| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 34.2 | Very low | 30.3 | Very low | 254 Ų | 254 | 142.2 Ų | 142.2 | 100% | 1.251 | 83% | 0.829 | S | S | * | * | 0 | 113.3 | 0 | -72.8 | -173.1 | -178.8 | 0 | 0 | 108.2 | |||||
| 2 | A | 31.2 | Very low | 30.3 | Very low | 95 Ų | 95 | 142 Ų | 142 | 79% | 0.785 | 83% | 0.831 | S | S | * | * | trans | -132.2 | 110.7 | 172.6 | 0 | 0 | 0 | 0 | 0 | 107.4 | V4 | A2-V4 PolarHBondContact O-N 2.84Š| ||
| 3 | A | 31.2 | Very low | 30 | Very low | 101 Ų | 101 | 136.5 Ų | 136.5 | 84% | 0.835 | 82% | 0.823 | S | S | * | * | trans | -79.6 | 108.6 | 175.5 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 4 | V | 29.9 | Very low | 29.8 | Very low | 130 Ų | 130 | 134.5 Ų | 134.5 | 79% | 0.788 | 82% | 0.818 | S | S | * | * | trans | -83.9 | 107.8 | 163.7 | 174.1 | 0 | 0 | 0 | 0 | 106.1 | A2 E6 | A2-V4 PolarHBondContact O-N 2.84Å; V4-E6 PolarHBondContact O-N 3.07Å | ||
| 5 | V | 32.8 | Very low | 29.9 | Very low | 119 Ų | 119 | 135.4 Ų | 135.4 | 72% | 0.721 | 82% | 0.815 | S | S | * | * | trans | -82.7 | 99 | 168.8 | 175.6 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 6 | E | 31.2 | Very low | 30 | Very low | 161 Ų | 161 | 136.1 Ų | 136.1 | 75% | 0.752 | 81% | 0.813 | S | S | * | * | trans | -67.4 | 135.4 | 158.3 | -99.8 | -168.4 | 119 | 0 | 0 | 109.2 | V4 | V4-E6 PolarHBondContact O-N 3.07Š| ||
| 7 | R | 28.4 | Very low | 31.3 | Very low | 237 Ų | 237 | 133.9 Ų | 133.9 | 89% | 0.894 | 80% | 0.803 | S | S | * | * | trans | -125.7 | 110.4 | 157.1 | -95.9 | -170.2 | 169.9 | 124.4 | -2.3 | 107.8 | ||||
| 8 | V | 30.5 | Very low | 31 | Very low | 113 Ų | 113 | 135.3 Ų | 135.3 | 69% | 0.685 | 81% | 0.806 | S | S | * | * | trans | -128.5 | 121.3 | 164.3 | 172.5 | 0 | 0 | 0 | 0 | 106.4 | ||||
| 9 | D | 28.2 | Very low | 30.9 | Very low | 163 Ų | 163 | 133.6 Ų | 133.6 | 87% | 0.872 | 81% | 0.808 | S | S | * | * | trans | 172.1 | 136.5 | 140.3 | -95.3 | -38.8 | 0 | 0 | 0 | 105.5 | ||||
| 10 | G | 27.5 | Very low | 31 | Very low | 69 Ų | 69 | 133.9 Ų | 133.9 | 71% | 0.711 | 81% | 0.81 | S | S | * | * | cis | 135.8 | 117.4 | 26.6 | 0 | 0 | 0 | 0 | 0 | 105.8 | ||||
| 11 | C | 28.2 | Very low | 30.9 | Very low | 122 Ų | 122 | 133.1 Ų | 133.1 | 82% | 0.824 | 81% | 0.81 | S | S | * | * | trans | -51.6 | 151.2 | -173.7 | -171.2 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 12 | V | 30.2 | Very low | 30.8 | Very low | 140 Ų | 140 | 127.4 Ų | 127.4 | 85% | 0.848 | 78% | 0.784 | S | S | * | * | 174.8 | 133.5 | 116 | 177.5 | 0 | 0 | 0 | 0 | 109 | |||||
| 13 | G | 27 | Very low | 30.8 | Very low | 71 Ų | 71 | 133.6 Ų | 133.6 | 73% | 0.732 | 79% | 0.787 | S | S | * | * | trans | -96.2 | -174.8 | -171 | 0 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 14 | S | 27.4 | Very low | 30.6 | Very low | 108 Ų | 108 | 137.5 Ų | 137.5 | 76% | 0.755 | 79% | 0.788 | S | S | * | * | trans | 170.4 | 124.6 | 142.2 | -165.5 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 15 | L | 30.6 | Very low | 30.9 | Very low | 148 Ų | 148 | 138 Ų | 138 | 78% | 0.775 | 79% | 0.792 | S | S | * | * | trans | 55.5 | 104.9 | 141.2 | -56.8 | 171.3 | 0 | 0 | 0 | 123.6 | ||||
| 16 | D | 32.1 | Very low | 30.5 | Very low | 147 Ų | 147 | 136.9 Ų | 136.9 | 79% | 0.786 | 79% | 0.79 | S | S | * | * | 69.1 | 165.2 | 119.7 | -103 | -40.2 | 0 | 0 | 0 | 123.1 | |||||
| 17 | P | 51.1 | Low | 30.2 | Very low | 98 Ų | 98 | 134.3 Ų | 134.3 | 64% | 0.636 | 79% | 0.789 | S | S | * | * | -124.7 | -164.4 | -109 | 44.7 | -28.1 | 0 | 0 | 0 | 115.2 | |||||
| 18 | D | 26.8 | Very low | 30.2 | Very low | 160 Ų | 160 | 131.2 Ų | 131.2 | 86% | 0.856 | 79% | 0.789 | S | S | * | * | trans | 93.5 | 112 | 171.8 | -70.8 | -31.2 | 0 | 0 | 0 | 119.2 | ||||
| 19 | A | 29.3 | Very low | 30.1 | Very low | 102 Ų | 102 | 134.7 Ų | 134.7 | 84% | 0.843 | 80% | 0.798 | S | S | * | * | 175.2 | 115.8 | 120.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | |||||
| 20 | V | 33 | Very low | 30.2 | Very low | 140 Ų | 140 | 135.6 Ų | 135.6 | 85% | 0.848 | 80% | 0.797 | S | S | * | * | trans | -78.6 | 126.9 | 165.6 | 176.1 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 21 | S | 28.4 | Very low | 30.6 | Very low | 117 Ų | 117 | 139.2 Ų | 139.2 | 82% | 0.818 | 80% | 0.796 | S | S | * | * | trans | -170.8 | 144.8 | 132 | -152.7 | 0 | 0 | 0 | 0 | 115 | ||||
| 22 | L | 32.5 | Very low | 31.2 | Very low | 135 Ų | 135 | 138.2 Ų | 138.2 | 71% | 0.707 | 79% | 0.788 | S | S | * | * | trans | -58.6 | 155.3 | -173.5 | -98.1 | 85.4 | 0 | 0 | 0 | 118.3 | ||||
| 23 | R | 29.6 | Very low | 31.9 | Very low | 224 Ų | 224 | 138.4 Ų | 138.4 | 85% | 0.845 | 78% | 0.779 | S | S | * | * | trans | 87.6 | 99.6 | 145 | -79.3 | -178.4 | -176.8 | -158.3 | 1 | 118.8 | ||||
| 24 | Q | 27.8 | Very low | 33.1 | Very low | 183 Ų | 183 | 142.2 Ų | 142.2 | 86% | 0.855 | 78% | 0.778 | S | S | * | * | -150.1 | 118.7 | 117.7 | -112.1 | 167.2 | 6 | 0 | 0 | 110.8 | S26 | Q24-S26 PolarHBondContact O-N 3.13Š| |||
| 25 | T | 35.3 | Very low | 34.1 | Very low | 142 Ų | 142 | 143.3 Ų | 143.3 | 87% | 0.871 | 78% | 0.775 | S | S | * | * | trans | -69 | 111.6 | 165.1 | 43.7 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 26 | S | 24.7 | Very low | 35.8 | Very low | 95 Ų | 95 | 139.6 Ų | 139.6 | 66% | 0.664 | 76% | 0.756 | S | S | * | * | trans | -157.9 | 127.6 | 164.8 | 44.5 | 0 | 0 | 0 | 0 | 111.4 | Q24 | Q24-S26 PolarHBondContact O-N 3.13Š| ||
| 27 | S | 25.3 | Very low | 37.8 | Very low | 107 Ų | 107 | 137.9 Ų | 137.9 | 75% | 0.748 | 75% | 0.753 | S | S | * | * | trans | 62.4 | 101.9 | 168.5 | 57.4 | 0 | 0 | 0 | 0 | 117.6 | Q29 | S27-Q29 PolarHBondContact O-N 3.02Š| ||
| 28 | L | 29 | Very low | 38.9 | Very low | 171 Ų | 171 | 136.6 Ų | 136.6 | 90% | 0.895 | 74% | 0.74 | S | S | * | * | trans | -39 | 106.3 | 139.3 | -66.3 | 174 | 0 | 0 | 0 | 108.5 | E30 | L28-E30 PolarHBondContact O-N 3.03Š| ||
| 29 | Q | 29 | Very low | 41.1 | Very low | 186 Ų | 186 | 130.6 Ų | 130.6 | 87% | 0.869 | 71% | 0.708 | S | S | * | * | trans | -68.3 | 96.8 | 159.5 | -99.4 | 176.4 | -35.7 | 0 | 0 | 105.7 | S27 Q31 | S27-Q29 PolarHBondContact O-N 3.02Å; Q29-Q31 PolarHBondContact O-N 3.5Å | ||
| 30 | E | 30.1 | Very low | 43.3 | Very low | 182 Ų | 182 | 128.7 Ų | 128.7 | 85% | 0.85 | 70% | 0.699 | S | S | * | * | trans | -43.2 | 100.3 | 151.6 | -90.1 | 175.2 | 114.9 | 0 | 0 | 107.2 | L28 P32 | L28-E30 PolarHBondContact O-N 3.03Å; E30-P32 WeakPolarHBondContact O-CD 3.29Å; E30-P32 VanDerWaalsContact O-N 3.14Å | ||
| 31 | Q | 34.6 | Very low | 45.7 | Very low | 146 Ų | 146 | 125.1 Ų | 125.1 | 68% | 0.682 | 67% | 0.674 | S | S | * | * | trans | -47.2 | 118.2 | 149.4 | -82.4 | -87.6 | -2.3 | 0 | 0 | 105 | Q29 H33 | Q29-Q31 PolarHBondContact O-N 3.5Å; Q31-H33 PolarHBondContact O-N 3.1Å; Q31-H33 PolarHBondContact O-ND1 3Å | ||
| 32 | P | 40.8 | Very low | 48.5 | Very low | 101 Ų | 101 | 123.9 Ų | 123.9 | 66% | 0.656 | 66% | 0.663 | S | S | * | * | trans | -63.9 | 99.1 | 165.2 | 28 | -27.8 | 0 | 0 | 0 | 103.5 | E30 Q34 | E30-P32 WeakPolarHBondContact O-CD 3.29Å; E30-P32 VanDerWaalsContact O-N 3.14Å; P32-Q34 PolarHBondContact O-N 2.95Å | ||
| 33 | H | 44.8 | Very low | 50.9 | Low | 144 Ų | 144 | 120.1 Ų | 120.1 | 67% | 0.667 | 64% | 0.644 | S | S | * | * | trans | -57.7 | 95 | 156.6 | -75.4 | 39.5 | 0 | 0 | 0 | 102.5 | Q31 N35 | Q31-H33 PolarHBondContact O-N 3.1Å; Q31-H33 PolarHBondContact O-ND1 3Å; H33-N35 WeakPolarHBondContact CB-ND2 3.23Å; H33-N35 PolarHBondContact O-N 3.46Å; H33-N35 PolarHBondContact O-ND2 3.46Å | ||
| 34 | Q | 52.1 | Low | 53.6 | Low | 151 Ų | 151 | 114.1 Ų | 114.1 | 71% | 0.706 | 63% | 0.631 | S | S | * | * | trans | -63 | 76.4 | 160 | -77.3 | -172.3 | 1.4 | 0 | 0 | 104.7 | P32 N36 | P32-Q34 PolarHBondContact O-N 2.95Å; Q34-N36 PolarHBondContact O-N 3.45Å | ||
| 35 | N | 49 | Very low | 56.5 | Low | 131 Ų | 131 | 107.1 Ų | 107.1 | 70% | 0.701 | 61% | 0.605 | S | S | * | * | trans | -64.4 | 77.5 | 162 | -73.8 | -59.8 | 0 | 0 | 0 | 103.8 | H33 P37 | H33-N35 WeakPolarHBondContact CB-ND2 3.23Å; H33-N35 PolarHBondContact O-N 3.46Å; H33-N35 PolarHBondContact O-ND2 3.46Å; N35-P37 WeakPolarHBondContact O-CD 3.49Å; N35-P37 VanDerWaalsContact O-N 3.14Å | ||
| 36 | N | 67.4 | Low | 58.9 | Low | 70 Ų | 70 | 100.5 Ų | 100.5 | 37% | 0.374 | 56% | 0.564 | S | S | . | * | trans | -72.6 | 99.8 | 172.2 | -78.7 | -37.2 | 0 | 0 | 0 | 104.8 | Q34 L38 L39 G40 | Q34-N36 PolarHBondContact O-N 3.45Å; N36-L38 PolarHBondContact O-N 3.44Å; N36-L38 VanDerWaalsContact O-N 3.12Å; N36-L39 HydrophobicContact CB-CB 4Å; N36-L39 HydrophobicContact CB-CD1 3.82Å; N36-L39 HydrophobicContact CB-CG 3.84Å; N36-L39 CarbonylContact O-C 3.58Å; N36-L39 WeakPolarHBondContact O-CA 3.42Å; N36-L39 PolarHBondContact O-N 2.9Å; N36-G40 PolarHBondContact O-N 2.91Å | ||
