContact O-N 3.37Å; L87-S91 PolarHBondContact O-OG 3.21Å |
| 88 | S | 63.5 | Low | 56.6 | Low | 59 Ų | 59 | 97.8 Ų | 97.8 | 41% | 0.413 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -66 | -42.4 | 177.1 | -67.8 | 0 | 0 | 0 | 0 | 111.4 | H84 C85 L92 | H84-S88 VanDerWaalsContact O-CB 3.31Å; H84-S88 WeakPolarHBondContact O-CB 3.2Å; H84-S88 PolarHBondContact O-N 3.49Å; H84-S88 PolarHBondContact O-OG 3.32Å; C85-S88 PolarHBondContact O-N 3.07Å; S88-L92 WeakPolarHBondContact O-CB 3.38Å; S88-L92 PolarHBondContact O-N 3.43Å |
| 89 | Q | 58.3 | Low | 55.9 | Low | 132 Ų | 132 | 97.8 Ų | 97.8 | 62% | 0.617 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -64.4 | -42.5 | 175 | -73.5 | -173.7 | -3.4 | 0 | 0 | 112 | C85 L86 L92 S93 | C85-Q89 WeakPolarHBondContact O-CG 3.25Å; C85-Q89 PolarHBondContact O-N 2.68Å; L86-Q89 PolarHBondContact O-N 3.45Å; Q89-L92 PolarHBondContact O-N 3.5Å; Q89-S93 PolarHBondContact O-N 2.8Å |
| 90 | L | 57.6 | Low | 54.7 | Low | 120 Ų | 120 | 102.2 Ų | 102.2 | 63% | 0.628 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -65.4 | -42.8 | 178.1 | -172.5 | 66.1 | 0 | 0 | 0 | 112 | L86 L87 L92 S93 C94 | L86-L90 WeakPolarHBondContact O-CB 3.45Å; L86-L90 PolarHBondContact O-N 3.01Å; L87-L90 PolarHBondContact O-N 3.03Å; L90-L92 VanDerWaalsContact C-N 3.33Å; L90-L92 PolarHBondContact O-N 3.39Å; L90-S93 PolarHBondContact O-N 3.4Å; L90-C94 WeakPolarHBondContact O-CB 3.2Å; L90-C94 PolarHBondContact O-N 2.85Å |
| 91 | S | 56.1 | Low | 53.7 | Low | 71 Ų | 71 | 101.4 Ų | 101.4 | 50% | 0.497 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -64.2 | -38.5 | 178.2 | -59 | 0 | 0 | 0 | 0 | 111.9 | L87 K95 | L87-S91 VanDerWaalsContact O-CB 3.28Å; L87-S91 WeakPolarHBondContact O-CB 3.38Å; L87-S91 PolarHBondContact O-N 3.37Å; L87-S91 PolarHBondContact O-OG 3.21Å; S91-K95 WeakPolarHBondContact O-CB 3.46Å; S91-K95 PolarHBondContact O-N 3.34Å; S91-K95 VanDerWaalsContact O-N 3.13Å |
| 92 | L | 54.3 | Low | 52.8 | Low | 101 Ų | 101 | 104.8 Ų | 104.8 | 53% | 0.529 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -71 | -35.2 | 177.5 | -163.1 | 69.1 | 0 | 0 | 0 | 112.1 | W33 S88 Q89 L90 G96 | W33-L92 HydrophobicContact CH2-CD2 3.99Å; W33-L92 HydrophobicContact CZ3-CD2 4.43Å; S88-L92 WeakPolarHBondContact O-CB 3.38Å; S88-L92 PolarHBondContact O-N 3.43Å; Q89-L92 PolarHBondContact O-N 3.5Å; L90-L92 VanDerWaalsContact C-N 3.33Å; L90-L92 PolarHBondContact O-N 3.39Å; L92-G96 PolarHBondContact O-N 2.77Å |
| 93 | S | 53.5 | Low | 51.7 | Low | 77 Ų | 77 | 105.3 Ų | 105.3 | 54% | 0.538 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -68.4 | -45.7 | 175.1 | -134.7 | 0 | 0 | 0 | 0 | 111.7 | Q89 L90 K95 G96 E97 | Q89-S93 PolarHBondContact O-N 2.8Å; L90-S93 PolarHBondContact O-N 3.4Å; S93-K95 PolarHBondContact O-N 2.71Å; S93-G96 PolarHBondContact O-N 3.38Å; S93-G96 VanDerWaalsContact O-N 3.15Å; S93-E97 PolarHBondContact O-N 3.3Å |
| 94 | C | 52 | Low | 50.3 | Low | 65 Ų | 65 | 113 Ų | 113 | 44% | 0.439 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -68.2 | -37.3 | -177 | -160 | 0 | 0 | 0 | 0 | 112.5 | L90 G96 E97 I98 | L90-C94 WeakPolarHBondContact O-CB 3.2Å; L90-C94 PolarHBondContact O-N 2.85Å; C94-G96 VanDerWaalsContact C-N 3.26Å; C94-G96 PolarHBondContact O-N 2.84Å; C94-E97 PolarHBondContact O-N 2.78Å; C94-I98 PolarHBondContact O-N 2.91Å |
| 95 | K | 49.5 | Very low | 48.8 | Very low | 172 Ų | 172 | 113.5 Ų | 113.5 | 75% | 0.748 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -68.5 | -24.1 | 174.6 | -164.9 | 163.2 | 173.3 | 179 | 0 | 112.9 | S91 S93 | S91-K95 WeakPolarHBondContact O-CB 3.46Å; S91-K95 PolarHBondContact O-N 3.34Å; S91-K95 VanDerWaalsContact O-N 3.13Å; S93-K95 PolarHBondContact O-N 2.71Å |
| 96 | G | 42.7 | Very low | 47.9 | Very low | 36 Ų | 36 | 118.3 Ų | 118.3 | 37% | 0.371 | 64% | 0.642 | S | S | . | * | H | α-helix | trans | -80.2 | -17.8 | 174.9 | 0 | 0 | 0 | 0 | 0 | 114.9 | L92 S93 C94 | L92-G96 PolarHBondContact O-N 2.77Å; S93-G96 PolarHBondContact O-N 3.38Å; S93-G96 VanDerWaalsContact O-N 3.15Å; C94-G96 VanDerWaalsContact C-N 3.26Å; C94-G96 PolarHBondContact O-N 2.84Å |
| 97 | E | 44 | Very low | 46.8 | Very low | 139 Ų | 139 | 117.4 Ų | 117.4 | 65% | 0.65 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -95.4 | -42.3 | -175.1 | -156.5 | 170.2 | -161.3 | 0 | 0 | 112.2 | S93 C94 Q99 R100 | S93-E97 PolarHBondContact O-N 3.3Å; C94-E97 PolarHBondContact O-N 2.78Å; E97-Q99 VanDerWaalsContact C-N 3.29Å; E97-Q99 PolarHBondContact O-N 3.49Å; E97-R100 PolarHBondContact O-N 3.27Å |
| 98 | I | 39.9 | Very low | 45.7 | Very low | 132 Ų | 132 | 119.6 Ų | 119.6 | 68% | 0.677 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -64.3 | -31.7 | 177.9 | -75.2 | 159.9 | 0 | 0 | 0 | 112.3 | C94 R100 | C94-I98 PolarHBondContact O-N 2.91Å; I98-R100 VanDerWaalsContact C-N 3.35Å; I98-R100 PolarHBondContact O-N 2.9Å |
| 99 | Q | 36.6 | Very low | 44.2 | Very low | 165 Ų | 165 | 124.8 Ų | 124.8 | 77% | 0.771 | 67% | 0.672 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80 | -11.5 | -178.4 | -139.1 | -151.1 | -46.9 | 0 | 0 | 114.3 | E97 | E97-Q99 VanDerWaalsContact C-N 3.29Å; E97-Q99 PolarHBondContact O-N 3.49Å |
| 100 | R | 38.4 | Very low | 43.5 | Very low | 165 Ų | 165 | 126 Ų | 126 | 62% | 0.623 | 69% | 0.688 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.6 | -13.3 | 178.5 | -90.4 | -165.6 | 177.9 | 79.5 | 5.9 | 114.5 | E97 I98 C102 | E97-R100 PolarHBondContact O-N 3.27Å; I98-R100 VanDerWaalsContact C-N 3.35Å; I98-R100 PolarHBondContact O-N 2.9Å; R100-C102 VanDerWaalsContact C-N 3.32Å; R100-C102 PolarHBondContact O-N 3.38Å |
| 101 | S | 37.8 | Very low | 42.4 | Very low | 104 Ų | 104 | 123.3 Ų | 123.3 | 73% | 0.727 | 69% | 0.689 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.1 | -15.2 | -178.9 | -149.6 | 0 | 0 | 0 | 0 | 113.6 | ||
| 102 | C | 39.6 | Very low | 41.7 | Very low | 128 Ų | 128 | 129.2 Ų | 129.2 | 87% | 0.865 | 71% | 0.709 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -102 | 9 | 178.7 | -70.2 | 0 | 0 | 0 | 0 | 115.2 | R100 | R100-C102 VanDerWaalsContact C-N 3.32Å; R100-C102 PolarHBondContact O-N 3.38Å |