| 37 | P | 73.1 | Confident | 61.9 | Low | 110 Ų | 110 | 98 Ų | 98 | 71% | 0.714 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -60.2 | -29.7 | -174.5 | 26.9 | -34.6 | 0 | 0 | 0 | 110.8 | N35 L39 G40 L41 | N35-P37 WeakPolarHBondContact O-CD 3.49Å; N35-P37 VanDerWaalsContact O-N 3.14Å; P37-L39 VanDerWaalsContact C-N 3.33Å; P37-L39 PolarHBondContact O-N 3.31Å; P37-G40 WeakPolarHBondContact O-CA 3.39Å; P37-G40 PolarHBondContact O-N 3.45Å; P37-L41 PolarHBondContact O-N 2.87Å |
| 38 | L | 73.8 | Confident | 64.9 | Low | 72 Ų | 72 | 96.3 Ų | 96.3 | 38% | 0.377 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -59.1 | -41 | 172.7 | -169 | 76 | 0 | 0 | 0 | 112.6 | N36 G40 L41 I46 I49 M68 | N36-L38 PolarHBondContact O-N 3.44Å; N36-L38 VanDerWaalsContact O-N 3.12Å; L38-G40 VanDerWaalsContact C-N 3.26Å; L38-G40 PolarHBondContact O-N 2.97Å; L38-L41 HydrophobicContact CD1-CD1 4.31Å; L38-L41 PolarHBondContact O-N 3.15Å; L38-I46 VanDerWaalsContact O-CD1 3.26Å; L38-I46 WeakPolarHBondContact O-CD1 3.34Å; L38-I46 WeakPolarHBondContact O-CG1 3.18Å; L38-I49 HydrophobicContact CD1-CD1 3.78Å; L38-M68 HydrophobicContact CD2-CE 3.94Å |
| 39 | L | 74.6 | Confident | 67.7 | Low | 33 Ų | 33 | 92 Ų | 92 | 17% | 0.173 | 50% | 0.504 | C | S | . | . | H | α-helix | trans | -80.3 | -6.9 | 175.4 | -59.6 | 179.3 | 0 | 0 | 0 | 111.7 | N36 P37 L41 C65 R67 | N36-L39 HydrophobicContact CB-CB 4Å; N36-L39 HydrophobicContact CB-CD1 3.82Å; N36-L39 HydrophobicContact CB-CG 3.84Å; N36-L39 CarbonylContact O-C 3.58Å; N36-L39 WeakPolarHBondContact O-CA 3.42Å; N36-L39 PolarHBondContact O-N 2.9Å; P37-L39 VanDerWaalsContact C-N 3.33Å; P37-L39 PolarHBondContact O-N 3.31Å; L39-L41 VanDerWaalsContact C-N 3.34Å; L39-C65 VanDerWaalsContact CD1-SG 3.56Å; L39-R67 HydrophobicContact CD2-CB 4.37Å; L39-R67 HydrophobicContact CD2-CG 4.25Å; L39-R67 PolarHBondContact O-NE 2.88Å; L39-R67 PolarHBondContact O-NH1 3.47Å; L39-R67 PolarHBondContact O-NH2 2.9Å |
| 40 | G | 74.9 | Confident | 70.5 | Confident | 63 Ų | 63 | 83.3 Ų | 83.3 | 65% | 0.649 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -78.7 | -21.6 | 169.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | N36 P37 L38 | N36-G40 PolarHBondContact O-N 2.91Å; P37-G40 WeakPolarHBondContact O-CA 3.39Å; P37-G40 PolarHBondContact O-N 3.45Å; L38-G40 VanDerWaalsContact C-N 3.26Å; L38-G40 PolarHBondContact O-N 2.97Å |
| 41 | L | 83.8 | Confident | 73.3 | Confident | 64 Ų | 64 | 79.2 Ų | 79.2 | 34% | 0.335 | 45% | 0.448 | S | S | . | . | S | Bend | trans | -69.9 | 150.2 | -173.9 | -63.9 | 174 | 0 | 0 | 0 | 112.7 | P37 L38 L39 A45 I46 I49 R67 | P37-L41 PolarHBondContact O-N 2.87Å; L38-L41 HydrophobicContact CD1-CD1 4.31Å; L38-L41 PolarHBondContact O-N 3.15Å; L39-L41 VanDerWaalsContact C-N 3.34Å; L41-A45 HydrophobicContact CB-CB 4.22Å; L41-I46 HydrophobicContact CB-CD1 4.37Å; L41-I46 HydrophobicContact CB-CG1 3.92Å; L41-I49 HydrophobicContact CD1-CD1 4.03Å; L41-R67 PolarHBondContact O-NH2 2.98Å |
| 42 | P | 86.8 | Confident | 76 | Confident | 91 Ų | 91 | 80.5 Ų | 80.5 | 59% | 0.591 | 45% | 0.451 | S | S | * | . | trans | -53.4 | 144.2 | 167.9 | -24.1 | 33.8 | 0 | 0 | 0 | 111.1 | V44 A45 I46 | P42-V44 PolarHBondContact O-N 3.41Å; P42-V44 VanDerWaalsContact O-N 3.08Å; P42-A45 WeakPolarHBondContact O-CB 3.32Å; P42-A45 PolarHBondContact O-N 3.47Å; P42-I46 PolarHBondContact O-N 3.15Å | ||
| 43 | I | 83.1 | Confident | 78.4 | Confident | 57 Ų | 57 | 78.7 Ų | 78.7 | 29% | 0.292 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -52.9 | -36.9 | -177.5 | -169.9 | 165.4 | 0 | 0 | 0 | 112.7 | A45 I46 E47 I71 R74 | I43-A45 VanDerWaalsContact C-N 3.34Å; I43-A45 PolarHBondContact O-N 2.92Å; I43-I46 PolarHBondContact O-N 3.38Å; I43-E47 HydrophobicContact CG1-CG 4.32Å; I43-E47 WeakPolarHBondContact O-CG 3.43Å; I43-E47 PolarHBondContact O-N 2.74Å; I43-I71 HydrophobicContact CD1-CG1 3.94Å; I43-I71 HydrophobicContact CG1-CD1 4.21Å; I43-I71 HydrophobicContact CG1-CG1 3.98Å; I43-I71 HydrophobicContact CG1-CG2 4.39Å; I43-R74 VanDerWaalsContact CD1-NH1 3.31Å |
| 44 | V | 86.6 | Confident | 80.8 | Confident | 97 Ų | 97 | 73.7 Ų | 73.7 | 59% | 0.588 | 42% | 0.417 | S | S | * | . | H | α-helix | trans | -62 | -40.1 | 178.4 | -175.7 | 0 | 0 | 0 | 0 | 112 | P42 E47 T48 | P42-V44 PolarHBondContact O-N 3.41Å; P42-V44 VanDerWaalsContact O-N 3.08Å; V44-E47 PolarHBondContact O-N 2.88Å; V44-T48 WeakPolarHBondContact O-CB 3.32Å; V44-T48 PolarHBondContact O-N 2.85Å; V44-T48 PolarHBondContact O-OG1 3.34Å |
| 45 | A | 86.9 | Confident | 82.8 | Confident | 37 Ų | 37 | 68 Ų | 68 | 31% | 0.306 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -68.2 | -40.5 | 177.8 | 0 | 0 | 0 | 0 | 0 | 110.9 | L41 P42 I43 T48 I49 | L41-A45 HydrophobicContact CB-CB 4.22Å; P42-A45 WeakPolarHBondContact O-CB 3.32Å; P42-A45 PolarHBondContact O-N 3.47Å; I43-A45 VanDerWaalsContact C-N 3.34Å; I43-A45 PolarHBondContact O-N 2.92Å; A45-T48 WeakPolarHBondContact O-CB 3.5Å; A45-T48 PolarHBondContact O-N 2.94Å; A45-I49 WeakPolarHBondContact O-CG1 3.34Å; A45-I49 PolarHBondContact O-N 3.11Å |
| 46 | I | 86.8 | Confident | 85 | Confident | 2 Ų | 2 | 64.8 Ų | 64.8 | 1% | 0.01 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -64.2 | -46.6 | 175.8 | -57.2 | 172.9 | 0 | 0 | 0 | 110.3 | L38 L41 P42 I43 T48 I49 L50 I71 | L38-I46 VanDerWaalsContact O-CD1 3.26Å; L38-I46 WeakPolarHBondContact O-CD1 3.34Å; L38-I46 WeakPolarHBondContact O-CG1 3.18Å; L41-I46 HydrophobicContact CB-CD1 4.37Å; L41-I46 HydrophobicContact CB-CG1 3.92Å; P42-I46 PolarHBondContact O-N 3.15Å; I43-I46 PolarHBondContact O-N 3.38Å; I46-T48 PolarHBondContact O-N 3.03Å; I46-I49 WeakPolarHBondContact O-CB 3.5Å; I46-I49 PolarHBondContact O-N 3.08Å; I46-I49 VanDerWaalsContact O-N 3.13Å; I46-L50 HydrophobicContact CG2-CD1 4.14Å; I46-L50 HydrophobicContact CG2-CG 4.3Å; I46-L50 VanDerWaalsContact O-CG 3.32Å; I46-L50 WeakPolarHBondContact O-CG 3.32Å; I46-L50 PolarHBondContact O-N 2.96Å; I46-I71 HydrophobicContact CB-CD1 4.31Å; I46-I71 HydrophobicContact CD1-CD1 3.69Å; I46-I71 HydrophobicContact CG2-CD1 4Å; I46-I71 HydrophobicContact CG2-CG2 4.16Å |
| 47 | E | 86.7 | Confident | 86.2 | Confident | 42 Ų | 42 | 65.3 Ų | 65.3 | 20% | 0.196 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -58.7 | -37 | 175.3 | -73.3 | 178.7 | -178.7 | 0 | 0 | 112 | I43 V44 L50 N51 I71 V75 | I43-E47 HydrophobicContact CG1-CG 4.32Å; I43-E47 WeakPolarHBondContact O-CG 3.43Å; I43-E47 PolarHBondContact O-N 2.74Å; V44-E47 PolarHBondContact O-N 2.88Å; E47-L50 PolarHBondContact O-N 3.11Å; E47-N51 VanDerWaalsContact O-CG 3.3Å; E47-N51 PolarHBondContact O-N 3.4Å; E47-N51 PolarHBondContact O-ND2 2.94Å; E47-I71 HydrophobicContact CG-CG2 4.05Å; E47-V75 HydrophobicContact CG-CG2 3.93Å |
| 48 | T | 88.4 | Confident | 87.2 | Confident | 72 Ų | 72 | 60.2 Ų | 60.2 | 44% | 0.442 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -66.5 | -40.4 | 176.5 | -52.9 | 0 | 0 | 0 | 0 | 111.6 | V44 A45 I46 N51 F52 | V44-T48 WeakPolarHBondContact O-CB 3.32Å; V44-T48 PolarHBondContact O-N 2.85Å; V44-T48 PolarHBondContact O-OG1 3.34Å; A45-T48 WeakPolarHBondContact O-CB 3.5Å; A45-T48 PolarHBondContact O-N 2.94Å; I46-T48 PolarHBondContact O-N 3.03Å; T48-N51 PolarHBondContact O-N 2.94Å; T48-F52 WeakPolarHBondContact O-CD2 3.37Å; T48-F52 WeakPolarHBondContact O-CE2 3.35Å |
| 49 | I | 89.3 | Confident | 88.1 | Confident | 80 Ų | 80 | 58 Ų | 58 | 41% | 0.41 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -64.6 | -44.8 | 173.7 | -65.8 | 164.1 | 0 | 0 | 0 | 110.3 | L38 L41 A45 I46 N51 F52 | L38-I49 HydrophobicContact CD1-CD1 3.78Å; L41-I49 HydrophobicContact CD1-CD1 4.03Å; A45-I49 WeakPolarHBondContact O-CG1 3.34Å; A45-I49 PolarHBondContact O-N 3.11Å; I46-I49 WeakPolarHBondContact O-CB 3.5Å; I46-I49 PolarHBondContact O-N 3.08Å; I46-I49 VanDerWaalsContact O-N 3.13Å; I49-N51 PolarHBondContact O-N 3.33Å; I49-F52 PolarHBondContact O-N 3.5Å; I49-F52 VanDerWaalsContact O-N 3.12Å |
| 50 | L | 87.9 | Confident | 88.9 | Confident | 4 Ų | 4 | 61.8 Ų | 61.8 | 2% | 0.021 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -63.8 | -27 | 179.8 | -67.7 | 178.2 | 0 | 0 | 0 | 112.8 | I46 E47 F52 L53 I58 L61 M68 I71 V75 | I46-L50 HydrophobicContact CG2-CD1 4.14Å; I46-L50 HydrophobicContact CG2-CG 4.3Å; I46-L50 VanDerWaalsContact O-CG 3.32Å; I46-L50 WeakPolarHBondContact O-CG 3.32Å; I46-L50 PolarHBondContact O-N 2.96Å; E47-L50 PolarHBondContact O-N 3.11Å; L50-F52 PolarHBondContact O-N 3.31Å; L50-F52 VanDerWaalsContact O-N 3.13Å; L50-L53 HydrophobicContact CD2-CD1 3.98Å; L50-L53 WeakPolarHBondContact O-CB 3.44Å; L50-L53 PolarHBondContact O-N 2.94Å; L50-I58 HydrophobicContact CB-CD1 4.46Å; L50-L61 HydrophobicContact CD2-CD1 3.64Å; L50-M68 HydrophobicContact CD1-SD 4.36Å; L50-M68 HydrophobicContact CD2-SD 4.45Å; L50-I71 HydrophobicContact CD1-CG2 3.79Å; L50-V75 HydrophobicContact CD1-CG2 4.23Å |
| 51 | N | 88.1 | Confident | 89.6 | Confident | 97 Ų | 97 | 61 Ų | 61 | 52% | 0.519 | 33% | 0.328 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -63.3 | -14.7 | 175 | -74.2 | -32.8 | 0 | 0 | 0 | 114.1 | E47 T48 I49 L53 | E47-N51 VanDerWaalsContact O-CG 3.3Å; E47-N51 PolarHBondContact O-N 3.4Å; E47-N51 PolarHBondContact O-ND2 2.94Å; T48-N51 PolarHBondContact O-N 2.94Å; I49-N51 PolarHBondContact O-N 3.33Å; N51-L53 VanDerWaalsContact C-N 3.32Å |
| 52 | F | 90.8 | Very high | 89.9 | Confident | 172 Ų | 172 | 60.6 Ų | 60.6 | 75% | 0.754 | 32% | 0.323 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.4 | -8.6 | 173.4 | -66.3 | -77.6 | 0 | 0 | 0 | 113.4 | T48 I49 L50 | T48-F52 WeakPolarHBondContact O-CD2 3.37Å; T48-F52 WeakPolarHBondContact O-CE2 3.35Å; I49-F52 PolarHBondContact O-N 3.5Å; I49-F52 VanDerWaalsContact O-N 3.12Å; L50-F52 PolarHBondContact O-N 3.31Å; L50-F52 VanDerWaalsContact O-N 3.13Å |
| 53 | L | 92 | Very high | 90 | Very high | 64 Ų | 64 | 61.4 Ų | 61.4 | 34% | 0.335 | 33% | 0.331 | S | S | . | . | S | Bend | trans | -99.7 | 156.2 | 178.4 | -57.7 | 179.4 | 0 | 0 | 0 | 110.8 | L50 N51 E57 I58 L61 | L50-L53 HydrophobicContact CD2-CD1 3.98Å; L50-L53 WeakPolarHBondContact O-CB 3.44Å; L50-L53 PolarHBondContact O-N 2.94Å; N51-L53 VanDerWaalsContact C-N 3.32Å; L53-E57 HydrophobicContact CB-CB 4.22Å; L53-I58 HydrophobicContact CB-CG1 4.14Å; L53-L61 HydrophobicContact CD1-CD1 3.58Å |
| 54 | S | 94.2 | Very high | 90.3 | Very high | 39 Ų | 39 | 63.3 Ų | 63.3 | 27% | 0.273 | 34% | 0.344 | S | S | . | . | trans | -68.2 | 154.5 | 168.4 | 62.5 | 0 | 0 | 0 | 0 | 111.1 | D56 E57 I58 | S54-D56 PolarHBondContact O-N 3.38Å; S54-E57 WeakPolarHBondContact CB-OE2 3.45Å; S54-E57 PolarHBondContact N-OE2 2.88Å; S54-E57 PolarHBondContact O-N 2.67Å; S54-E57 VanDerWaalsContact OG-CD 3.26Å; S54-E57 WeakPolarHBondContact OG-CG 3.46Å; S54-E57 PolarHBondContact OG-N 2.95Å; S54-E57 PolarHBondContact OG-OE2 3.46Å; S54-I58 VanDerWaalsContact O-CG1 3.29Å; S54-I58 WeakPolarHBondContact O-CG1 3.46Å; S54-I58 PolarHBondContact O-N 2.72Å | ||
| 55 | Y | 94.8 | Very high | 90.5 | Very high | 30 Ų | 30 | 60.5 Ų | 60.5 | 12% | 0.118 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -64 | -28.7 | 175.6 | -72.4 | -77.2 | 0 | 0 | 0 | 112.1 | I58 S59 V75 L76 G79 G145 I148 D149 Y152 | Y55-I58 HydrophobicContact CD1-CD1 4.08Å; Y55-I58 HydrophobicContact CE1-CD1 4.47Å; Y55-I58 PolarHBondContact O-N 2.99Å; Y55-S59 PolarHBondContact O-N 3.21Å; Y55-S59 PolarHBondContact O-OG 3.4Å; Y55-V75 HydrophobicContact CE1-CG1 4.19Å; Y55-L76 HydrophobicContact CD1-CD2 4.03Å; Y55-G79 WeakPolarHBondContact OH-CA 3.39Å; Y55-G145 VanDerWaalsContact CB-O 3.3Å; Y55-G145 WeakPolarHBondContact CB-O 3.37Å; Y55-G145 WeakPolarHBondContact O-CA 3.43Å; Y55-I148 HydrophobicContact CD1-CD1 4.15Å; Y55-I148 HydrophobicContact CD1-CG2 4.39Å; Y55-I148 HydrophobicContact CD2-CB 3.9Å; Y55-I148 HydrophobicContact CD2-CG2 3.33Å; Y55-I148 HydrophobicContact CE2-CG2 3.5Å; Y55-I148 HydrophobicContact CG-CB 3.98Å; Y55-I148 HydrophobicContact CG-CD1 4.23Å; Y55-I148 HydrophobicContact CG-CG2 3.81Å; Y55-D149 WeakPolarHBondContact CD2-OD1 3.4Å; Y55-D149 VanDerWaalsContact N-CG 3.34Å; Y55-D149 PolarHBondContact N-OD1 3.39Å; Y55-D149 PolarHBondContact N-OD2 2.71Å; Y55-Y152 HydrophobicContact CE2-CD2 4.14Å; Y55-Y152 AromaticContact CE2-CE2 3.76Å; Y55-Y152 HydrophobicContact CE2-CE2 3.76Å |
| 56 | D | 94.5 | Very high | 90.6 | Very high | 65 Ų | 65 | 67.5 Ų | 67.5 | 35% | 0.348 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -61.2 | -47.4 | 171.3 | -165.4 | 46.8 | 0 | 0 | 0 | 112.3 | S54 I58 S59 M60 K146 D149 | S54-D56 PolarHBondContact O-N 3.38Å; D56-I58 PolarHBondContact O-N 3.21Å; D56-S59 WeakPolarHBondContact O-CB 2.98Å; D56-S59 PolarHBondContact O-N 3.45Å; D56-M60 PolarHBondContact O-N 3.42Å; D56-M60 VanDerWaalsContact O-N 3.11Å; D56-K146 HydrophobicContact CB-CB 4.13Å; D56-D149 PolarHBondContact N-OD2 2.82Å |
| 57 | E | 93.5 | Very high | 90.6 | Very high | 81 Ų | 81 | 72.7 Ų | 72.7 | 38% | 0.379 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -62.3 | -43 | 174.6 | -71.1 | 164.4 | 131.6 | 0 | 0 | 111.5 | L53 S54 S59 M60 L61 | L53-E57 HydrophobicContact CB-CB 4.22Å; S54-E57 WeakPolarHBondContact CB-OE2 3.45Å; S54-E57 PolarHBondContact N-OE2 2.88Å; S54-E57 PolarHBondContact O-N 2.67Å; S54-E57 VanDerWaalsContact OG-CD 3.26Å; S54-E57 WeakPolarHBondContact OG-CG 3.46Å; S54-E57 PolarHBondContact OG-N 2.95Å; S54-E57 PolarHBondContact OG-OE2 3.46Å; E57-S59 VanDerWaalsContact C-N 3.25Å; E57-S59 PolarHBondContact O-N 2.89Å; E57-M60 HydrophobicContact CB-CE 4.49Å; E57-M60 HydrophobicContact CG-CE 4.12Å; E57-M60 WeakPolarHBondContact O-CB 3.44Å; E57-M60 PolarHBondContact O-N 3.39Å; E57-L61 WeakPolarHBondContact O-CG 3.45Å; E57-L61 PolarHBondContact O-N 3.12Å |
| 58 | I | 93.3 | Very high | 90.8 | Very high | 3 Ų | 3 | 71.2 Ų | 71.2 | 2% | 0.015 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -59.6 | -38.4 | 176.2 | -65 | 164.7 | 0 | 0 | 0 | 110.9 | L50 L53 S54 Y55 D56 L61 C72 V75 L76 | L50-I58 HydrophobicContact CB-CD1 4.46Å; L53-I58 HydrophobicContact CB-CG1 4.14Å; S54-I58 VanDerWaalsContact O-CG1 3.29Å; S54-I58 WeakPolarHBondContact O-CG1 3.46Å; S54-I58 PolarHBondContact O-N 2.72Å; Y55-I58 HydrophobicContact CD1-CD1 4.08Å; Y55-I58 HydrophobicContact CE1-CD1 4.47Å; Y55-I58 PolarHBondContact O-N 2.99Å; D56-I58 PolarHBondContact O-N 3.21Å; I58-L61 PolarHBondContact O-N 3.17Å; I58-C72 HydrophobicContact CG2-CB 3.88Å; I58-C72 PolarHBondContact O-SG 2.94Å; I58-V75 HydrophobicContact CD1-CG1 3.92Å; I58-V75 HydrophobicContact CG2-CB 4.41Å; I58-V75 HydrophobicContact CG2-CG1 4.26Å; I58-L76 HydrophobicContact CG2-CD1 4.4Å; I58-L76 HydrophobicContact CG2-CD2 4.29Å; I58-L76 HydrophobicContact CG2-CG 4.01Å |
| 59 | S | 92.7 | Very high | 90.9 | Very high | 24 Ų | 24 | 69.7 Ų | 69.7 | 17% | 0.168 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -63.2 | -38.7 | 174.1 | -82.8 | 0 | 0 | 0 | 0 | 112.5 | Y55 D56 E57 R62 L76 I143 G145 | Y55-S59 PolarHBondContact O-N 3.21Å; Y55-S59 PolarHBondContact O-OG 3.4Å; D56-S59 WeakPolarHBondContact O-CB 2.98Å; D56-S59 PolarHBondContact O-N 3.45Å; E57-S59 VanDerWaalsContact C-N 3.25Å; E57-S59 PolarHBondContact O-N 2.89Å; S59-R62 WeakPolarHBondContact O-CB 3.48Å; S59-R62 WeakPolarHBondContact O-CG 3.39Å; S59-L76 WeakPolarHBondContact OG-CD1 3.5Å; S59-L76 WeakPolarHBondContact OG-CD2 3.33Å; S59-I143 PolarHBondContact OG-O 3.46Å; S59-G145 WeakPolarHBondContact OG-CA 3.37Å; S59-G145 PolarHBondContact OG-N 3.34Å |
| 60 | M | 91.8 | Very high | 90.9 | Very high | 114 Ų | 114 | 71.1 Ų | 71.1 | 56% | 0.562 | 36% | 0.36 | S | S | * | . | H | α-helix | trans | -69.2 | -36.8 | 176.5 | -65.2 | -167.8 | -73.1 | 0 | 0 | 112.7 | D56 E57 R62 S63 | D56-M60 PolarHBondContact O-N 3.42Å; D56-M60 VanDerWaalsContact O-N 3.11Å; E57-M60 HydrophobicContact CB-CE 4.49Å; E57-M60 HydrophobicContact CG-CE 4.12Å; E57-M60 WeakPolarHBondContact O-CB 3.44Å; E57-M60 PolarHBondContact O-N 3.39Å; M60-R62 PolarHBondContact O-N 3.33Å; M60-R62 VanDerWaalsContact O-N 3.09Å; M60-S63 PolarHBondContact O-N 2.98Å; M60-S63 PolarHBondContact O-OG 3.43Å |
| 61 | L | 89.9 | Confident | 91 | Very high | 45 Ų | 45 | 71.1 Ų | 71.1 | 24% | 0.236 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -62 | -17.6 | 179.9 | -72.7 | 177.1 | 0 | 0 | 0 | 114.1 | L50 L53 E57 I58 S63 V64 M68 | L50-L61 HydrophobicContact CD2-CD1 3.64Å; L53-L61 HydrophobicContact CD1-CD1 3.58Å; E57-L61 WeakPolarHBondContact O-CG 3.45Å; E57-L61 PolarHBondContact O-N 3.12Å; I58-L61 PolarHBondContact O-N 3.17Å; L61-S63 PolarHBondContact O-N 2.87Å; L61-V64 HydrophobicContact CD2-CG2 4.13Å; L61-V64 WeakPolarHBondContact O-CB 3.48Å; L61-V64 WeakPolarHBondContact O-CG2 3.47Å; L61-V64 PolarHBondContact O-N 2.75Å; L61-V64 VanDerWaalsContact O-N 3.15Å; L61-M68 HydrophobicContact CB-CG 4.19Å; L61-M68 WeakPolarHBondContact O-CG 3.49Å |