| 103 | S | 41.9 | Very low | 40.9 | Very low | 95 Ų | 95 | 133 Ų | 133 | 66% | 0.664 | 72% | 0.724 | S | S | * | * | S | Bend | trans | -124.9 | 18.3 | -174.1 | 78 | 0 | 0 | 0 | 0 | 115.2 | ||
| 104 | R | 37.7 | Very low | 40.1 | Very low | 214 Ų | 214 | 135.2 Ų | 135.2 | 81% | 0.808 | 74% | 0.738 | S | S | * | * | S | Bend | trans | -149.5 | 88.9 | 178.3 | -151.3 | 168.7 | -174 | 147.3 | 0.5 | 106.7 | ||
| 105 | T | 36.1 | Very low | 39.5 | Very low | 128 Ų | 128 | 139.8 Ų | 139.8 | 79% | 0.785 | 75% | 0.753 | S | S | * | * | -166.2 | 106.8 | 88.8 | 37.9 | 0 | 0 | 0 | 0 | 110.9 | |||||
| 106 | V | 39.6 | Very low | 39.3 | Very low | 159 Ų | 159 | 138.2 Ų | 138.2 | 96% | 0.964 | 76% | 0.757 | S | S | * | * | S | Bend | trans | -124.5 | 25.3 | 164.5 | -178.8 | 0 | 0 | 0 | 0 | 110.7 | ||
| 107 | A | 40.1 | Very low | 39.2 | Very low | 88 Ų | 88 | 140.7 Ų | 140.7 | 73% | 0.727 | 77% | 0.774 | S | S | * | * | S | Bend | trans | -138.8 | 108.2 | 168.5 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||
| 108 | E | 40 | Very low | 38.9 | Very low | 162 Ų | 162 | 139.4 Ų | 139.4 | 76% | 0.757 | 78% | 0.779 | S | S | * | * | S | Bend | trans | 96.7 | 125.6 | 157.5 | -142.9 | 176.3 | 140.3 | 0 | 0 | 118.4 | ||
| 109 | K | 32.6 | Very low | 38.8 | Very low | 168 Ų | 168 | 142.8 Ų | 142.8 | 73% | 0.73 | 79% | 0.792 | S | S | * | * | trans | 91.9 | 89 | 170.6 | -51 | -55.1 | 178.7 | -159.9 | 0 | 116.8 | ||||
| 110 | V | 42.7 | Very low | 38.9 | Very low | 157 Ų | 157 | 140.2 Ų | 140.2 | 95% | 0.952 | 79% | 0.791 | S | S | * | * | trans | -50 | 128.3 | 137 | 166.8 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 111 | G | 35.2 | Very low | 38.9 | Very low | 63 Ų | 63 | 143.7 Ų | 143.7 | 65% | 0.649 | 80% | 0.804 | S | S | * | * | trans | 165.1 | 79.9 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 112 | E | 42.4 | Very low | 39 | Very low | 196 Ų | 196 | 150.3 Ų | 150.3 | 92% | 0.916 | 81% | 0.813 | S | S | * | * | S | Bend | trans | 46 | 127.2 | 152.8 | -55.3 | -174.2 | 129.5 | 0 | 0 | 119.4 | ||
| 113 | Q | 37.2 | Very low | 38.9 | Very low | 180 Ų | 180 | 154.6 Ų | 154.6 | 84% | 0.841 | 81% | 0.813 | S | S | * | * | trans | 93.6 | 69.8 | 168 | -150.4 | 154.1 | 6.3 | 0 | 0 | 117.1 | ||||
| 114 | C | 36.7 | Very low | 39.4 | Very low | 123 Ų | 123 | 154.9 Ų | 154.9 | 83% | 0.831 | 81% | 0.812 | S | S | * | * | trans | -87.6 | 103.2 | 162 | -167.5 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 115 | Q | 39.3 | Very low | 40.1 | Very low | 161 Ų | 161 | 150.7 Ų | 150.7 | 75% | 0.752 | 81% | 0.813 | S | S | * | * | trans | -94.4 | 96.7 | 175 | -145.9 | 178.3 | 39.5 | 0 | 0 | 110.5 | A117 | Q115-A117 PolarHBondContact O-N 3.49Š| ||
| 116 | V | 45.6 | Very low | 40.6 | Very low | 139 Ų | 139 | 152.1 Ų | 152.1 | 84% | 0.842 | 82% | 0.815 | S | S | * | * | S | Bend | trans | 57.8 | 33.2 | 137.8 | -157 | 0 | 0 | 0 | 0 | 120.3 | ||
| 117 | A | 40.3 | Very low | 41.6 | Very low | 88 Ų | 88 | 149.8 Ų | 149.8 | 73% | 0.727 | 80% | 0.803 | S | S | * | * | trans | -143.2 | 23.5 | 173 | 0 | 0 | 0 | 0 | 0 | 118.1 | Q115 | Q115-A117 PolarHBondContact O-N 3.49Š| ||
| 118 | C | 36.5 | Very low | 42.6 | Very low | 112 Ų | 112 | 151.2 Ų | 151.2 | 76% | 0.757 | 81% | 0.805 | S | S | * | * | trans | -139.7 | 114.1 | 167.9 | -79.9 | 0 | 0 | 0 | 0 | 110.4 | C120 | C118-C120 PolarHBondContact O-N 3.5Š| ||
| 119 | H | 38.4 | Very low | 43.3 | Very low | 204 Ų | 204 | 149.2 Ų | 149.2 | 94% | 0.944 | 81% | 0.806 | S | S | * | * | trans | -65.6 | 93.6 | 167.9 | -95.6 | -66.2 | 0 | 0 | 0 | 109.6 | R121 | H119-R121 PolarHBondContact O-N 2.96Š| ||
| 120 | C | 39.3 | Very low | 44.8 | Very low | 111 Ų | 111 | 146.8 Ų | 146.8 | 75% | 0.75 | 81% | 0.807 | S | S | * | * | trans | -68.2 | 114.4 | 174.6 | -65.4 | 0 | 0 | 0 | 0 | 110.7 | C118 R122 | C118-C120 PolarHBondContact O-N 3.5Å; C120-R122 PolarHBondContact O-N 3.47Å | ||
| 121 | R | 37.9 | Very low | 45.7 | Very low | 238 Ų | 238 | 144.9 Ų | 144.9 | 90% | 0.898 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -64.1 | 124.4 | 162.2 | -108.4 | -161.4 | 177.9 | -173.3 | 1.5 | 108.4 | H119 Y123 | H119-R121 PolarHBondContact O-N 2.96Å; R121-Y123 PolarHBondContact O-N 2.88Å |
| 122 | R | 40.8 | Very low | 46.6 | Very low | 243 Ų | 243 | 147.9 Ų | 147.9 | 92% | 0.917 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -60.1 | 124.5 | 167.7 | -77.7 | -174.4 | 177.9 | 136.3 | -1.8 | 109.2 | C120 | C120-R122 PolarHBondContact O-N 3.47Š|
| 123 | Y | 37.3 | Very low | 47.4 | Very low | 218 Ų | 218 | 144.1 Ų | 144.1 | 86% | 0.855 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -68.9 | 137.3 | 166.2 | -84.4 | -90.2 | 0 | 0 | 0 | 109.7 | R121 | R121-Y123 PolarHBondContact O-N 2.88Š|
| 124 | P | 52.6 | Low | 48.4 | Very low | 100 Ų | 100 | 140.7 Ų | 140.7 | 65% | 0.649 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -72 | 148.4 | 170.1 | 29.5 | -30.9 | 0 | 0 | 0 | 110.4 | ||
| 125 | P | 51 | Low | 49.1 | Very low | 126 Ų | 126 | 140.9 Ų | 140.9 | 82% | 0.818 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -65.9 | 135.6 | -179.2 | 26.3 | -32.5 | 0 | 0 | 0 | 111.6 | ||
| 126 | L | 48.1 | Very low | 49.7 | Very low | 158 Ų | 158 | 139.3 Ų | 139.3 | 83% | 0.827 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -71.9 | 141.8 | 173.4 | -89.7 | 73.7 | 0 | 0 | 0 | 110.8 | ||
| 127 | P | 60.7 | Low | 50 | Low | 111 Ų | 111 | 144.3 Ų | 144.3 | 72% | 0.721 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -70.3 | 156.3 | 173.1 | 28.9 | -33.1 | 0 | 0 | 0 | 112.4 | ||
| 128 | P | 60.5 | Low | 50.4 | Low | 117 Ų | 117 | 148.3 Ų | 148.3 | 76% | 0.76 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -64.1 | 148.9 | -177.5 | 26.1 | -33.9 | 0 | 0 | 0 | 112.5 | ||
| 129 | P | 54.1 | Low | 50.5 | Low | 120 Ų | 120 | 151.2 Ų | 151.2 | 78% | 0.779 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -69.9 | 135.6 | -175.1 | 26.9 | -33.2 | 0 | 0 | 0 | 112.3 | ||
| 130 | P | 63.4 | Low | 50.9 | Low | 118 Ų | 118 | 145 Ų | 145 | 77% | 0.766 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -73.9 | 153.6 | 171.7 | 28.8 | -32.2 | 0 | 0 | 0 | 112.4 | ||
| 131 | P | 61.6 | Low | 50.6 | Low | 116 Ų | 116 | 145.7 Ų | 145.7 | 75% | 0.753 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -65.7 | 154.2 | -177.3 | 26.2 | -34 | 0 | 0 | 0 | 113.5 | ||
| 132 | P | 54 | Low | 50.9 | Low | 126 Ų | 126 | 141.5 Ų | 141.5 | 82% | 0.818 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -72.1 | 132.7 | -172.1 | 27.4 | -33.7 | 0 | 0 | 0 | 113.1 | ||
| 133 | P | 60.1 | Low | 50.8 | Low | 117 Ų | 117 | 136.1 Ų | 136.1 | 76% | 0.76 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -81 | 151.8 | 171.5 | 30.1 | -31.7 | 0 | 0 | 0 | 113.1 | ||
| 134 | P | 58.6 | Low | 51 | Low | 109 Ų | 109 | 129.8 Ų | 129.8 | 71% | 0.708 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -71.2 | 158.3 | -176.1 | 29.6 | -35 | 0 | 0 | 0 | 113.5 | P136 | P134-P136 VanDerWaalsContact O-CD 3.26Å; P134-P136 WeakPolarHBondContact O-CD 3.46Å |
| 135 | P | 51.2 | Low | 50.4 | Low | 127 Ų | 127 | 133.4 Ų | 133.4 | 83% | 0.825 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -76.5 | 122.8 | -168.9 | 29.4 | -33.2 | 0 | 0 | 0 | 113.1 | ||
| 136 | P | 51.4 | Low | 49.7 | Very low | 127 Ų | 127 | 132.7 Ų | 132.7 | 83% | 0.825 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -88.1 | 137.3 | 170.2 | -8.2 | 28.3 | 0 | 0 | 0 | 111.6 | P134 | P134-P136 VanDerWaalsContact O-CD 3.26Å; P134-P136 WeakPolarHBondContact O-CD 3.46Å |
| 137 | R | 51.8 | Low | 49.3 | Very low | 244 Ų | 244 | 133.6 Ų | 133.6 | 92% | 0.921 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -70.5 | 147.4 | -174.8 | -64.9 | 178 | 172.3 | -175 | -3.2 | 112.9 | L139 | R137-L139 PolarHBondContact O-N 3.45Š|
| 138 | L | 48.6 | Very low | 48.3 | Very low | 172 Ų | 172 | 134.5 Ų | 134.5 | 90% | 0.901 | 80% | 0.803 | S | S | * | * | trans | -35.1 | 118.2 | 169.4 | -76.6 | 152.7 | 0 | 0 | 0 | 114.8 | ||||
| 139 | L | 38.9 | Very low | 47.5 | Very low | 174 Ų | 174 | 133.3 Ų | 133.3 | 91% | 0.911 | 80% | 0.795 | S | S | * | * | trans | -149.6 | 114.3 | 143.7 | -97 | 119.9 | 0 | 0 | 0 | 108 | R137 | R137-L139 PolarHBondContact O-N 3.45Š| ||
| 140 | G | 46.6 | Very low | 47.1 | Very low | 74 Ų | 74 | 134.9 Ų | 134.9 | 76% | 0.763 | 80% | 0.797 | S | S | * | * | trans | -73.7 | 133.9 | -177.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 141 | T | 34.3 | Very low | 46.3 | Very low | 124 Ų | 124 | 134.9 Ų | 134.9 | 76% | 0.761 | 79% | 0.789 | S | S | * | * | trans | -150.8 | 105.4 | 150.4 | 41.2 | 0 | 0 | 0 | 0 | 107.3 | V143 | T141-V143 PolarHBondContact O-N 2.98Š| ||
| 142 | T | 43.6 | Very low | 45.8 | Very low | 150 Ų | 150 | 139.2 Ų | 139.2 | 92% | 0.92 | 79% | 0.791 | S | S | * | * | trans | -61.2 | 92.6 | 171.8 | -31.4 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 143 | V | 38.4 | Very low | 45.7 | Very low | 131 Ų | 131 | 136.3 Ų | 136.3 | 79% | 0.794 | 77% | 0.772 | S | S | * | * | trans | -95.1 | 99 | 166.3 | 177.2 | 0 | 0 | 0 | 0 | 106.2 | T141 E145 | T141-V143 PolarHBondContact O-N 2.98Å; V143-E145 PolarHBondContact O-N 3.3Å | ||
| 144 | A | 40.8 | Very low | 45.2 | Very low | 85 Ų | 85 | 137.9 Ų | 137.9 | 70% | 0.702 | 76% | 0.763 | S | S | * | * | trans | -55.5 | 130.1 | 174.6 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 145 | E | 39.6 | Very low | 44.8 | Very low | 175 Ų | 175 | 140.3 Ų | 140.3 | 82% | 0.818 | 76% | 0.758 | S | S | * | * | trans | -50.9 | 141.5 | 165.6 | -94.1 | -144.9 | 133.9 | 0 | 0 | 110.5 | V143 M147 | V143-E145 PolarHBondContact O-N 3.3Å; E145-M147 VanDerWaalsContact C-N 3.35Å; E145-M147 PolarHBondContact O-N 3.12Å | ||
| 146 | P | 37.7 | Very low | 44.9 | Very low | 111 Ų | 111 | 140.1 Ų | 140.1 | 72% | 0.721 | 75% | 0.748 | S | S | * | * | trans | -69 | 101.6 | 163.3 | 30.2 | -27.9 | 0 | 0 | 0 | 106.8 | V148 | P146-V148 VanDerWaalsContact C-N 3.32Å; P146-V148 PolarHBondContact O-N 3.23Å | ||
| 147 | M | 39.5 | Very low | 45.2 | Very low | 177 Ų | 177 | 140.2 Ų | 140.2 | 87% | 0.872 | 74% | 0.737 | S | S | * | * | trans | -45.4 | 103.4 | 157.1 | -90.5 | -174.2 | 155.3 | 0 | 0 | 107.5 | E145 P149 | E145-M147 VanDerWaalsContact C-N 3.35Å; E145-M147 PolarHBondContact O-N 3.12Å; M147-P149 WeakPolarHBondContact O-CD 3.31Å | ||
| 148 | V | 39.9 | Very low | 45.6 | Very low | 130 Ų | 130 | 132.4 Ų | 132.4 | 79% | 0.788 | 72% | 0.716 | S | S | * | * | trans | -55 | 112.9 | 160.6 | 174.4 | 0 | 0 | 0 | 0 | 104.6 | P146 L150 | P146-V148 VanDerWaalsContact C-N 3.32Å; P146-V148 PolarHBondContact O-N 3.23Å; V148-L150 PolarHBondContact O-N 3.39Å | ||
| 149 | P | 42.9 | Very low | 46.1 | Very low | 92 Ų | 92 | 128.6 Ų | 128.6 | 60% | 0.597 | 70% | 0.697 | S | S | * | * | trans | -62.5 | 117.4 | 177 | 25.1 | -29.1 | 0 | 0 | 0 | 105 | M147 L151 | M147-P149 WeakPolarHBondContact O-CD 3.31Å; P149-L151 HydrophobicContact CG-CG 4.41Å; P149-L151 PolarHBondContact O-N 2.91Å | ||
| 150 | L | 45.4 | Very low | 47.2 | Very low | 154 Ų | 154 | 125.4 Ų | 125.4 | 81% | 0.806 | 68% | 0.684 | S | S | * | * | trans | -57.5 | 84.8 | 156.3 | -172.5 | 144 | 0 | 0 | 0 | 104.5 | V148 R152 | V148-L150 PolarHBondContact O-N 3.39Å; L150-R152 HydrophobicContact CD2-CG 4Å; L150-R152 PolarHBondContact O-N 2.91Å | ||
| 151 | L | 47.7 | Very low | 48 | Very low | 117 Ų | 117 | 126.4 Ų | 126.4 | 61% | 0.613 | 67% | 0.671 | S | S | * | * | trans | -60.5 | 86.5 | 173.8 | -85.5 | 156.6 | 0 | 0 | 0 | 104.5 | P149 P153 W154 | P149-L151 HydrophobicContact CG-CG 4.41Å; P149-L151 PolarHBondContact O-N 2.91Å; L151-P153 WeakPolarHBondContact O-CD 3.41Å; L151-P153 VanDerWaalsContact O-N 3.08Å; L151-W154 HydrophobicContact CD2-CZ3 4.23Å | ||
| 152 | R | 49.7 | Very low | 49.6 | Very low | 207 Ų | 207 | 124 Ų | 124 | 78% | 0.781 | 66% | 0.656 | S | S | * | * | trans | -55.2 | 112.5 | 151.2 | -78.6 | -143.8 | -154.8 | -157.2 | 11.7 | 104 | L150 W154 | L150-R152 HydrophobicContact CD2-CG 4Å; L150-R152 PolarHBondContact O-N 2.91Å; R152-W154 VanDerWaalsContact C-N 3.33Å; R152-W154 PolarHBondContact O-N 3.44Å | ||