| 62 | R | 90.1 | Very high | 91.2 | Very high | 57 Ų | 57 | 66.5 Ų | 66.5 | 22% | 0.215 | 34% | 0.336 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -59.2 | -28.2 | 175 | -67 | -178.7 | 62.4 | -158.4 | -2 | 113.9 | S59 M60 V64 D69 C72 C141 | S59-R62 WeakPolarHBondContact O-CB 3.48Å; S59-R62 WeakPolarHBondContact O-CG 3.39Å; M60-R62 PolarHBondContact O-N 3.33Å; M60-R62 VanDerWaalsContact O-N 3.09Å; R62-V64 VanDerWaalsContact C-N 3.27Å; R62-V64 PolarHBondContact O-N 3.01Å; R62-D69 IonicContact CZ-OD1 3.74Å; R62-D69 IonicContact NE-OD1 3.09Å; R62-D69 PolarHBondContact NE-OD1 3.42Å; R62-D69 IonicContact NH2-OD1 2.87Å; R62-D69 PolarHBondContact NH2-OD1 2.96Å; R62-D69 WeakPolarHBondContact O-CB 3.37Å; R62-C72 HydrophobicContact CG-CB 3.5Å; R62-C72 VanDerWaalsContact CG-CB 3.5Å; R62-C141 PolarHBondContact NH1-SG 2.83Å |
| 63 | S | 89.3 | Confident | 91.3 | Very high | 108 Ų | 108 | 60.9 Ų | 60.9 | 76% | 0.755 | 31% | 0.312 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.2 | -10.4 | -179.7 | 63.3 | 0 | 0 | 0 | 0 | 114.1 | M60 L61 | M60-S63 PolarHBondContact O-N 2.98Å; M60-S63 PolarHBondContact O-OG 3.43Å; L61-S63 PolarHBondContact O-N 2.87Å |
| 64 | V | 89.1 | Confident | 91.3 | Very high | 96 Ų | 96 | 64 Ų | 64 | 58% | 0.582 | 32% | 0.319 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74 | -53.4 | -171.4 | 178.1 | 0 | 0 | 0 | 0 | 112.3 | L61 R62 | L61-V64 HydrophobicContact CD2-CG2 4.13Å; L61-V64 WeakPolarHBondContact O-CB 3.48Å; L61-V64 WeakPolarHBondContact O-CG2 3.47Å; L61-V64 PolarHBondContact O-N 2.75Å; L61-V64 VanDerWaalsContact O-N 3.15Å; R62-V64 VanDerWaalsContact C-N 3.27Å; R62-V64 PolarHBondContact O-N 3.01Å |
| 65 | C | 89.6 | Confident | 91.2 | Very high | 38 Ų | 38 | 62.5 Ų | 62.5 | 26% | 0.257 | 31% | 0.308 | S | S | . | . | trans | -158.5 | 161 | 178.4 | 75.9 | 0 | 0 | 0 | 0 | 112.1 | L39 R67 M68 D69 | L39-C65 VanDerWaalsContact CD1-SG 3.56Å; C65-R67 VanDerWaalsContact C-N 3.31Å; C65-R67 PolarHBondContact O-N 3.48Å; C65-M68 PolarHBondContact O-N 3.46Å; C65-M68 VanDerWaalsContact O-N 3.16Å; C65-M68 WeakPolarHBondContact SG-CB 3.44Å; C65-M68 PolarHBondContact SG-N 3.34Å; C65-D69 PolarHBondContact O-N 2.82Å | ||
| 66 | K | 89.3 | Confident | 91.2 | Very high | 185 Ų | 185 | 61 Ų | 61 | 80% | 0.804 | 30% | 0.302 | S | S | * | . | H | α-helix | trans | -57.7 | -39.9 | -178.2 | -65 | -176.5 | -179.4 | 177.7 | 0 | 113.3 | M70 | K66-M70 WeakPolarHBondContact O-CG 3.39Å; K66-M70 PolarHBondContact O-N 2.99Å; K66-M70 VanDerWaalsContact O-N 3.11Å |
| 67 | R | 88.2 | Confident | 91.1 | Very high | 110 Ų | 110 | 59.8 Ų | 59.8 | 42% | 0.415 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -67.6 | -43.6 | 178.2 | -179.9 | 170.6 | 173.2 | 163.4 | -6.3 | 111.4 | L39 L41 C65 M70 I71 | L39-R67 HydrophobicContact CD2-CB 4.37Å; L39-R67 HydrophobicContact CD2-CG 4.25Å; L39-R67 PolarHBondContact O-NE 2.88Å; L39-R67 PolarHBondContact O-NH1 3.47Å; L39-R67 PolarHBondContact O-NH2 2.9Å; L41-R67 PolarHBondContact O-NH2 2.98Å; C65-R67 VanDerWaalsContact C-N 3.31Å; C65-R67 PolarHBondContact O-N 3.48Å; R67-M70 PolarHBondContact O-N 3.4Å; R67-I71 HydrophobicContact CG-CD1 4.15Å; R67-I71 WeakPolarHBondContact O-CG1 3.46Å; R67-I71 PolarHBondContact O-N 2.89Å |
| 68 | M | 89.4 | Confident | 91.1 | Very high | 11 Ų | 11 | 59.9 Ų | 59.9 | 5% | 0.054 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -64.8 | -42.2 | 176.7 | -172.3 | 62.8 | 92.6 | 0 | 0 | 110.8 | L38 L50 L61 C65 M70 I71 C72 | L38-M68 HydrophobicContact CD2-CE 3.94Å; L50-M68 HydrophobicContact CD1-SD 4.36Å; L50-M68 HydrophobicContact CD2-SD 4.45Å; L61-M68 HydrophobicContact CB-CG 4.19Å; L61-M68 WeakPolarHBondContact O-CG 3.49Å; C65-M68 PolarHBondContact O-N 3.46Å; C65-M68 VanDerWaalsContact O-N 3.16Å; C65-M68 WeakPolarHBondContact SG-CB 3.44Å; C65-M68 PolarHBondContact SG-N 3.34Å; M68-M70 PolarHBondContact O-N 3.34Å; M68-I71 PolarHBondContact O-N 3.27Å; M68-I71 VanDerWaalsContact O-N 3.14Å; M68-C72 WeakPolarHBondContact O-CB 3.46Å; M68-C72 PolarHBondContact O-N 2.95Å; M68-C72 PolarHBondContact O-SG 2.9Å; M68-C72 VanDerWaalsContact O-SG 3.38Å |
| 69 | D | 90.3 | Very high | 91.1 | Very high | 41 Ų | 41 | 59.7 Ų | 59.7 | 22% | 0.219 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -54.5 | -50.7 | 174.6 | -176.5 | 36 | 0 | 0 | 0 | 111.2 | R62 C65 I71 C72 Q73 | R62-D69 IonicContact CZ-OD1 3.74Å; R62-D69 IonicContact NE-OD1 3.09Å; R62-D69 PolarHBondContact NE-OD1 3.42Å; R62-D69 IonicContact NH2-OD1 2.87Å; R62-D69 PolarHBondContact NH2-OD1 2.96Å; R62-D69 WeakPolarHBondContact O-CB 3.37Å; C65-D69 PolarHBondContact O-N 2.82Å; D69-I71 VanDerWaalsContact C-N 3.3Å; D69-I71 PolarHBondContact O-N 2.92Å; D69-C72 PolarHBondContact O-N 3.42Å; D69-Q73 WeakPolarHBondContact O-CB 3.46Å; D69-Q73 WeakPolarHBondContact O-CG 3.34Å; D69-Q73 PolarHBondContact O-N 3Å; D69-Q73 PolarHBondContact OD1-NE2 3.49Å; D69-Q73 PolarHBondContact OD2-NE2 2.7Å |
| 70 | M | 90.4 | Very high | 91.2 | Very high | 109 Ų | 109 | 58.6 Ų | 58.6 | 54% | 0.537 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -57.9 | -39.4 | 177.7 | -70.9 | -179.9 | 70.7 | 0 | 0 | 113.6 | K66 R67 M68 R74 | K66-M70 WeakPolarHBondContact O-CG 3.39Å; K66-M70 PolarHBondContact O-N 2.99Å; K66-M70 VanDerWaalsContact O-N 3.11Å; R67-M70 PolarHBondContact O-N 3.4Å; M68-M70 PolarHBondContact O-N 3.34Å; M70-R74 WeakPolarHBondContact O-CG 3.5Å; M70-R74 PolarHBondContact O-N 2.69Å |
| 71 | I | 90.9 | Very high | 91.3 | Very high | 5 Ų | 5 | 56.9 Ų | 56.9 | 3% | 0.026 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -72.4 | -50.6 | 179.9 | -62.1 | 170.6 | 0 | 0 | 0 | 110 | I43 I46 E47 L50 R67 M68 D69 Q73 R74 V75 | I43-I71 HydrophobicContact CD1-CG1 3.94Å; I43-I71 HydrophobicContact CG1-CD1 4.21Å; I43-I71 HydrophobicContact CG1-CG1 3.98Å; I43-I71 HydrophobicContact CG1-CG2 4.39Å; I46-I71 HydrophobicContact CB-CD1 4.31Å; I46-I71 HydrophobicContact CD1-CD1 3.69Å; I46-I71 HydrophobicContact CG2-CD1 4Å; I46-I71 HydrophobicContact CG2-CG2 4.16Å; E47-I71 HydrophobicContact CG-CG2 4.05Å; L50-I71 HydrophobicContact CD1-CG2 3.79Å; R67-I71 HydrophobicContact CG-CD1 4.15Å; R67-I71 WeakPolarHBondContact O-CG1 3.46Å; R67-I71 PolarHBondContact O-N 2.89Å; M68-I71 PolarHBondContact O-N 3.27Å; M68-I71 VanDerWaalsContact O-N 3.14Å; D69-I71 VanDerWaalsContact C-N 3.3Å; D69-I71 PolarHBondContact O-N 2.92Å; I71-Q73 VanDerWaalsContact C-N 3.29Å; I71-Q73 PolarHBondContact O-N 3.29Å; I71-R74 WeakPolarHBondContact O-CB 3.26Å; I71-R74 PolarHBondContact O-N 3.41Å; I71-V75 HydrophobicContact CG2-CG2 4.35Å; I71-V75 WeakPolarHBondContact O-CG2 3.45Å; I71-V75 PolarHBondContact O-N 3.08Å |
| 72 | C | 92.1 | Very high | 91.5 | Very high | 0 Ų | 0 | 58.6 Ų | 58.6 | 0% | 0 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -58 | -40.2 | 177.9 | -72.5 | 0 | 0 | 0 | 0 | 112 | I58 R62 M68 D69 R74 V75 L76 | I58-C72 HydrophobicContact CG2-CB 3.88Å; I58-C72 PolarHBondContact O-SG 2.94Å; R62-C72 HydrophobicContact CG-CB 3.5Å; R62-C72 VanDerWaalsContact CG-CB 3.5Å; M68-C72 WeakPolarHBondContact O-CB 3.46Å; M68-C72 PolarHBondContact O-N 2.95Å; M68-C72 PolarHBondContact O-SG 2.9Å; M68-C72 VanDerWaalsContact O-SG 3.38Å; D69-C72 PolarHBondContact O-N 3.42Å; C72-R74 VanDerWaalsContact C-N 3.33Å; C72-R74 PolarHBondContact O-N 3.44Å; C72-V75 PolarHBondContact O-N 2.94Å; C72-L76 WeakPolarHBondContact O-CB 3.48Å; C72-L76 WeakPolarHBondContact O-CD1 3.4Å; C72-L76 VanDerWaalsContact O-CG 3.27Å; C72-L76 WeakPolarHBondContact O-CG 3.45Å; C72-L76 PolarHBondContact O-N 2.96Å |
| 73 | Q | 92.1 | Very high | 91.8 | Very high | 54 Ų | 54 | 55.9 Ų | 55.9 | 25% | 0.252 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -57.4 | -45.1 | 174 | -74.5 | -175.8 | 39.1 | 0 | 0 | 112 | D69 I71 N77 C141 | D69-Q73 WeakPolarHBondContact O-CB 3.46Å; D69-Q73 WeakPolarHBondContact O-CG 3.34Å; D69-Q73 PolarHBondContact O-N 3Å; D69-Q73 PolarHBondContact OD1-NE2 3.49Å; D69-Q73 PolarHBondContact OD2-NE2 2.7Å; I71-Q73 VanDerWaalsContact C-N 3.29Å; I71-Q73 PolarHBondContact O-N 3.29Å; Q73-N77 WeakPolarHBondContact O-CB 3.39Å; Q73-N77 PolarHBondContact O-N 3.08Å; Q73-N77 PolarHBondContact O-ND2 3.3Å; Q73-C141 HydrophobicContact CB-CB 3.68Å; Q73-C141 HydrophobicContact CG-CB 3.63Å |
| 74 | R | 91.6 | Very high | 92.1 | Very high | 129 Ų | 129 | 53.8 Ų | 53.8 | 49% | 0.487 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -64.1 | -45.5 | 176.2 | -71 | 177.6 | -176.4 | -176.6 | 1.5 | 111.5 | I43 M70 I71 C72 L76 N77 Q78 | I43-R74 VanDerWaalsContact CD1-NH1 3.31Å; M70-R74 WeakPolarHBondContact O-CG 3.5Å; M70-R74 PolarHBondContact O-N 2.69Å; I71-R74 WeakPolarHBondContact O-CB 3.26Å; I71-R74 PolarHBondContact O-N 3.41Å; C72-R74 VanDerWaalsContact C-N 3.33Å; C72-R74 PolarHBondContact O-N 3.44Å; R74-L76 PolarHBondContact O-N 3.49Å; R74-N77 PolarHBondContact O-N 3.13Å; R74-Q78 WeakPolarHBondContact O-CB 3.48Å; R74-Q78 VanDerWaalsContact O-CG 3.31Å; R74-Q78 WeakPolarHBondContact O-CG 3.34Å; R74-Q78 PolarHBondContact O-N 3.42Å |