| 153 | P | 53.1 | Low | 50.8 | Low | 66 Ų | 66 | 123 Ų | 123 | 43% | 0.429 | 64% | 0.644 | S | S | . | * | trans | -71.2 | 97.8 | -174.8 | 27.6 | -30.5 | 0 | 0 | 0 | 106.7 | L151 W155 M156 | L151-P153 WeakPolarHBondContact O-CD 3.41Å; L151-P153 VanDerWaalsContact O-N 3.08Å; P153-W155 PolarHBondContact O-N 3.38Å; P153-W155 VanDerWaalsContact O-N 3.07Å; P153-M156 HydrophobicContact CB-CB 4.48Å; P153-M156 HydrophobicContact CB-CG 3.79Å; P153-M156 HydrophobicContact CG-CB 4.11Å; P153-M156 HydrophobicContact CG-CG 3.46Å; P153-M156 VanDerWaalsContact CG-CG 3.46Å; P153-M156 PolarHBondContact O-N 3.45Å | ||
| 154 | W | 50.3 | Low | 52.3 | Low | 149 Ų | 149 | 117.8 Ų | 117.8 | 56% | 0.564 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -52.6 | -27.7 | 171.9 | 61.5 | 67.5 | 0 | 0 | 0 | 110.9 | L151 R152 M156 E157 V158 | L151-W154 HydrophobicContact CD2-CZ3 4.23Å; R152-W154 VanDerWaalsContact C-N 3.33Å; R152-W154 PolarHBondContact O-N 3.44Å; W154-M156 VanDerWaalsContact C-N 3.26Å; W154-M156 PolarHBondContact O-N 2.9Å; W154-E157 PolarHBondContact O-N 3.47Å; W154-E157 VanDerWaalsContact O-N 3.16Å; W154-V158 WeakPolarHBondContact O-CG2 3.44Å; W154-V158 PolarHBondContact O-N 2.88Å; W154-V158 VanDerWaalsContact O-N 3.12Å |
| 155 | W | 49.3 | Very low | 53.3 | Low | 161 Ų | 161 | 116.2 Ų | 116.2 | 61% | 0.61 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -55.3 | -39 | 174.2 | -55.5 | 100.6 | 0 | 0 | 0 | 112.4 | P153 E157 D159 | P153-W155 PolarHBondContact O-N 3.38Å; P153-W155 VanDerWaalsContact O-N 3.07Å; W155-E157 VanDerWaalsContact C-N 3.31Å; W155-E157 PolarHBondContact O-N 2.9Å; W155-D159 WeakPolarHBondContact O-CB 3.29Å; W155-D159 PolarHBondContact O-N 3.14Å |
| 156 | M | 53.8 | Low | 54.6 | Low | 123 Ų | 123 | 112.2 Ų | 112.2 | 61% | 0.606 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -71.4 | -28.4 | -178.6 | -63.8 | -68.2 | 174 | 0 | 0 | 112.2 | P153 W154 V160 | P153-M156 HydrophobicContact CB-CB 4.48Å; P153-M156 HydrophobicContact CB-CG 3.79Å; P153-M156 HydrophobicContact CG-CB 4.11Å; P153-M156 HydrophobicContact CG-CG 3.46Å; P153-M156 VanDerWaalsContact CG-CG 3.46Å; P153-M156 PolarHBondContact O-N 3.45Å; W154-M156 VanDerWaalsContact C-N 3.26Å; W154-M156 PolarHBondContact O-N 2.9Å; M156-V160 VanDerWaalsContact O-CB 3.25Å; M156-V160 WeakPolarHBondContact O-CB 3.37Å; M156-V160 WeakPolarHBondContact O-CG2 3.32Å; M156-V160 PolarHBondContact O-N 3.19Å; M156-V160 VanDerWaalsContact O-N 3.11Å |
| 157 | E | 56.7 | Low | 56.3 | Low | 128 Ų | 128 | 109.5 Ų | 109.5 | 60% | 0.598 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -80.5 | -41.1 | 179.5 | -163.2 | 148.4 | -156.6 | 0 | 0 | 110.6 | W154 W155 V160 I161 | W154-E157 PolarHBondContact O-N 3.47Å; W154-E157 VanDerWaalsContact O-N 3.16Å; W155-E157 VanDerWaalsContact C-N 3.31Å; W155-E157 PolarHBondContact O-N 2.9Å; E157-V160 PolarHBondContact O-N 2.74Å; E157-I161 HydrophobicContact CG-CD1 4.3Å; E157-I161 WeakPolarHBondContact O-CB 3.24Å; E157-I161 WeakPolarHBondContact O-CD1 3.36Å; E157-I161 WeakPolarHBondContact O-CG1 3.25Å; E157-I161 PolarHBondContact O-N 3.38Å |
| 158 | V | 60.1 | Low | 57.5 | Low | 81 Ų | 81 | 102.6 Ų | 102.6 | 49% | 0.491 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -68.6 | -42.2 | 174.3 | -175.5 | 0 | 0 | 0 | 0 | 111 | W154 V160 I161 V162 | W154-V158 WeakPolarHBondContact O-CG2 3.44Å; W154-V158 PolarHBondContact O-N 2.88Å; W154-V158 VanDerWaalsContact O-N 3.12Å; V158-V160 PolarHBondContact O-N 3.28Å; V158-I161 PolarHBondContact O-N 2.98Å; V158-V162 HydrophobicContact CG1-CG2 3.94Å; V158-V162 VanDerWaalsContact O-CB 3.27Å; V158-V162 WeakPolarHBondContact O-CB 3.36Å; V158-V162 WeakPolarHBondContact O-CG2 3.33Å; V158-V162 PolarHBondContact O-N 3.46Å |
| 159 | D | 59.8 | Low | 58.8 | Low | 92 Ų | 92 | 99.3 Ų | 99.3 | 49% | 0.492 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -65.5 | -38.4 | 176.9 | -77.9 | -17.8 | 0 | 0 | 0 | 111.4 | W155 L163 | W155-D159 WeakPolarHBondContact O-CB 3.29Å; W155-D159 PolarHBondContact O-N 3.14Å; D159-L163 WeakPolarHBondContact O-CA 3.43Å; D159-L163 WeakPolarHBondContact O-CB 3.39Å; D159-L163 PolarHBondContact O-N 2.8Å |
| 160 | V | 61.7 | Low | 60.2 | Low | 106 Ų | 106 | 97.8 Ų | 97.8 | 64% | 0.642 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -67.5 | -38.2 | 176.3 | 168.5 | 0 | 0 | 0 | 0 | 111.3 | M156 E157 V158 G164 | M156-V160 VanDerWaalsContact O-CB 3.25Å; M156-V160 WeakPolarHBondContact O-CB 3.37Å; M156-V160 WeakPolarHBondContact O-CG2 3.32Å; M156-V160 PolarHBondContact O-N 3.19Å; M156-V160 VanDerWaalsContact O-N 3.11Å; E157-V160 PolarHBondContact O-N 2.74Å; V158-V160 PolarHBondContact O-N 3.28Å; V160-G164 VanDerWaalsContact O-CA 3.3Å; V160-G164 WeakPolarHBondContact O-CA 3.33Å; V160-G164 PolarHBondContact O-N 2.83Å |
| 161 | I | 63.8 | Low | 61.5 | Low | 96 Ų | 96 | 93.7 Ų | 93.7 | 49% | 0.492 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -71.3 | -46.1 | 177.5 | -66.5 | 164 | 0 | 0 | 0 | 110.7 | E157 V158 T165 | E157-I161 HydrophobicContact CG-CD1 4.3Å; E157-I161 WeakPolarHBondContact O-CB 3.24Å; E157-I161 WeakPolarHBondContact O-CD1 3.36Å; E157-I161 WeakPolarHBondContact O-CG1 3.25Å; E157-I161 PolarHBondContact O-N 3.38Å; V158-I161 PolarHBondContact O-N 2.98Å; I161-T165 HydrophobicContact CG2-CG2 4.39Å; I161-T165 VanDerWaalsContact O-CB 3.29Å; I161-T165 WeakPolarHBondContact O-CB 3.23Å; I161-T165 WeakPolarHBondContact O-CG2 3.44Å; I161-T165 PolarHBondContact O-N 2.89Å; I161-T165 PolarHBondContact O-OG1 2.82Å |
| 162 | V | 67.1 | Low | 62.7 | Low | 73 Ų | 73 | 90.7 Ų | 90.7 | 44% | 0.442 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -69.9 | -48.1 | -179.1 | 173.8 | 0 | 0 | 0 | 0 | 110.4 | V158 G164 T165 V166 | V158-V162 HydrophobicContact CG1-CG2 3.94Å; V158-V162 VanDerWaalsContact O-CB 3.27Å; V158-V162 WeakPolarHBondContact O-CB 3.36Å; V158-V162 WeakPolarHBondContact O-CG2 3.33Å; V158-V162 PolarHBondContact O-N 3.46Å; V162-G164 VanDerWaalsContact C-N 3.31Å; V162-G164 PolarHBondContact O-N 3.45Å; V162-T165 WeakPolarHBondContact CA-OG1 3.24Å; V162-T165 PolarHBondContact O-N 3.48Å; V162-T165 PolarHBondContact O-OG1 3.33Å; V162-V166 HydrophobicContact CG1-CG2 4.24Å; V162-V166 VanDerWaalsContact O-CB 3.25Å; V162-V166 WeakPolarHBondContact O-CB 3.47Å; V162-V166 WeakPolarHBondContact O-CG2 3.46Å; V162-V166 PolarHBondContact O-N 3.32Å |
| 163 | L | 70 | Confident | 63.6 | Low | 128 Ų | 128 | 87.6 Ų | 87.6 | 67% | 0.67 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -66.1 | -36.9 | 177 | -165.6 | 65.7 | 0 | 0 | 0 | 110.9 | D159 S167 | D159-L163 WeakPolarHBondContact O-CA 3.43Å; D159-L163 WeakPolarHBondContact O-CB 3.39Å; D159-L163 PolarHBondContact O-N 2.8Å; L163-S167 WeakPolarHBondContact O-CB 3.44Å; L163-S167 PolarHBondContact O-N 3.47Å; L163-S167 PolarHBondContact O-OG 3.47Å |
| 164 | G | 69.4 | Low | 64.5 | Low | 23 Ų | 23 | 89 Ų | 89 | 24% | 0.237 | 48% | 0.481 | C | S | . | . | H | α-helix | trans | -64.7 | -47.2 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | V160 V162 S167 C168 | V160-G164 VanDerWaalsContact O-CA 3.3Å; V160-G164 WeakPolarHBondContact O-CA 3.33Å; V160-G164 PolarHBondContact O-N 2.83Å; V162-G164 VanDerWaalsContact C-N 3.31Å; V162-G164 PolarHBondContact O-N 3.45Å; G164-S167 PolarHBondContact O-OG 3.17Å; G164-S167 VanDerWaalsContact O-OG 3.11Å; G164-C168 WeakPolarHBondContact O-CB 3.46Å; G164-C168 PolarHBondContact O-N 3.13Å |
| 165 | T | 61.9 | Low | 65.3 | Low | 51 Ų | 51 | 84.6 Ų | 84.6 | 31% | 0.313 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -68.4 | -45.5 | 179.1 | 50.4 | 0 | 0 | 0 | 0 | 111.9 | Y43 I161 V162 C168 A169 | Y43-T165 HydrophobicContact CE2-CG2 3.96Å; Y43-T165 WeakPolarHBondContact OH-CG2 3.44Å; I161-T165 HydrophobicContact CG2-CG2 4.39Å; I161-T165 VanDerWaalsContact O-CB 3.29Å; I161-T165 WeakPolarHBondContact O-CB 3.23Å; I161-T165 WeakPolarHBondContact O-CG2 3.44Å; I161-T165 PolarHBondContact O-N 2.89Å; I161-T165 PolarHBondContact O-OG1 2.82Å; V162-T165 WeakPolarHBondContact CA-OG1 3.24Å; V162-T165 PolarHBondContact O-N 3.48Å; V162-T165 PolarHBondContact O-OG1 3.33Å; T165-C168 PolarHBondContact O-N 2.88Å; T165-A169 WeakPolarHBondContact O-CB 3.18Å; T165-A169 PolarHBondContact O-N 2.78Å |
| 166 | V | 66.8 | Low | 66 | Low | 91 Ų | 91 | 78.3 Ų | 78.3 | 55% | 0.552 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -69 | -41.7 | -179.1 | 175.6 | 0 | 0 | 0 | 0 | 111.2 | V162 S170 | V162-V166 HydrophobicContact CG1-CG2 4.24Å; V162-V166 VanDerWaalsContact O-CB 3.25Å; V162-V166 WeakPolarHBondContact O-CB 3.47Å; V162-V166 WeakPolarHBondContact O-CG2 3.46Å; V162-V166 PolarHBondContact O-N 3.32Å; V166-S170 VanDerWaalsContact O-CB 3.26Å; V166-S170 WeakPolarHBondContact O-CB 3.22Å; V166-S170 PolarHBondContact O-N 2.94Å |
| 167 | S | 73 | Confident | 66.8 | Low | 54 Ų | 54 | 74.2 Ų | 74.2 | 38% | 0.378 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -65.2 | -41.1 | 175.5 | 63.2 | 0 | 0 | 0 | 0 | 111.6 | L163 G164 S170 V171 | L163-S167 WeakPolarHBondContact O-CB 3.44Å; L163-S167 PolarHBondContact O-N 3.47Å; L163-S167 PolarHBondContact O-OG 3.47Å; G164-S167 PolarHBondContact O-OG 3.17Å; G164-S167 VanDerWaalsContact O-OG 3.11Å; S167-S170 PolarHBondContact O-N 3.47Å; S167-V171 VanDerWaalsContact O-CG2 3.29Å; S167-V171 WeakPolarHBondContact O-CG2 3.5Å; S167-V171 PolarHBondContact O-N 3.36Å |
| 168 | C | 66.2 | Low | 67.5 | Low | 32 Ų | 32 | 73.2 Ų | 73.2 | 22% | 0.216 | 43% | 0.432 | C | S | . | . | H | α-helix | trans | -62.9 | -50.2 | 177 | -177.6 | 0 | 0 | 0 | 0 | 112 | F81 G164 T165 S170 V171 V172 | F81-C168 WeakPolarHBondContact CZ-SG 3.21Å; G164-C168 WeakPolarHBondContact O-CB 3.46Å; G164-C168 PolarHBondContact O-N 3.13Å; T165-C168 PolarHBondContact O-N 2.88Å; C168-S170 VanDerWaalsContact C-N 3.27Å; C168-S170 PolarHBondContact O-N 2.82Å; C168-V171 PolarHBondContact O-N 3.22Å; C168-V172 WeakPolarHBondContact O-CG2 3.44Å; C168-V172 PolarHBondContact O-N 3.49Å |
| 169 | A | 67.3 | Low | 68.2 | Low | 62 Ų | 62 | 72.4 Ų | 72.4 | 51% | 0.512 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -58.8 | -40.3 | 177 | 0 | 0 | 0 | 0 | 0 | 111.7 | T165 V172 F173 | T165-A169 WeakPolarHBondContact O-CB 3.18Å; T165-A169 PolarHBondContact O-N 2.78Å; A169-V172 PolarHBondContact O-N 3.49Å; A169-F173 WeakPolarHBondContact O-CB 3.21Å; A169-F173 PolarHBondContact O-N 3.36Å |
| 170 | S | 72.1 | Confident | 68.9 | Low | 60 Ų | 60 | 73.4 Ų | 73.4 | 42% | 0.42 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -63.1 | -45 | 176 | -177.8 | 0 | 0 | 0 | 0 | 112.5 | V166 S167 C168 V172 F173 L174 | V166-S170 VanDerWaalsContact O-CB 3.26Å; V166-S170 WeakPolarHBondContact O-CB 3.22Å; V166-S170 PolarHBondContact O-N 2.94Å; S167-S170 PolarHBondContact O-N 3.47Å; C168-S170 VanDerWaalsContact C-N 3.27Å; C168-S170 PolarHBondContact O-N 2.82Å; S170-V172 PolarHBondContact O-N 3.42Å; S170-F173 PolarHBondContact O-N 3.39Å; S170-L174 WeakPolarHBondContact O-CB 3.16Å; S170-L174 WeakPolarHBondContact O-CG 3.32Å; S170-L174 PolarHBondContact O-N 3.37Å |
| 171 | V | 72.8 | Confident | 69.3 | Low | 68 Ų | 68 | 71.7 Ų | 71.7 | 41% | 0.412 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -64.2 | -42.6 | 178.5 | 170.8 | 0 | 0 | 0 | 0 | 111.4 | S167 C168 F173 L174 L175 | S167-V171 VanDerWaalsContact O-CG2 3.29Å; S167-V171 WeakPolarHBondContact O-CG2 3.5Å; S167-V171 PolarHBondContact O-N 3.36Å; C168-V171 PolarHBondContact O-N 3.22Å; V171-F173 VanDerWaalsContact C-N 3.34Å; V171-F173 PolarHBondContact O-N 3.46Å; V171-L174 PolarHBondContact O-N 3.4Å; V171-L175 HydrophobicContact CG1-CD1 3.85Å; V171-L175 HydrophobicContact CG1-CG 4.43Å; V171-L175 WeakPolarHBondContact O-CB 3.36Å; V171-L175 VanDerWaalsContact O-CG 3.31Å; V171-L175 WeakPolarHBondContact O-CG 3.43Å; V171-L175 PolarHBondContact O-N 3.06Å |
| 172 | V | 72.9 | Confident | 69.6 | Low | 53 Ų | 53 | 73.7 Ų | 73.7 | 32% | 0.321 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -59 | -48.2 | 174.1 | 175.9 | 0 | 0 | 0 | 0 | 110.6 | F77 C168 A169 S170 L174 L175 S176 | F77-V172 HydrophobicContact CD2-CG2 3.99Å; F77-V172 HydrophobicContact CE1-CG2 4.44Å; F77-V172 HydrophobicContact CE2-CB 4.46Å; F77-V172 HydrophobicContact CE2-CG2 3.06Å; F77-V172 HydrophobicContact CZ-CG2 3.29Å; C168-V172 WeakPolarHBondContact O-CG2 3.44Å; C168-V172 PolarHBondContact O-N 3.49Å; A169-V172 PolarHBondContact O-N 3.49Å; S170-V172 PolarHBondContact O-N 3.42Å; V172-L174 PolarHBondContact O-N 2.98Å; V172-L175 PolarHBondContact O-N 3.05Å; V172-S176 WeakPolarHBondContact O-CB 3.33Å; V172-S176 PolarHBondContact O-N 3.39Å; V172-S176 PolarHBondContact O-OG 3.45Å |