| 75 | V | 93.1 | Very high | 92.4 | Very high | 7 Ų | 7 | 57 Ų | 57 | 4% | 0.042 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -62.4 | -41.8 | -179.8 | 175.4 | 0 | 0 | 0 | 0 | 111.4 | E47 L50 Y55 I58 I71 C72 G79 | E47-V75 HydrophobicContact CG-CG2 3.93Å; L50-V75 HydrophobicContact CD1-CG2 4.23Å; Y55-V75 HydrophobicContact CE1-CG1 4.19Å; I58-V75 HydrophobicContact CD1-CG1 3.92Å; I58-V75 HydrophobicContact CG2-CB 4.41Å; I58-V75 HydrophobicContact CG2-CG1 4.26Å; I71-V75 HydrophobicContact CG2-CG2 4.35Å; I71-V75 WeakPolarHBondContact O-CG2 3.45Å; I71-V75 PolarHBondContact O-N 3.08Å; C72-V75 PolarHBondContact O-N 2.94Å; V75-G79 WeakPolarHBondContact O-CA 3.22Å; V75-G79 PolarHBondContact O-N 3.42Å |
| 76 | L | 93.9 | Very high | 92.7 | Very high | 0 Ų | 0 | 58.8 Ų | 58.8 | 0% | 0 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -67.2 | -46.4 | 178.1 | -71.9 | 162.6 | 0 | 0 | 0 | 112.2 | Y55 I58 S59 C72 R74 Q78 G79 F80 F142 I148 | Y55-L76 HydrophobicContact CD1-CD2 4.03Å; I58-L76 HydrophobicContact CG2-CD1 4.4Å; I58-L76 HydrophobicContact CG2-CD2 4.29Å; I58-L76 HydrophobicContact CG2-CG 4.01Å; S59-L76 WeakPolarHBondContact OG-CD1 3.5Å; S59-L76 WeakPolarHBondContact OG-CD2 3.33Å; C72-L76 WeakPolarHBondContact O-CB 3.48Å; C72-L76 WeakPolarHBondContact O-CD1 3.4Å; C72-L76 VanDerWaalsContact O-CG 3.27Å; C72-L76 WeakPolarHBondContact O-CG 3.45Å; C72-L76 PolarHBondContact O-N 2.96Å; R74-L76 PolarHBondContact O-N 3.49Å; L76-Q78 VanDerWaalsContact C-N 3.35Å; L76-Q78 PolarHBondContact O-N 3.28Å; L76-G79 PolarHBondContact O-N 3.02Å; L76-G79 VanDerWaalsContact O-N 3.14Å; L76-F80 PolarHBondContact O-N 2.87Å; L76-F142 WeakPolarHBondContact CB-O 3.46Å; L76-F142 WeakPolarHBondContact CD1-O 3.36Å; L76-I148 HydrophobicContact CD2-CD1 4.47Å |
| 77 | N | 93.4 | Very high | 93 | Very high | 39 Ų | 39 | 50.2 Ų | 50.2 | 21% | 0.209 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -60.4 | -45.9 | 176.5 | -70.4 | -8.2 | 0 | 0 | 0 | 111.1 | Q73 R74 G79 L81 V135 C141 F142 | Q73-N77 WeakPolarHBondContact O-CB 3.39Å; Q73-N77 PolarHBondContact O-N 3.08Å; Q73-N77 PolarHBondContact O-ND2 3.3Å; R74-N77 PolarHBondContact O-N 3.13Å; N77-G79 VanDerWaalsContact C-N 3.32Å; N77-G79 PolarHBondContact O-N 3.35Å; N77-L81 PolarHBondContact O-N 3.13Å; N77-V135 HydrophobicContact CB-CG1 4.48Å; N77-C141 WeakPolarHBondContact OD1-CA 3.32Å; N77-C141 WeakPolarHBondContact OD1-CB 3.37Å; N77-F142 PolarHBondContact OD1-N 3.12Å |
| 78 | Q | 92.9 | Very high | 93.3 | Very high | 82 Ų | 82 | 47.4 Ų | 47.4 | 38% | 0.383 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -65.3 | -36.3 | 174.7 | -73.1 | -174 | 13.1 | 0 | 0 | 112.3 | R74 L76 L81 K82 | R74-Q78 WeakPolarHBondContact O-CB 3.48Å; R74-Q78 VanDerWaalsContact O-CG 3.31Å; R74-Q78 WeakPolarHBondContact O-CG 3.34Å; R74-Q78 PolarHBondContact O-N 3.42Å; L76-Q78 VanDerWaalsContact C-N 3.35Å; L76-Q78 PolarHBondContact O-N 3.28Å; Q78-L81 PolarHBondContact O-N 3Å; Q78-K82 WeakPolarHBondContact O-CB 3.39Å; Q78-K82 VanDerWaalsContact O-CG 3.22Å; Q78-K82 WeakPolarHBondContact O-CG 3.35Å; Q78-K82 PolarHBondContact O-N 3.31Å |
| 79 | G | 93.6 | Very high | 93.5 | Very high | 0 Ų | 0 | 50.9 Ų | 50.9 | 0% | 0 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -59 | -46.2 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | Y55 V75 L76 N77 K82 V83 | Y55-G79 WeakPolarHBondContact OH-CA 3.39Å; V75-G79 WeakPolarHBondContact O-CA 3.22Å; V75-G79 PolarHBondContact O-N 3.42Å; L76-G79 PolarHBondContact O-N 3.02Å; L76-G79 VanDerWaalsContact O-N 3.14Å; N77-G79 VanDerWaalsContact C-N 3.32Å; N77-G79 PolarHBondContact O-N 3.35Å; G79-K82 PolarHBondContact O-N 3.26Å; G79-V83 PolarHBondContact O-N 3.26Å |
| 80 | F | 95 | Very high | 93.6 | Very high | 1 Ų | 1 | 49.3 Ų | 49.3 | 0% | 0.004 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -62.1 | -46.1 | 176.3 | -170.3 | -102.3 | 0 | 0 | 0 | 112.1 | L76 K82 V83 E84 L124 L127 N128 M132 F142 I148 | L76-F80 PolarHBondContact O-N 2.87Å; F80-K82 VanDerWaalsContact C-N 3.3Å; F80-K82 PolarHBondContact O-N 2.85Å; F80-V83 HydrophobicContact CD2-CG1 4.5Å; F80-V83 VanDerWaalsContact O-CG1 3.26Å; F80-V83 WeakPolarHBondContact O-CG1 3.38Å; F80-V83 PolarHBondContact O-N 2.98Å; F80-E84 PolarHBondContact O-N 3.41Å; F80-L124 HydrophobicContact CE2-CD2 3.97Å; F80-L124 HydrophobicContact CZ-CD2 4.16Å; F80-L127 HydrophobicContact CE2-CB 3.96Å; F80-L127 HydrophobicContact CE2-CD1 4.21Å; F80-L127 HydrophobicContact CZ-CB 3.87Å; F80-N128 HydrophobicContact CE1-CB 4.25Å; F80-N128 HydrophobicContact CZ-CB 4.4Å; F80-M132 HydrophobicContact CD1-CE 3.66Å; F80-M132 HydrophobicContact CD1-SD 4.25Å; F80-M132 HydrophobicContact CE1-CE 3.97Å; F80-M132 HydrophobicContact CG-CE 4.37Å; F80-F142 HydrophobicContact CB-CD1 4.43Å; F80-F142 HydrophobicContact CB-CD2 4.35Å; F80-F142 HydrophobicContact CB-CG 4.26Å; F80-F142 HydrophobicContact CD2-CD2 4.09Å; F80-F142 HydrophobicContact CD2-CE1 4.01Å; F80-F142 AromaticContact CD2-CE2 3.52Å; F80-F142 HydrophobicContact CD2-CE2 3.52Å; F80-F142 AromaticContact CD2-CZ 3.47Å; F80-F142 HydrophobicContact CD2-CZ 3.47Å; F80-F142 VanDerWaalsContact CD2-CZ 3.47Å; F80-F142 AromaticContact CE2-CE2 3.72Å; F80-F142 HydrophobicContact CE2-CE2 3.72Å; F80-F142 AromaticContact CE2-CZ 3.8Å; F80-F142 HydrophobicContact CE2-CZ 3.8Å; F80-F142 HydrophobicContact CG-CD2 4.08Å; F80-F142 AromaticContact CG-CE2 3.97Å; F80-F142 HydrophobicContact CG-CE2 3.97Å; F80-F142 HydrophobicContact CG-CG 4.46Å; F80-F142 HydrophobicContact CG-CZ 4.26Å; F80-F142 HydrophobicContact CZ-CE2 4.33Å; F80-I148 HydrophobicContact CB-CD1 4.26Å; F80-I148 HydrophobicContact CD2-CG1 4.46Å |
| 81 | L | 93.3 | Very high | 93.7 | Very high | 77 Ų | 77 | 45.2 Ų | 45.2 | 40% | 0.403 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -66.4 | -29.8 | 176.3 | -65.3 | 173.4 | 0 | 0 | 0 | 113.3 | N77 Q78 R85 | N77-L81 PolarHBondContact O-N 3.13Å; Q78-L81 PolarHBondContact O-N 3Å; L81-R85 WeakPolarHBondContact O-CG 3.4Å; L81-R85 PolarHBondContact O-N 2.71Å; L81-R85 PolarHBondContact O-NE 2.97Å; L81-R85 VanDerWaalsContact O-NE 3.13Å |
| 82 | K | 94.6 | Very high | 93.7 | Very high | 81 Ų | 81 | 53.4 Ų | 53.4 | 35% | 0.352 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -70 | -44.6 | 174.4 | -77.4 | 171.7 | -176.7 | 174.8 | 0 | 110.5 | Q78 G79 F80 R85 Y86 | Q78-K82 WeakPolarHBondContact O-CB 3.39Å; Q78-K82 VanDerWaalsContact O-CG 3.22Å; Q78-K82 WeakPolarHBondContact O-CG 3.35Å; Q78-K82 PolarHBondContact O-N 3.31Å; G79-K82 PolarHBondContact O-N 3.26Å; F80-K82 VanDerWaalsContact C-N 3.3Å; F80-K82 PolarHBondContact O-N 2.85Å; K82-R85 PolarHBondContact O-N 3.23Å; K82-Y86 WeakPolarHBondContact O-CB 3.45Å; K82-Y86 PolarHBondContact O-N 3.15Å |
| 83 | V | 95.7 | Very high | 93.7 | Very high | 0 Ų | 0 | 57.7 Ų | 57.7 | 0% | 0 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -69.4 | -36.5 | -178.8 | 79.4 | 0 | 0 | 0 | 0 | 112.1 | G79 F80 R85 Y86 H87 L124 I148 I151 Y152 L155 | G79-V83 PolarHBondContact O-N 3.26Å; F80-V83 HydrophobicContact CD2-CG1 4.5Å; F80-V83 VanDerWaalsContact O-CG1 3.26Å; F80-V83 WeakPolarHBondContact O-CG1 3.38Å; F80-V83 PolarHBondContact O-N 2.98Å; V83-R85 PolarHBondContact O-N 3.21Å; V83-Y86 PolarHBondContact O-N 3.22Å; V83-H87 WeakPolarHBondContact O-CB 3.47Å; V83-H87 PolarHBondContact O-N 3.16Å; V83-L124 HydrophobicContact CG1-CD2 4.2Å; V83-I148 HydrophobicContact CB-CG2 4.46Å; V83-I148 HydrophobicContact CG1-CG2 4.39Å; V83-I151 HydrophobicContact CG1-CD1 4.36Å; V83-I151 HydrophobicContact CG1-CG2 4.43Å; V83-I151 HydrophobicContact CG2-CB 3.95Å; V83-I151 HydrophobicContact CG2-CG2 3.35Å; V83-Y152 HydrophobicContact CB-CD2 4.37Å; V83-Y152 HydrophobicContact CB-CE1 4.27Å; V83-Y152 HydrophobicContact CB-CE2 3.74Å; V83-Y152 HydrophobicContact CG2-CD1 4.05Å; V83-Y152 HydrophobicContact CG2-CD2 3.96Å; V83-Y152 HydrophobicContact CG2-CE1 3.88Å; V83-Y152 HydrophobicContact CG2-CE2 3.79Å; V83-Y152 HydrophobicContact CG2-CG 4.09Å; V83-Y152 PolarHBondContact N-OH 3.33Å; V83-L155 HydrophobicContact CG2-CD1 3.91Å |
| 84 | E | 95 | Very high | 93.5 | Very high | 64 Ų | 64 | 56 Ų | 56 | 30% | 0.299 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -60.5 | -44.3 | 173.8 | -174.1 | -176.5 | -151.6 | 0 | 0 | 111.8 | F80 S88 | F80-E84 PolarHBondContact O-N 3.41Å; E84-S88 WeakPolarHBondContact O-CB 3.44Å; E84-S88 PolarHBondContact O-N 3.11Å; E84-S88 PolarHBondContact O-OG 2.86Å |