| 173 | F | 68.6 | Low | 69.6 | Low | 143 Ų | 143 | 73.1 Ų | 73.1 | 63% | 0.627 | 41% | 0.414 | S | S | * | . | H | α-helix | trans | -60.9 | -47.3 | -178.8 | -176.1 | -101.8 | 0 | 0 | 0 | 111.4 | A169 S170 V171 S176 A177 | A169-F173 WeakPolarHBondContact O-CB 3.21Å; A169-F173 PolarHBondContact O-N 3.36Å; S170-F173 PolarHBondContact O-N 3.39Å; V171-F173 VanDerWaalsContact C-N 3.34Å; V171-F173 PolarHBondContact O-N 3.46Å; F173-S176 PolarHBondContact O-N 3.16Å; F173-S176 PolarHBondContact O-OG 3.16Å; F173-A177 WeakPolarHBondContact O-CB 3.17Å; F173-A177 PolarHBondContact O-N 2.89Å |
| 174 | L | 71.4 | Confident | 69.4 | Low | 95 Ų | 95 | 69.5 Ų | 69.5 | 50% | 0.497 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -63 | -44.2 | 178 | -71.6 | 172.5 | 0 | 0 | 0 | 112.5 | S170 V171 V172 S176 A177 I178 | S170-L174 WeakPolarHBondContact O-CB 3.16Å; S170-L174 WeakPolarHBondContact O-CG 3.32Å; S170-L174 PolarHBondContact O-N 3.37Å; V171-L174 PolarHBondContact O-N 3.4Å; V172-L174 PolarHBondContact O-N 2.98Å; L174-S176 VanDerWaalsContact C-N 3.33Å; L174-S176 PolarHBondContact O-N 3.18Å; L174-A177 PolarHBondContact O-N 2.79Å; L174-I178 WeakPolarHBondContact O-CB 3.34Å; L174-I178 WeakPolarHBondContact O-CD1 3.36Å; L174-I178 WeakPolarHBondContact O-CG1 2.93Å; L174-I178 PolarHBondContact O-N 3.31Å |
| 175 | L | 67.7 | Low | 69.5 | Low | 56 Ų | 56 | 73.6 Ų | 73.6 | 29% | 0.293 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -63.1 | -41.3 | 176.9 | -73.9 | 171 | 0 | 0 | 0 | 111.6 | V171 V172 I178 I179 | V171-L175 HydrophobicContact CG1-CD1 3.85Å; V171-L175 HydrophobicContact CG1-CG 4.43Å; V171-L175 WeakPolarHBondContact O-CB 3.36Å; V171-L175 VanDerWaalsContact O-CG 3.31Å; V171-L175 WeakPolarHBondContact O-CG 3.43Å; V171-L175 PolarHBondContact O-N 3.06Å; V172-L175 PolarHBondContact O-N 3.05Å; L175-I178 PolarHBondContact O-N 3Å; L175-I179 WeakPolarHBondContact O-CD1 3.36Å; L175-I179 WeakPolarHBondContact O-CG1 3.44Å; L175-I179 PolarHBondContact O-N 3.06Å |
| 176 | S | 63.7 | Low | 69.4 | Low | 30 Ų | 30 | 77.8 Ų | 77.8 | 21% | 0.21 | 43% | 0.432 | C | S | . | . | H | α-helix | trans | -62.5 | -45.7 | 175.8 | 75.9 | 0 | 0 | 0 | 0 | 112.1 | V172 F173 L174 I178 I179 I180 | V172-S176 WeakPolarHBondContact O-CB 3.33Å; V172-S176 PolarHBondContact O-N 3.39Å; V172-S176 PolarHBondContact O-OG 3.45Å; F173-S176 PolarHBondContact O-N 3.16Å; F173-S176 PolarHBondContact O-OG 3.16Å; L174-S176 VanDerWaalsContact C-N 3.33Å; L174-S176 PolarHBondContact O-N 3.18Å; S176-I178 PolarHBondContact O-N 2.81Å; S176-I179 PolarHBondContact O-N 3.29Å; S176-I180 WeakPolarHBondContact O-CB 3.16Å; S176-I180 WeakPolarHBondContact O-CD1 3.42Å; S176-I180 WeakPolarHBondContact O-CG1 3.4Å; S176-I180 PolarHBondContact O-N 3.49Å |
| 177 | A | 69.2 | Low | 68.8 | Low | 36 Ų | 36 | 81.4 Ų | 81.4 | 30% | 0.298 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -60.9 | -45.6 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.2 | F173 L174 I179 I180 C181 | F173-A177 WeakPolarHBondContact O-CB 3.17Å; F173-A177 PolarHBondContact O-N 2.89Å; L174-A177 PolarHBondContact O-N 2.79Å; A177-I179 PolarHBondContact O-N 3.23Å; A177-I180 PolarHBondContact O-N 3.19Å; A177-C181 WeakPolarHBondContact O-CB 3.42Å; A177-C181 PolarHBondContact O-N 3.23Å; A177-C181 PolarHBondContact O-SG 2.84Å |
| 178 | I | 72.1 | Confident | 67.7 | Low | 108 Ų | 108 | 86.6 Ų | 86.6 | 55% | 0.554 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -59.9 | -44.8 | 178.2 | -70.9 | 163.9 | 0 | 0 | 0 | 111.1 | L174 L175 S176 C181 Y182 | L174-I178 WeakPolarHBondContact O-CB 3.34Å; L174-I178 WeakPolarHBondContact O-CD1 3.36Å; L174-I178 WeakPolarHBondContact O-CG1 2.93Å; L174-I178 PolarHBondContact O-N 3.31Å; L175-I178 PolarHBondContact O-N 3Å; S176-I178 PolarHBondContact O-N 2.81Å; I178-C181 PolarHBondContact O-N 3.24Å; I178-Y182 WeakPolarHBondContact O-CB 3.35Å; I178-Y182 PolarHBondContact O-N 2.82Å |
| 179 | I | 73.9 | Confident | 66.7 | Low | 64 Ų | 64 | 89.5 Ų | 89.5 | 33% | 0.328 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -67.7 | -43.6 | -179.3 | -70.9 | 163.6 | 0 | 0 | 0 | 111 | F73 L175 S176 A177 Y182 K183 | F73-I179 HydrophobicContact CD1-CD1 4.14Å; F73-I179 HydrophobicContact CE1-CD1 3.38Å; F73-I179 HydrophobicContact CE1-CG1 4.47Å; F73-I179 HydrophobicContact CE2-CB 4.47Å; F73-I179 HydrophobicContact CE2-CD1 4.06Å; F73-I179 HydrophobicContact CE2-CG2 4.02Å; F73-I179 HydrophobicContact CZ-CB 3.76Å; F73-I179 HydrophobicContact CZ-CD1 3.33Å; F73-I179 HydrophobicContact CZ-CG1 4.12Å; F73-I179 HydrophobicContact CZ-CG2 3.81Å; L175-I179 WeakPolarHBondContact O-CD1 3.36Å; L175-I179 WeakPolarHBondContact O-CG1 3.44Å; L175-I179 PolarHBondContact O-N 3.06Å; S176-I179 PolarHBondContact O-N 3.29Å; A177-I179 PolarHBondContact O-N 3.23Å; I179-Y182 PolarHBondContact O-N 3.47Å; I179-K183 WeakPolarHBondContact O-CG 3.39Å; I179-K183 PolarHBondContact O-N 2.87Å |
| 180 | I | 75.9 | Confident | 65.9 | Low | 113 Ų | 113 | 94.3 Ų | 94.3 | 58% | 0.579 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -62.5 | -46.7 | 176.6 | -66.7 | 165.7 | 0 | 0 | 0 | 110.1 | S176 A177 Y182 K183 A184 | S176-I180 WeakPolarHBondContact O-CB 3.16Å; S176-I180 WeakPolarHBondContact O-CD1 3.42Å; S176-I180 WeakPolarHBondContact O-CG1 3.4Å; S176-I180 PolarHBondContact O-N 3.49Å; A177-I180 PolarHBondContact O-N 3.19Å; I180-Y182 PolarHBondContact O-N 2.83Å; I180-K183 PolarHBondContact O-N 2.91Å; I180-A184 WeakPolarHBondContact O-CB 3.45Å; I180-A184 PolarHBondContact O-N 3.27Å |
| 181 | C | 69.1 | Low | 64.9 | Low | 70 Ų | 70 | 101.4 Ų | 101.4 | 47% | 0.473 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -61.6 | -43.4 | 176.3 | -72.1 | 0 | 0 | 0 | 0 | 111.7 | A177 I178 K183 A184 I185 | A177-C181 WeakPolarHBondContact O-CB 3.42Å; A177-C181 PolarHBondContact O-N 3.23Å; A177-C181 PolarHBondContact O-SG 2.84Å; I178-C181 PolarHBondContact O-N 3.24Å; C181-K183 PolarHBondContact O-N 3.43Å; C181-A184 PolarHBondContact O-N 3.39Å; C181-I185 WeakPolarHBondContact O-CB 3.49Å; C181-I185 WeakPolarHBondContact O-CD1 3.43Å; C181-I185 WeakPolarHBondContact O-CG1 3.45Å; C181-I185 PolarHBondContact O-N 2.95Å |
| 182 | Y | 69.8 | Low | 63.9 | Low | 138 Ų | 138 | 104.3 Ų | 104.3 | 54% | 0.541 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -63.1 | -42.8 | 176.9 | 179 | -101.5 | 0 | 0 | 0 | 111.6 | I178 I179 I180 I185 K186 | I178-Y182 WeakPolarHBondContact O-CB 3.35Å; I178-Y182 PolarHBondContact O-N 2.82Å; I179-Y182 PolarHBondContact O-N 3.47Å; I180-Y182 PolarHBondContact O-N 2.83Å; Y182-I185 PolarHBondContact O-N 3.18Å; Y182-K186 HydrophobicContact CD1-CG 4.34Å; Y182-K186 HydrophobicContact CD2-CG 4.34Å; Y182-K186 HydrophobicContact CE1-CG 3.96Å; Y182-K186 HydrophobicContact CE2-CD 4.49Å; Y182-K186 HydrophobicContact CE2-CG 3.95Å; Y182-K186 VanDerWaalsContact O-CB 3.31Å; Y182-K186 WeakPolarHBondContact O-CB 3.42Å; Y182-K186 WeakPolarHBondContact O-CG 3.22Å; Y182-K186 PolarHBondContact O-N 3.31Å; Y182-K186 VanDerWaalsContact OH-CE 3.28Å; Y182-K186 WeakPolarHBondContact OH-CE 3.09Å |
| 183 | K | 68.1 | Low | 63.1 | Low | 61 Ų | 61 | 111.3 Ų | 111.3 | 27% | 0.265 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -66.8 | -36.1 | 174.1 | -72.2 | -172.3 | 83.7 | 173.2 | 0 | 111.7 | D69 I179 I180 C181 K186 R187 | D69-K183 IonicContact OD1-NZ 2.58Å; D69-K183 PolarHBondContact OD1-NZ 2.98Å; D69-K183 IonicContact OD2-NZ 2.73Å; D69-K183 PolarHBondContact OD2-NZ 3.17Å; I179-K183 WeakPolarHBondContact O-CG 3.39Å; I179-K183 PolarHBondContact O-N 2.87Å; I180-K183 PolarHBondContact O-N 2.91Å; C181-K183 PolarHBondContact O-N 3.43Å; K183-K186 PolarHBondContact O-N 2.83Å; K183-R187 WeakPolarHBondContact O-CB 3.17Å; K183-R187 WeakPolarHBondContact O-CG 3.31Å; K183-R187 PolarHBondContact O-N 3.07Å |
| 184 | A | 65.9 | Low | 62.4 | Low | 52 Ų | 52 | 111.4 Ų | 111.4 | 43% | 0.43 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -65.7 | -40.8 | 175 | 0 | 0 | 0 | 0 | 0 | 111.9 | I180 C181 K188 | I180-A184 WeakPolarHBondContact O-CB 3.45Å; I180-A184 PolarHBondContact O-N 3.27Å; C181-A184 PolarHBondContact O-N 3.39Å; A184-K188 WeakPolarHBondContact O-CB 3.13Å; A184-K188 WeakPolarHBondContact O-CG 3.28Å; A184-K188 PolarHBondContact O-N 3.1Å |
| 185 | I | 70.4 | Confident | 61.2 | Low | 108 Ų | 108 | 112.9 Ų | 112.9 | 55% | 0.554 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -73.9 | -31.6 | 177.4 | -64 | 162.5 | 0 | 0 | 0 | 111.8 | C181 Y182 | C181-I185 WeakPolarHBondContact O-CB 3.49Å; C181-I185 WeakPolarHBondContact O-CD1 3.43Å; C181-I185 WeakPolarHBondContact O-CG1 3.45Å; C181-I185 PolarHBondContact O-N 2.95Å; Y182-I185 PolarHBondContact O-N 3.18Å |
| 186 | K | 60.1 | Low | 60.6 | Low | 140 Ų | 140 | 113.8 Ų | 113.8 | 61% | 0.609 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -83 | -28.1 | 176 | -75.1 | -77 | -175.6 | 174.3 | 0 | 113.2 | Y182 K183 | Y182-K186 HydrophobicContact CD1-CG 4.34Å; Y182-K186 HydrophobicContact CD2-CG 4.34Å; Y182-K186 HydrophobicContact CE1-CG 3.96Å; Y182-K186 HydrophobicContact CE2-CD 4.49Å; Y182-K186 HydrophobicContact CE2-CG 3.95Å; Y182-K186 VanDerWaalsContact O-CB 3.31Å; Y182-K186 WeakPolarHBondContact O-CB 3.42Å; Y182-K186 WeakPolarHBondContact O-CG 3.22Å; Y182-K186 PolarHBondContact O-N 3.31Å; Y182-K186 VanDerWaalsContact OH-CE 3.28Å; Y182-K186 WeakPolarHBondContact OH-CE 3.09Å; K183-K186 PolarHBondContact O-N 2.83Å |
| 187 | R | 55.1 | Low | 60 | Low | 167 Ų | 167 | 118.3 Ų | 118.3 | 63% | 0.63 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -83.3 | -20.5 | 173.3 | -69.8 | -165 | -163 | -151.1 | 13.6 | 113.2 | K183 P189 | K183-R187 WeakPolarHBondContact O-CB 3.17Å; K183-R187 WeakPolarHBondContact O-CG 3.31Å; K183-R187 PolarHBondContact O-N 3.07Å; R187-P189 WeakPolarHBondContact O-CD 3.08Å |
| 188 | K | 49 | Very low | 59.2 | Low | 162 Ų | 162 | 118.4 Ų | 118.4 | 70% | 0.704 | 60% | 0.598 | S | S | * | * | S | Bend | trans | -85.6 | 93.1 | 156.4 | -68.8 | -163.4 | -179.3 | -161.1 | 0 | 106.8 | A184 L190 | A184-K188 WeakPolarHBondContact O-CB 3.13Å; A184-K188 WeakPolarHBondContact O-CG 3.28Å; A184-K188 PolarHBondContact O-N 3.1Å; K188-L190 PolarHBondContact O-N 2.73Å |
| 189 | P | 44.8 | Very low | 58.4 | Low | 94 Ų | 94 | 124.8 Ų | 124.8 | 61% | 0.61 | 62% | 0.615 | S | S | * | * | trans | -50.1 | 131.3 | 167.9 | 24.4 | -32.3 | 0 | 0 | 0 | 105.9 | R187 R191 | R187-P189 WeakPolarHBondContact O-CD 3.08Å; P189-R191 HydrophobicContact CG-CG 4.46Å; P189-R191 PolarHBondContact O-N 2.58Å | ||
| 190 | L | 51 | Low | 57.5 | Low | 162 Ų | 162 | 124.7 Ų | 124.7 | 85% | 0.848 | 63% | 0.63 | S | S | * | * | trans | -61.8 | 66.1 | 167.7 | -129 | 120.9 | 0 | 0 | 0 | 106.5 | K188 K192 | K188-L190 PolarHBondContact O-N 2.73Å; L190-K192 PolarHBondContact O-N 3.19Å | ||
| 191 | R | 51.8 | Low | 56.3 | Low | 210 Ų | 210 | 126.5 Ų | 126.5 | 79% | 0.792 | 64% | 0.637 | S | S | * | * | trans | -70.1 | 83.9 | 160.8 | -86.2 | -161.3 | 87.8 | 88.9 | -0.6 | 102.8 | P189 E193 | P189-R191 HydrophobicContact CG-CG 4.46Å; P189-R191 PolarHBondContact O-N 2.58Å; R191-E193 VanDerWaalsContact C-N 3.29Å; R191-E193 PolarHBondContact O-N 2.84Å | ||
| 192 | K | 51 | Low | 55.6 | Low | 129 Ų | 129 | 130.3 Ų | 130.3 | 56% | 0.561 | 64% | 0.642 | S | S | * | * | trans | 12.8 | 79.9 | 136.9 | -163.1 | 171.9 | -175.4 | 168.3 | 0 | 111.5 | L190 E194 | L190-K192 PolarHBondContact O-N 3.19Å; K192-E194 HydrophobicContact CD-CG 4.36Å; K192-E194 WeakPolarHBondContact CE-OE1 3.4Å; K192-E194 HydrophobicContact CG-CG 3.46Å; K192-E194 VanDerWaalsContact CG-CG 3.46Å; K192-E194 PolarHBondContact O-N 3.04Å | ||
| 193 | E | 56.5 | Low | 54.7 | Low | 200 Ų | 200 | 128.1 Ų | 128.1 | 94% | 0.935 | 65% | 0.652 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.3 | 30.2 | 170.3 | -105.1 | -96.8 | 150.2 | 0 | 0 | 109.9 | R191 | R191-E193 VanDerWaalsContact C-N 3.29Å; R191-E193 PolarHBondContact O-N 2.84Å |
| 194 | E | 54.3 | Low | 54 | Low | 145 Ų | 145 | 133.2 Ų | 133.2 | 68% | 0.678 | 68% | 0.679 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -138.2 | 18.8 | -173.3 | 65.7 | 167.3 | -163.5 | 0 | 0 | 114.1 | K192 | K192-E194 HydrophobicContact CD-CG 4.36Å; K192-E194 WeakPolarHBondContact CE-OE1 3.4Å; K192-E194 HydrophobicContact CG-CG 3.46Å; K192-E194 VanDerWaalsContact CG-CG 3.46Å; K192-E194 PolarHBondContact O-N 3.04Å |