| 85 | R | 95.6 | Very high | 93.3 | Very high | 164 Ų | 164 | 55.5 Ų | 55.5 | 62% | 0.619 | 25% | 0.253 | S | S | * | . | H | α-helix | trans | -65.1 | -40.3 | 174.7 | -76.1 | -175.7 | -74.2 | -176 | -2.9 | 112.4 | L81 K82 V83 S88 L89 | L81-R85 WeakPolarHBondContact O-CG 3.4Å; L81-R85 PolarHBondContact O-N 2.71Å; L81-R85 PolarHBondContact O-NE 2.97Å; L81-R85 VanDerWaalsContact O-NE 3.13Å; K82-R85 PolarHBondContact O-N 3.23Å; V83-R85 PolarHBondContact O-N 3.21Å; R85-S88 WeakPolarHBondContact O-CB 3.37Å; R85-S88 PolarHBondContact O-N 3.39Å; R85-L89 PolarHBondContact O-N 3.21Å |
| 86 | Y | 95.3 | Very high | 93 | Very high | 75 Ų | 75 | 59.2 Ų | 59.2 | 29% | 0.294 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -66.1 | -43.7 | 178.2 | -176.9 | -118.2 | 0 | 0 | 0 | 111.9 | K82 V83 S88 L89 C90 Y152 L155 | K82-Y86 WeakPolarHBondContact O-CB 3.45Å; K82-Y86 PolarHBondContact O-N 3.15Å; V83-Y86 PolarHBondContact O-N 3.22Å; Y86-S88 VanDerWaalsContact C-N 3.34Å; Y86-S88 PolarHBondContact O-N 2.85Å; Y86-L89 WeakPolarHBondContact O-CB 3.48Å; Y86-L89 PolarHBondContact O-N 3.43Å; Y86-C90 PolarHBondContact O-N 3.45Å; Y86-C90 PolarHBondContact O-SG 2.89Å; Y86-C90 VanDerWaalsContact O-SG 3.38Å; Y86-Y152 HydrophobicContact CD1-CD1 4.14Å; Y86-Y152 AromaticContact CD1-CE1 3.95Å; Y86-Y152 HydrophobicContact CD1-CE1 3.95Å; Y86-Y152 HydrophobicContact CE1-CD1 4.48Å; Y86-Y152 HydrophobicContact CG-CE1 4.43Å; Y86-L155 HydrophobicContact CD1-CB 4.19Å; Y86-L155 HydrophobicContact CD1-CD1 3.6Å; Y86-L155 HydrophobicContact CE1-CB 3.83Å; Y86-L155 HydrophobicContact CE1-CD1 4.13Å |
| 87 | H | 95.9 | Very high | 92.6 | Very high | 5 Ų | 5 | 65.2 Ų | 65.2 | 2% | 0.023 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -56 | -48.5 | 171.3 | 166.5 | -82.9 | 0 | 0 | 0 | 111.5 | V83 L89 C90 Q91 L117 E121 L124 L155 | V83-H87 WeakPolarHBondContact O-CB 3.47Å; V83-H87 PolarHBondContact O-N 3.16Å; H87-L89 PolarHBondContact O-N 3.46Å; H87-C90 PolarHBondContact O-N 3.25Å; H87-Q91 WeakPolarHBondContact O-CB 3.29Å; H87-Q91 PolarHBondContact O-N 3.42Å; H87-L117 PolarHBondContact NE2-O 3.48Å; H87-E121 VanDerWaalsContact CE1-CB 3.48Å; H87-E121 WeakPolarHBondContact CE1-CB 3.35Å; H87-E121 PolarHBondContact NE2-N 3.28Å; H87-L124 HydrophobicContact CB-CD1 3.67Å; H87-L155 HydrophobicContact CB-CD1 3.98Å; H87-L155 HydrophobicContact CB-CD2 4.26Å |
| 88 | S | 94.8 | Very high | 92.1 | Very high | 52 Ų | 52 | 64.4 Ų | 64.4 | 36% | 0.364 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -58.3 | -37 | 179.4 | -65.9 | 0 | 0 | 0 | 0 | 112.5 | E84 R85 Y86 R92 | E84-S88 WeakPolarHBondContact O-CB 3.44Å; E84-S88 PolarHBondContact O-N 3.11Å; E84-S88 PolarHBondContact O-OG 2.86Å; R85-S88 WeakPolarHBondContact O-CB 3.37Å; R85-S88 PolarHBondContact O-N 3.39Å; Y86-S88 VanDerWaalsContact C-N 3.34Å; Y86-S88 PolarHBondContact O-N 2.85Å; S88-R92 WeakPolarHBondContact O-CB 3.43Å; S88-R92 PolarHBondContact O-N 2.97Å |
| 89 | L | 94.3 | Very high | 91.4 | Very high | 83 Ų | 83 | 62.1 Ų | 62.1 | 44% | 0.435 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -66.2 | -52.9 | 175.2 | -179.6 | 67.1 | 0 | 0 | 0 | 111.3 | R85 Y86 H87 Q91 R92 Q93 | R85-L89 PolarHBondContact O-N 3.21Å; Y86-L89 WeakPolarHBondContact O-CB 3.48Å; Y86-L89 PolarHBondContact O-N 3.43Å; H87-L89 PolarHBondContact O-N 3.46Å; L89-Q91 VanDerWaalsContact C-N 3.27Å; L89-Q91 PolarHBondContact O-N 3.27Å; L89-R92 PolarHBondContact O-N 2.94Å; L89-Q93 WeakPolarHBondContact O-CG 3.49Å; L89-Q93 PolarHBondContact O-N 3.29Å |
| 90 | C | 92.4 | Very high | 90.4 | Very high | 9 Ų | 9 | 73.6 Ų | 73.6 | 6% | 0.061 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -56.2 | -44.1 | 177.8 | -68 | 0 | 0 | 0 | 0 | 111.2 | Y86 H87 R92 Q93 V94 L117 | Y86-C90 PolarHBondContact O-N 3.45Å; Y86-C90 PolarHBondContact O-SG 2.89Å; Y86-C90 VanDerWaalsContact O-SG 3.38Å; H87-C90 PolarHBondContact O-N 3.25Å; C90-R92 PolarHBondContact O-N 3.17Å; C90-Q93 PolarHBondContact O-N 2.98Å; C90-V94 WeakPolarHBondContact O-CG2 3.34Å; C90-V94 PolarHBondContact O-N 3.05Å; C90-L117 HydrophobicContact CB-CD1 4.43Å; C90-L117 HydrophobicContact CB-CD2 4.25Å |
| 91 | Q | 92 | Very high | 89.4 | Confident | 22 Ų | 22 | 81.7 Ų | 81.7 | 10% | 0.103 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -64.5 | -41.7 | 179.4 | -160.2 | -165.6 | 48 | 0 | 0 | 112.1 | H87 L89 V94 K95 L117 E121 | H87-Q91 WeakPolarHBondContact O-CB 3.29Å; H87-Q91 PolarHBondContact O-N 3.42Å; L89-Q91 VanDerWaalsContact C-N 3.27Å; L89-Q91 PolarHBondContact O-N 3.27Å; Q91-V94 PolarHBondContact O-N 3.21Å; Q91-K95 VanDerWaalsContact CD-CE 3.47Å; Q91-K95 HydrophobicContact CG-CD 4.03Å; Q91-K95 HydrophobicContact CG-CG 4.4Å; Q91-K95 VanDerWaalsContact O-CB 3.23Å; Q91-K95 WeakPolarHBondContact O-CB 3.46Å; Q91-K95 VanDerWaalsContact O-CG 3.27Å; Q91-K95 WeakPolarHBondContact O-CG 3.42Å; Q91-K95 PolarHBondContact O-N 3Å; Q91-L117 HydrophobicContact CG-CB 4.35Å; Q91-E121 PolarHBondContact NE2-OE2 2.99Å |
| 92 | R | 91.3 | Very high | 88.1 | Confident | 178 Ų | 178 | 82.8 Ų | 82.8 | 67% | 0.672 | 38% | 0.377 | S | S | * | . | H | α-helix | trans | -64.2 | -40.9 | 176.6 | -167.5 | -176.9 | -56.6 | 171.1 | 3.4 | 111.8 | S88 L89 C90 K95 A96 | S88-R92 WeakPolarHBondContact O-CB 3.43Å; S88-R92 PolarHBondContact O-N 2.97Å; L89-R92 PolarHBondContact O-N 2.94Å; C90-R92 PolarHBondContact O-N 3.17Å; R92-K95 PolarHBondContact O-N 2.99Å; R92-A96 WeakPolarHBondContact O-CB 3.45Å; R92-A96 PolarHBondContact O-N 3.37Å |
| 93 | Q | 90.9 | Very high | 86.9 | Confident | 89 Ų | 89 | 83 Ų | 83 | 42% | 0.416 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -62.4 | -47.2 | 177.4 | -72.4 | 173.8 | -10.5 | 0 | 0 | 111.7 | L89 C90 A96 Q97 | L89-Q93 WeakPolarHBondContact O-CG 3.49Å; L89-Q93 PolarHBondContact O-N 3.29Å; C90-Q93 PolarHBondContact O-N 2.98Å; Q93-A96 PolarHBondContact O-N 3.35Å; Q93-Q97 WeakPolarHBondContact O-CG 3.49Å; Q93-Q97 PolarHBondContact O-N 2.88Å |
| 94 | V | 88.6 | Confident | 85.5 | Confident | 20 Ų | 20 | 87.4 Ų | 87.4 | 12% | 0.121 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -66.2 | -46.4 | 177 | 174.7 | 0 | 0 | 0 | 0 | 110.8 | C90 Q91 A96 Q97 L98 L110 H113 A114 L117 | C90-V94 WeakPolarHBondContact O-CG2 3.34Å; C90-V94 PolarHBondContact O-N 3.05Å; Q91-V94 PolarHBondContact O-N 3.21Å; V94-A96 VanDerWaalsContact C-N 3.27Å; V94-A96 PolarHBondContact O-N 3.33Å; V94-Q97 PolarHBondContact O-N 2.83Å; V94-Q97 VanDerWaalsContact O-N 3.09Å; V94-L98 HydrophobicContact CG1-CD1 4.2Å; V94-L98 HydrophobicContact CG1-CG 4.42Å; V94-L98 WeakPolarHBondContact O-CG 3.38Å; V94-L98 PolarHBondContact O-N 2.82Å; V94-L110 HydrophobicContact CG1-CB 4.25Å; V94-H113 HydrophobicContact CG1-CB 4.27Å; V94-H113 HydrophobicContact CG2-CB 4.44Å; V94-A114 HydrophobicContact CG1-CB 4.07Å; V94-L117 HydrophobicContact CB-CD1 4.13Å; V94-L117 HydrophobicContact CG2-CD1 3.76Å |
| 95 | K | 87 | Confident | 84.6 | Confident | 117 Ų | 117 | 87.8 Ų | 87.8 | 51% | 0.509 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -59.2 | -34.8 | 178.4 | -78.8 | 176.7 | 175.6 | 169.9 | 0 | 113 | Q91 R92 Q97 L98 | Q91-K95 VanDerWaalsContact CD-CE 3.47Å; Q91-K95 HydrophobicContact CG-CD 4.03Å; Q91-K95 HydrophobicContact CG-CG 4.4Å; Q91-K95 VanDerWaalsContact O-CB 3.23Å; Q91-K95 WeakPolarHBondContact O-CB 3.46Å; Q91-K95 VanDerWaalsContact O-CG 3.27Å; Q91-K95 WeakPolarHBondContact O-CG 3.42Å; Q91-K95 PolarHBondContact O-N 3Å; R92-K95 PolarHBondContact O-N 2.99Å; K95-Q97 VanDerWaalsContact C-N 3.31Å; K95-Q97 PolarHBondContact O-N 3.36Å; K95-L98 PolarHBondContact O-N 2.95Å |
| 96 | A | 87.5 | Confident | 83.5 | Confident | 85 Ų | 85 | 89 Ų | 89 | 70% | 0.702 | 41% | 0.413 | S | S | * | . | H | α-helix | trans | -69.6 | -27 | 178 | 0 | 0 | 0 | 0 | 0 | 113.5 | R92 Q93 V94 | R92-A96 WeakPolarHBondContact O-CB 3.45Å; R92-A96 PolarHBondContact O-N 3.37Å; Q93-A96 PolarHBondContact O-N 3.35Å; V94-A96 VanDerWaalsContact C-N 3.27Å; V94-A96 PolarHBondContact O-N 3.33Å |
| 97 | Q | 85.5 | Confident | 82.4 | Confident | 127 Ų | 127 | 92.4 Ų | 92.4 | 59% | 0.593 | 44% | 0.436 | S | S | * | . | H | α-helix | trans | -89.9 | -12.2 | 179.1 | -64.4 | 176.8 | 29.6 | 0 | 0 | 112.9 | Q93 V94 K95 L110 | Q93-Q97 WeakPolarHBondContact O-CG 3.49Å; Q93-Q97 PolarHBondContact O-N 2.88Å; V94-Q97 PolarHBondContact O-N 2.83Å; V94-Q97 VanDerWaalsContact O-N 3.09Å; K95-Q97 VanDerWaalsContact C-N 3.31Å; K95-Q97 PolarHBondContact O-N 3.36Å; Q97-L110 HydrophobicContact CB-CD1 3.84Å; Q97-L110 VanDerWaalsContact OE1-CD1 3.3Å |