| 195 | N | 45.1 | Very low | 53.3 | Low | 125 Ų | 125 | 135.1 Ų | 135.1 | 67% | 0.668 | 69% | 0.69 | S | S | * | * | trans | -134.7 | 82.5 | 158.2 | -93.4 | -27.1 | 0 | 0 | 0 | 108.7 | T197 | N195-T197 PolarHBondContact O-N 2.61Š| ||
| 196 | G | 56.6 | Low | 52.4 | Low | 75 Ų | 75 | 137.7 Ų | 137.7 | 77% | 0.773 | 70% | 0.702 | S | S | * | * | trans | -54.2 | 117.5 | 162.6 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 197 | T | 50.2 | Low | 52.1 | Low | 125 Ų | 125 | 142.2 Ų | 142.2 | 77% | 0.767 | 72% | 0.716 | S | S | * | * | trans | -167.6 | 109.7 | 140.6 | 2.9 | 0 | 0 | 0 | 0 | 107.6 | N195 | N195-T197 PolarHBondContact O-N 2.61Š| ||
| 198 | S | 53.3 | Low | 52 | Low | 38 Ų | 38 | 140.9 Ų | 140.9 | 27% | 0.266 | 72% | 0.721 | S | S | . | * | trans | 48 | 94.8 | 134.1 | -165.2 | 0 | 0 | 0 | 0 | 115.4 | Y202 | S198-Y202 WeakPolarHBondContact CB-OH 3Å; S198-Y202 WeakPolarHBondContact O-CE2 3.11Å; S198-Y202 VanDerWaalsContact O-CZ 3.29Å; S198-Y202 PolarHBondContact O-OH 3.08Å; S198-Y202 WeakPolarHBondContact OG-CE1 3.2Å; S198-Y202 PolarHBondContact OG-OH 2.98Å; S198-Y202 VanDerWaalsContact OG-OH 3.08Å | ||
| 199 | R | 54.7 | Low | 52.1 | Low | 242 Ų | 242 | 142.7 Ų | 142.7 | 91% | 0.913 | 73% | 0.729 | S | S | * | * | S | Bend | trans | -127.6 | 8.5 | 157.5 | -137.7 | -177.2 | 84.6 | 161.7 | 4.5 | 113.1 | ||
| 200 | G | 54.7 | Low | 52.5 | Low | 62 Ų | 62 | 148.3 Ų | 148.3 | 64% | 0.639 | 74% | 0.744 | S | S | * | * | S | Bend | trans | -109.7 | -16.7 | 177.9 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||
| 201 | E | 51.9 | Low | 52.6 | Low | 152 Ų | 152 | 145 Ų | 145 | 71% | 0.71 | 74% | 0.74 | S | S | * | * | S | Bend | trans | -96 | -9.2 | -169.2 | -73.1 | 175.4 | 144.4 | 0 | 0 | 115 | ||
| 202 | Y | 53.3 | Low | 52.9 | Low | 150 Ų | 150 | 144 Ų | 144 | 59% | 0.588 | 75% | 0.747 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.6 | 0.6 | 179.6 | -25.2 | -73.9 | 0 | 0 | 0 | 114.6 | S198 M204 | S198-Y202 WeakPolarHBondContact CB-OH 3Å; S198-Y202 WeakPolarHBondContact O-CE2 3.11Å; S198-Y202 VanDerWaalsContact O-CZ 3.29Å; S198-Y202 PolarHBondContact O-OH 3.08Å; S198-Y202 WeakPolarHBondContact OG-CE1 3.2Å; S198-Y202 PolarHBondContact OG-OH 2.98Å; S198-Y202 VanDerWaalsContact OG-OH 3.08Å; Y202-M204 VanDerWaalsContact C-N 3.29Å |
| 203 | A | 51.9 | Low | 52.7 | Low | 92 Ų | 92 | 140.9 Ų | 140.9 | 76% | 0.76 | 75% | 0.751 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.7 | -7.9 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||
| 204 | M | 52.3 | Low | 52.6 | Low | 167 Ų | 167 | 137.1 Ų | 137.1 | 82% | 0.823 | 74% | 0.741 | S | S | * | * | S | Bend | trans | -116.7 | -2 | -173.9 | -122.4 | -176.1 | -70.3 | 0 | 0 | 115.9 | Y202 | Y202-M204 VanDerWaalsContact C-N 3.29Š|
| 205 | S | 52.3 | Low | 52.7 | Low | 93 Ų | 93 | 138 Ų | 138 | 65% | 0.65 | 75% | 0.751 | S | S | * | * | S | Bend | trans | -90.2 | -15.9 | 176.5 | 85.3 | 0 | 0 | 0 | 0 | 114.4 | R207 | S205-R207 PolarHBondContact O-N 3.49Š|
| 206 | I | 51.4 | Low | 53.2 | Low | 161 Ų | 161 | 137.6 Ų | 137.6 | 83% | 0.826 | 75% | 0.749 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.5 | -4.8 | -173.9 | -131.3 | 164.8 | 0 | 0 | 0 | 114.5 | ||
| 207 | R | 53.3 | Low | 52.7 | Low | 235 Ų | 235 | 140 Ų | 140 | 89% | 0.887 | 75% | 0.748 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.9 | -9 | -179.1 | -159.8 | 171.3 | -175.3 | 174.9 | 1.7 | 114.4 | S205 | S205-R207 PolarHBondContact O-N 3.49Š|
| 208 | N | 52 | Low | 52.3 | Low | 140 Ų | 140 | 140.3 Ų | 140.3 | 75% | 0.749 | 75% | 0.75 | S | S | * | * | S | Bend | trans | -113.2 | 48.4 | -176 | -154 | -34.7 | 0 | 0 | 0 | 113.3 | ||
| 209 | K | 51.2 | Low | 51.6 | Low | 200 Ų | 200 | 148.6 Ų | 148.6 | 87% | 0.87 | 80% | 0.799 | S | S | * | * | S | Bend | trans | -139.5 | 17.8 | 167.5 | -82.1 | -161.8 | 178.6 | -175 | 0 | 114.2 | ||
| 210 | K | 53.2 | Low | 51.4 | Low | 211 Ų | 211 | 144 Ų | 144 | 92% | 0.917 | 79% | 0.793 | S | S | * | * | S | Bend | trans | -126.2 | 24.1 | 177.8 | -93.3 | -169.9 | 176.5 | -176.8 | 0 | 114.9 | ||
| 211 | A | 53.4 | Low | 51.2 | Low | 92 Ų | 92 | 148.3 Ų | 148.3 | 76% | 0.76 | 80% | 0.801 | S | S | * | * | S | Bend | trans | -134.3 | 33.1 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||
| 212 | M | 59.1 | Low | 51.2 | Low | 191 Ų | 191 | 148.1 Ų | 148.1 | 94% | 0.941 | 81% | 0.806 | S | S | * | * | trans | -137.1 | 80.9 | 171.9 | -150 | 83.3 | 144.4 | 0 | 0 | 108.7 | ||||
| 213 | G | 47 | Very low | 51.1 | Low | 63 Ų | 63 | 147.9 Ų | 147.9 | 65% | 0.649 | 82% | 0.819 | S | S | * | * | trans | -156 | 67.1 | 176.7 | 0 | 0 | 0 | 0 | 0 | 107 | N215 | G213-N215 PolarHBondContact O-N 3.38Š| ||
| 214 | T | 53.6 | Low | 51 | Low | 120 Ų | 120 | 151.4 Ų | 151.4 | 74% | 0.736 | 82% | 0.823 | S | S | * | * | trans | -16 | 111.9 | 168.1 | 40.8 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 215 | N | 56.6 | Low | 50.9 | Low | 164 Ų | 164 | 150.4 Ų | 150.4 | 88% | 0.877 | 82% | 0.823 | S | S | * | * | trans | -80.5 | 111.2 | 150.2 | -43.1 | -59.6 | 0 | 0 | 0 | 107.1 | G213 | G213-N215 PolarHBondContact O-N 3.38Š| ||
| 216 | N | 55.6 | Low | 50.8 | Low | 117 Ų | 117 | 154.5 Ų | 154.5 | 63% | 0.626 | 84% | 0.835 | S | S | * | * | trans | -155 | 86 | 161 | 52.9 | -21.2 | 0 | 0 | 0 | 107.8 | ||||
| 217 | T | 45.3 | Very low | 50.8 | Low | 124 Ų | 124 | 154 Ų | 154 | 76% | 0.761 | 84% | 0.836 | S | S | * | * | 68.8 | 117.4 | 95.3 | 56.8 | 0 | 0 | 0 | 0 | 115.5 | |||||
| 218 | V | 42.2 | Very low | 50.6 | Low | 133 Ų | 133 | 147.3 Ų | 147.3 | 81% | 0.806 | 83% | 0.831 | S | S | * | * | trans | 71.6 | 105.2 | 130.2 | 178.9 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 219 | V | 37.4 | Very low | 50.4 | Low | 212 Ų | 212 | 147.9 Ų | 147.9 | 100% | 1.285 | 84% | 0.839 | S | S | * | * | -178.2 | 0 | 110.4 | 158.2 | 0 | 0 | 0 | 0 | 108.2 |
Retrieved 219 of 219 residues in 226 ms
(Link to these results)