| 98 | L | 82.8 | Confident | 81.6 | Confident | 22 Ų | 22 | 95.1 Ų | 95.1 | 12% | 0.115 | 45% | 0.448 | C | S | . | . | S | Bend | trans | -79.5 | 139.2 | 179.2 | -73.1 | 171.6 | 0 | 0 | 0 | 111.6 | V94 K95 R105 H108 L110 A114 | V94-L98 HydrophobicContact CG1-CD1 4.2Å; V94-L98 HydrophobicContact CG1-CG 4.42Å; V94-L98 WeakPolarHBondContact O-CG 3.38Å; V94-L98 PolarHBondContact O-N 2.82Å; K95-L98 PolarHBondContact O-N 2.95Å; L98-R105 HydrophobicContact CB-CG 4.05Å; L98-R105 HydrophobicContact CD2-CG 4.36Å; L98-H108 HydrophobicContact CD2-CB 4.29Å; L98-L110 HydrophobicContact CD2-CB 4.06Å; L98-A114 HydrophobicContact CD1-CB 3.7Å |
| 99 | P | 77.4 | Confident | 80.9 | Confident | 34 Ų | 34 | 96.3 Ų | 96.3 | 22% | 0.221 | 46% | 0.457 | C | S | . | . | trans | -53.8 | 150.1 | 170.2 | -25.5 | 33.9 | 0 | 0 | 0 | 111.8 | R101 E104 R105 | P99-R101 VanDerWaalsContact C-N 3.31Å; P99-R101 PolarHBondContact O-N 3.33Å; P99-E104 HydrophobicContact CB-CB 3.78Å; P99-E104 HydrophobicContact CG-CB 4.13Å; P99-R105 WeakPolarHBondContact O-CD 3.34Å; P99-R105 WeakPolarHBondContact O-CG 3.14Å; P99-R105 PolarHBondContact O-NH1 3.06Å | ||
| 100 | R | 72.9 | Confident | 80.5 | Confident | 241 Ų | 241 | 93.8 Ų | 93.8 | 91% | 0.909 | 44% | 0.444 | S | S | * | . | S | Bend | trans | -70.5 | -24.9 | 178.9 | -80.5 | -174 | 178.8 | 177.9 | 0.8 | 113.5 | R105 | R100-R105 VanDerWaalsContact C-NH1 3.3Å; R100-R105 VanDerWaalsContact O-CZ 3.24Å; R100-R105 PolarHBondContact O-NH1 3.27Å; R100-R105 PolarHBondContact O-NH2 3.14Å |
| 101 | R | 73.8 | Confident | 80.1 | Confident | 170 Ų | 170 | 94.1 Ų | 94.1 | 64% | 0.642 | 45% | 0.447 | S | S | * | . | S | Bend | trans | -89.7 | 134.7 | -178.4 | -73.4 | 175.6 | 171.6 | -175.4 | -1.5 | 111.3 | P99 S103 E104 R105 | P99-R101 VanDerWaalsContact C-N 3.31Å; P99-R101 PolarHBondContact O-N 3.33Å; R101-S103 PolarHBondContact O-N 3.37Å; R101-E104 HydrophobicContact CB-CB 4.36Å; R101-E104 HydrophobicContact CB-CG 4.29Å; R101-E104 VanDerWaalsContact CD-OE1 3.28Å; R101-E104 WeakPolarHBondContact CD-OE1 3.43Å; R101-E104 IonicContact NH1-OE1 4Å; R101-E104 PolarHBondContact O-N 3.27Å; R101-R105 PolarHBondContact O-N 3.33Å |
| 102 | E | 66.8 | Low | 79.9 | Confident | 100 Ų | 100 | 98.8 Ų | 98.8 | 47% | 0.467 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -66.1 | -36.7 | -174.8 | -169.1 | 57.8 | -157 | 0 | 0 | 113.5 | E104 R105 R106 | E102-E104 VanDerWaalsContact C-N 3.34Å; E102-E104 PolarHBondContact O-N 2.82Å; E102-R105 PolarHBondContact O-N 3.18Å; E102-R105 IonicContact OE2-CZ 3.17Å; E102-R105 IonicContact OE2-NE 3.91Å; E102-R105 PolarHBondContact OE2-NE 2.92Å; E102-R105 IonicContact OE2-NH2 2.64Å; E102-R105 PolarHBondContact OE2-NH2 3.47Å; E102-R105 VanDerWaalsContact OE2-NH2 3.09Å; E102-R106 PolarHBondContact O-N 3.47Å; E102-R106 IonicContact OE1-NE 2.89Å |
| 103 | S | 69.1 | Low | 79.9 | Confident | 85 Ų | 85 | 90.9 Ų | 90.9 | 59% | 0.594 | 43% | 0.434 | S | S | * | . | H | α-helix | trans | -63.8 | -37.5 | 175.8 | 48.8 | 0 | 0 | 0 | 0 | 112.8 | R101 | R101-S103 PolarHBondContact O-N 3.37Å |
| 104 | E | 66.3 | Low | 79.9 | Confident | 93 Ų | 93 | 87.7 Ų | 87.7 | 44% | 0.435 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -76.6 | -31.2 | 177.3 | -67.9 | 164.5 | -160.5 | 0 | 0 | 111.5 | P99 R101 E102 N107 H108 | P99-E104 HydrophobicContact CB-CB 3.78Å; P99-E104 HydrophobicContact CG-CB 4.13Å; R101-E104 HydrophobicContact CB-CB 4.36Å; R101-E104 HydrophobicContact CB-CG 4.29Å; R101-E104 VanDerWaalsContact CD-OE1 3.28Å; R101-E104 WeakPolarHBondContact CD-OE1 3.43Å; R101-E104 IonicContact NH1-OE1 4Å; R101-E104 PolarHBondContact O-N 3.27Å; E102-E104 VanDerWaalsContact C-N 3.34Å; E102-E104 PolarHBondContact O-N 2.82Å; E104-N107 PolarHBondContact O-N 3.4Å; E104-H108 PolarHBondContact O-N 3.11Å |
| 105 | R | 75.9 | Confident | 80 | Confident | 72 Ų | 72 | 91.7 Ų | 91.7 | 27% | 0.272 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -62.3 | -43.6 | 174.2 | -83.6 | -169 | -80.9 | -101.3 | -1.4 | 112.7 | L98 P99 R100 R101 E102 N107 H108 A111 | L98-R105 HydrophobicContact CB-CG 4.05Å; L98-R105 HydrophobicContact CD2-CG 4.36Å; P99-R105 WeakPolarHBondContact O-CD 3.34Å; P99-R105 WeakPolarHBondContact O-CG 3.14Å; P99-R105 PolarHBondContact O-NH1 3.06Å; R100-R105 VanDerWaalsContact C-NH1 3.3Å; R100-R105 VanDerWaalsContact O-CZ 3.24Å; R100-R105 PolarHBondContact O-NH1 3.27Å; R100-R105 PolarHBondContact O-NH2 3.14Å; R101-R105 PolarHBondContact O-N 3.33Å; E102-R105 PolarHBondContact O-N 3.18Å; E102-R105 IonicContact OE2-CZ 3.17Å; E102-R105 IonicContact OE2-NE 3.91Å; E102-R105 PolarHBondContact OE2-NE 2.92Å; E102-R105 IonicContact OE2-NH2 2.64Å; E102-R105 PolarHBondContact OE2-NH2 3.47Å; E102-R105 VanDerWaalsContact OE2-NH2 3.09Å; R105-N107 PolarHBondContact O-N 3.05Å; R105-H108 VanDerWaalsContact O-CB 3.28Å; R105-H108 WeakPolarHBondContact O-CB 3.47Å; R105-H108 PolarHBondContact O-N 2.86Å; R105-A111 WeakPolarHBondContact O-CB 3.43Å |
| 106 | R | 72.4 | Confident | 80.3 | Confident | 190 Ų | 190 | 86.1 Ų | 86.1 | 72% | 0.717 | 42% | 0.42 | S | S | * | . | H | α-helix | trans | -62.9 | -26.2 | -177.3 | -70.5 | -177.2 | -178.8 | -166.1 | -0.7 | 113.7 | E102 | E102-R106 PolarHBondContact O-N 3.47Å; E102-R106 IonicContact OE1-NE 2.89Å |
| 107 | N | 71.6 | Confident | 80.6 | Confident | 147 Ų | 147 | 82.2 Ų | 82.2 | 79% | 0.786 | 39% | 0.387 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -95.2 | -0.6 | 178.5 | -64.1 | -9.2 | 0 | 0 | 0 | 112.7 | E104 R105 | E104-N107 PolarHBondContact O-N 3.4Å; R105-N107 PolarHBondContact O-N 3.05Å |
| 108 | H | 80.8 | Confident | 81 | Confident | 61 Ų | 61 | 78.1 Ų | 78.1 | 28% | 0.282 | 38% | 0.375 | S | S | . | . | S | Bend | trans | -80.4 | 145 | -179.4 | -165.9 | -97.3 | 0 | 0 | 0 | 111.5 | L98 E104 R105 L110 A111 | L98-H108 HydrophobicContact CD2-CB 4.29Å; E104-H108 PolarHBondContact O-N 3.11Å; R105-H108 VanDerWaalsContact O-CB 3.28Å; R105-H108 WeakPolarHBondContact O-CB 3.47Å; R105-H108 PolarHBondContact O-N 2.86Å; H108-L110 WeakPolarHBondContact ND1-CB 3.41Å; H108-L110 PolarHBondContact ND1-N 3.4Å; H108-L110 VanDerWaalsContact ND1-N 3.11Å; H108-L110 PolarHBondContact O-N 3.38Å; H108-A111 VanDerWaalsContact O-CB 3.23Å; H108-A111 WeakPolarHBondContact O-CB 3.48Å; H108-A111 PolarHBondContact O-N 3.09Å |
| 109 | S | 80.3 | Confident | 81.5 | Confident | 78 Ų | 78 | 78.1 Ų | 78.1 | 55% | 0.545 | 38% | 0.378 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -57.2 | -34 | 178.8 | 55.8 | 0 | 0 | 0 | 0 | 113 | ||
| 110 | L | 84.6 | Confident | 82.4 | Confident | 29 Ų | 29 | 76.5 Ų | 76.5 | 15% | 0.152 | 37% | 0.367 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -85.3 | 1.5 | 178.8 | -57.2 | 176.5 | 0 | 0 | 0 | 115.1 | V94 Q97 L98 H108 R112 H113 A114 | V94-L110 HydrophobicContact CG1-CB 4.25Å; Q97-L110 HydrophobicContact CB-CD1 3.84Å; Q97-L110 VanDerWaalsContact OE1-CD1 3.3Å; L98-L110 HydrophobicContact CD2-CB 4.06Å; H108-L110 WeakPolarHBondContact ND1-CB 3.41Å; H108-L110 PolarHBondContact ND1-N 3.4Å; H108-L110 VanDerWaalsContact ND1-N 3.11Å; H108-L110 PolarHBondContact O-N 3.38Å; L110-R112 VanDerWaalsContact C-N 3.27Å; L110-R112 PolarHBondContact O-N 3.01Å; L110-H113 WeakPolarHBondContact O-CB 3.41Å; L110-H113 PolarHBondContact O-N 3.29Å; L110-A114 PolarHBondContact O-N 2.88Å |
| 111 | A | 85.5 | Confident | 83.5 | Confident | 16 Ų | 16 | 68.6 Ų | 68.6 | 13% | 0.132 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -56 | -45.7 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111.2 | R105 H108 H113 A114 D115 | R105-A111 WeakPolarHBondContact O-CB 3.43Å; H108-A111 VanDerWaalsContact O-CB 3.23Å; H108-A111 WeakPolarHBondContact O-CB 3.48Å; H108-A111 PolarHBondContact O-N 3.09Å; A111-H113 PolarHBondContact O-N 3.16Å; A111-A114 WeakPolarHBondContact O-CB 3.48Å; A111-A114 PolarHBondContact O-N 3.23Å; A111-A114 VanDerWaalsContact O-N 3.14Å; A111-D115 PolarHBondContact O-N 3.38Å |
| 112 | R | 87.8 | Confident | 84.5 | Confident | 121 Ų | 121 | 64 Ų | 64 | 46% | 0.457 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -63.9 | -38.7 | 178.8 | -71.5 | -173.6 | -84.4 | 176.5 | -14.3 | 112.6 | L110 A114 D115 I116 P164 | L110-R112 VanDerWaalsContact C-N 3.27Å; L110-R112 PolarHBondContact O-N 3.01Å; R112-A114 VanDerWaalsContact C-N 3.3Å; R112-A114 PolarHBondContact O-N 3.31Å; R112-D115 PolarHBondContact O-N 3.28Å; R112-I116 WeakPolarHBondContact O-CD1 3.37Å; R112-I116 WeakPolarHBondContact O-CG1 3.31Å; R112-I116 PolarHBondContact O-N 2.93Å; R112-P164 HydrophobicContact CB-CG 4.05Å; R112-P164 PolarHBondContact NH1-O 2.94Å |
| 113 | H | 90.8 | Very high | 85.9 | Confident | 11 Ų | 11 | 62.1 Ų | 62.1 | 5% | 0.051 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -60.9 | -42.6 | 174 | -61.7 | 71.9 | 0 | 0 | 0 | 111.2 | V94 L110 A111 I116 L117 V158 T161 R162 P164 | V94-H113 HydrophobicContact CG1-CB 4.27Å; V94-H113 HydrophobicContact CG2-CB 4.44Å; L110-H113 WeakPolarHBondContact O-CB 3.41Å; L110-H113 PolarHBondContact O-N 3.29Å; A111-H113 PolarHBondContact O-N 3.16Å; H113-I116 PolarHBondContact O-N 3.32Å; H113-L117 WeakPolarHBondContact O-CB 3.35Å; H113-L117 VanDerWaalsContact O-CG 3.25Å; H113-L117 WeakPolarHBondContact O-CG 3.42Å; H113-L117 PolarHBondContact O-N 2.87Å; H113-V158 HydrophobicContact CB-CG1 4.09Å; H113-V158 PolarHBondContact CD2-O 3.24Å; H113-V158 PolarHBondContact NE2-O 2.97Å; H113-T161 PolarHBondContact NE2-O 3.49Å; H113-R162 PolarHBondContact CE1-O 3.3Å; H113-P164 WeakPolarHBondContact CE1-CD 3.3Å |
| 114 | A | 90 | Very high | 87.2 | Confident | 22 Ų | 22 | 58.3 Ų | 58.3 | 18% | 0.182 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -64.7 | -43.4 | 179 | 0 | 0 | 0 | 0 | 0 | 112 | V94 L98 L110 A111 R112 L117 A118 | V94-A114 HydrophobicContact CG1-CB 4.07Å; L98-A114 HydrophobicContact CD1-CB 3.7Å; L110-A114 PolarHBondContact O-N 2.88Å; A111-A114 WeakPolarHBondContact O-CB 3.48Å; A111-A114 PolarHBondContact O-N 3.23Å; A111-A114 VanDerWaalsContact O-N 3.14Å; R112-A114 VanDerWaalsContact C-N 3.3Å; R112-A114 PolarHBondContact O-N 3.31Å; A114-L117 PolarHBondContact O-N 3.22Å; A114-A118 WeakPolarHBondContact O-CB 3.41Å; A114-A118 PolarHBondContact O-N 2.92Å |
| 115 | D | 90.9 | Very high | 88.6 | Confident | 104 Ų | 104 | 56.7 Ų | 56.7 | 56% | 0.556 | 29% | 0.293 | S | S | * | . | H | α-helix | trans | -61.8 | -44.2 | 177 | -67.8 | -21.2 | 0 | 0 | 0 | 111.7 | A111 R112 A118 A119 | A111-D115 PolarHBondContact O-N 3.38Å; R112-D115 PolarHBondContact O-N 3.28Å; D115-A118 PolarHBondContact O-N 3.45Å; D115-A119 WeakPolarHBondContact O-CB 3.45Å; D115-A119 PolarHBondContact O-N 3.05Å |
| 116 | I | 93.2 | Very high | 89.5 | Confident | 1 Ų | 1 | 56.5 Ų | 56.5 | 1% | 0.005 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -61.5 | -48.2 | 176 | -68.3 | 166.9 | 0 | 0 | 0 | 110.4 | R112 H113 A118 A119 V120 V154 V158 P164 A167 V170 L171 | R112-I116 WeakPolarHBondContact O-CD1 3.37Å; R112-I116 WeakPolarHBondContact O-CG1 3.31Å; R112-I116 PolarHBondContact O-N 2.93Å; H113-I116 PolarHBondContact O-N 3.32Å; I116-A118 VanDerWaalsContact C-N 3.35Å; I116-A118 PolarHBondContact O-N 3.06Å; I116-A119 PolarHBondContact O-N 3.42Å; I116-V120 WeakPolarHBondContact O-CG2 3.27Å; I116-V120 PolarHBondContact O-N 3.28Å; I116-V154 HydrophobicContact CG2-CG1 4.23Å; I116-V158 HydrophobicContact CB-CG2 4.18Å; I116-V158 HydrophobicContact CD1-CG2 4.39Å; I116-V158 HydrophobicContact CG2-CG2 3.38Å; I116-P164 HydrophobicContact CD1-CB 3.55Å; I116-P164 HydrophobicContact CD1-CG 3.78Å; I116-A167 HydrophobicContact CG1-CB 3.73Å; I116-V170 HydrophobicContact CD1-CG2 4.47Å; I116-L171 HydrophobicContact CG2-CD1 3.66Å |
| 117 | L | 94 | Very high | 90.6 | Very high | 2 Ų | 2 | 47.4 Ų | 47.4 | 1% | 0.01 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -64.4 | -37.5 | 179.7 | -70.5 | 171.3 | 0 | 0 | 0 | 112.3 | H87 C90 Q91 V94 H113 A114 A119 V120 E121 L155 V158 | H87-L117 PolarHBondContact NE2-O 3.48Å; C90-L117 HydrophobicContact CB-CD1 4.43Å; C90-L117 HydrophobicContact CB-CD2 4.25Å; Q91-L117 HydrophobicContact CG-CB 4.35Å; V94-L117 HydrophobicContact CB-CD1 4.13Å; V94-L117 HydrophobicContact CG2-CD1 3.76Å; H113-L117 WeakPolarHBondContact O-CB 3.35Å; H113-L117 VanDerWaalsContact O-CG 3.25Å; H113-L117 WeakPolarHBondContact O-CG 3.42Å; H113-L117 PolarHBondContact O-N 2.87Å; A114-L117 PolarHBondContact O-N 3.22Å; L117-A119 VanDerWaalsContact C-N 3.34Å; L117-V120 PolarHBondContact O-N 3.44Å; L117-E121 PolarHBondContact O-N 3.29Å; L117-L155 HydrophobicContact CD2-CD2 3.57Å; L117-V158 HydrophobicContact CD1-CG1 4.38Å; L117-V158 HydrophobicContact CD2-CG1 4.33Å; L117-V158 HydrophobicContact CG-CG1 4.18Å |
| 118 | A | 93.4 | Very high | 91.7 | Very high | 41 Ų | 41 | 42.8 Ų | 42.8 | 34% | 0.339 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -65 | -38 | 173.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | A114 D115 I116 E121 T122 | A114-A118 WeakPolarHBondContact O-CB 3.41Å; A114-A118 PolarHBondContact O-N 2.92Å; D115-A118 PolarHBondContact O-N 3.45Å; I116-A118 VanDerWaalsContact C-N 3.35Å; I116-A118 PolarHBondContact O-N 3.06Å; A118-E121 WeakPolarHBondContact O-CB 3.44Å; A118-E121 PolarHBondContact O-N 3.42Å; A118-T122 PolarHBondContact O-N 3.47Å; A118-T122 VanDerWaalsContact O-N 3.1Å; A118-T122 PolarHBondContact O-OG1 3.29Å |
| 119 | A | 94.4 | Very high | 92.2 | Very high | 22 Ų | 22 | 46.6 Ų | 46.6 | 18% | 0.182 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -68.1 | -37.9 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | D115 I116 L117 T122 R123 L171 | D115-A119 WeakPolarHBondContact O-CB 3.45Å; D115-A119 PolarHBondContact O-N 3.05Å; I116-A119 PolarHBondContact O-N 3.42Å; L117-A119 VanDerWaalsContact C-N 3.34Å; A119-T122 WeakPolarHBondContact O-CB 3.46Å; A119-T122 PolarHBondContact O-N 2.87Å; A119-R123 PolarHBondContact O-N 3.26Å; A119-L171 HydrophobicContact CB-CD2 3.4Å; A119-L171 VanDerWaalsContact CB-CD2 3.4Å |
| 120 | V | 96.1 | Very high | 92.8 | Very high | 0 Ų | 0 | 43.9 Ų | 43.9 | 0% | 0 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -64.3 | -40.7 | 172.2 | 175.4 | 0 | 0 | 0 | 0 | 111.1 | I116 L117 T122 R123 L124 I151 V154 L155 L171 L174 | I116-V120 WeakPolarHBondContact O-CG2 3.27Å; I116-V120 PolarHBondContact O-N 3.28Å; L117-V120 PolarHBondContact O-N 3.44Å; V120-T122 VanDerWaalsContact C-N 3.26Å; V120-T122 PolarHBondContact O-N 2.92Å; V120-R123 PolarHBondContact O-N 3.48Å; V120-R123 VanDerWaalsContact O-N 3.08Å; V120-L124 HydrophobicContact CG1-CD1 4.02Å; V120-L124 HydrophobicContact CG1-CG 4.36Å; V120-L124 PolarHBondContact O-N 2.87Å; V120-I151 HydrophobicContact CG1-CG2 4.14Å; V120-V154 HydrophobicContact CG2-CG1 3.73Å; V120-L155 HydrophobicContact CG1-CD2 4.43Å; V120-L171 HydrophobicContact CG2-CD1 4.2Å; V120-L171 HydrophobicContact CG2-CD2 3.97Å; V120-L171 HydrophobicContact CG2-CG 4.22Å; V120-L174 HydrophobicContact CG2-CD2 4.25Å |
| 121 | E | 95.8 | Very high | 93.2 | Very high | 76 Ų | 76 | 42.6 Ų | 42.6 | 36% | 0.355 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -57.8 | -41 | 176 | -171 | 177.1 | -170.1 | 0 | 0 | 111.8 | H87 Q91 L117 A118 R123 L124 S125 | H87-E121 VanDerWaalsContact CE1-CB 3.48Å; H87-E121 WeakPolarHBondContact CE1-CB 3.35Å; H87-E121 PolarHBondContact NE2-N 3.28Å; Q91-E121 PolarHBondContact NE2-OE2 2.99Å; L117-E121 PolarHBondContact O-N 3.29Å; A118-E121 WeakPolarHBondContact O-CB 3.44Å; A118-E121 PolarHBondContact O-N 3.42Å; E121-R123 VanDerWaalsContact C-N 3.33Å; E121-R123 PolarHBondContact O-N 3.36Å; E121-L124 PolarHBondContact O-N 3.05Å; E121-S125 WeakPolarHBondContact O-CB 3.4Å; E121-S125 PolarHBondContact O-N 3.12Å; E121-S125 PolarHBondContact O-OG 2.92Å |
| 122 | T | 95.7 | Very high | 93.5 | Very high | 74 Ų | 74 | 42.7 Ų | 42.7 | 45% | 0.454 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -64 | -40 | 177 | -54.3 | 0 | 0 | 0 | 0 | 111 | A118 A119 V120 L126 | A118-T122 PolarHBondContact O-N 3.47Å; A118-T122 VanDerWaalsContact O-N 3.1Å; A118-T122 PolarHBondContact O-OG1 3.29Å; A119-T122 WeakPolarHBondContact O-CB 3.46Å; A119-T122 PolarHBondContact O-N 2.87Å; V120-T122 VanDerWaalsContact C-N 3.26Å; V120-T122 PolarHBondContact O-N 2.92Å; T122-L126 WeakPolarHBondContact O-CG 3.48Å; T122-L126 PolarHBondContact O-N 3.07Å |
| 123 | R | 95.9 | Very high | 93.6 | Very high | 59 Ų | 59 | 41.8 Ų | 41.8 | 22% | 0.223 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -67.8 | -45.6 | 175.6 | -67.1 | -58.4 | 93.8 | 128.8 | 2 | 112 | A119 V120 E121 S125 L126 L127 L174 | A119-R123 PolarHBondContact O-N 3.26Å; V120-R123 PolarHBondContact O-N 3.48Å; V120-R123 VanDerWaalsContact O-N 3.08Å; E121-R123 VanDerWaalsContact C-N 3.33Å; E121-R123 PolarHBondContact O-N 3.36Å; R123-S125 VanDerWaalsContact C-N 3.34Å; R123-S125 PolarHBondContact O-N 2.94Å; R123-L126 PolarHBondContact O-N 2.86Å; R123-L127 WeakPolarHBondContact O-CG 3.48Å; R123-L127 PolarHBondContact O-N 3.44Å; R123-L174 HydrophobicContact CG-CD2 4.44Å; R123-L174 HydrophobicContact CG-CG 4.47Å |
| 124 | L | 95.9 | Very high | 93.5 | Very high | 5 Ų | 5 | 42 Ų | 42 | 3% | 0.026 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -57.1 | -46.7 | 176.2 | -79.3 | 169.4 | 0 | 0 | 0 | 111.6 | F80 V83 H87 V120 E121 L126 L127 N128 I151 | F80-L124 HydrophobicContact CE2-CD2 3.97Å; F80-L124 HydrophobicContact CZ-CD2 4.16Å; V83-L124 HydrophobicContact CG1-CD2 4.2Å; H87-L124 HydrophobicContact CB-CD1 3.67Å; V120-L124 HydrophobicContact CG1-CD1 4.02Å; V120-L124 HydrophobicContact CG1-CG 4.36Å; V120-L124 PolarHBondContact O-N 2.87Å; E121-L124 PolarHBondContact O-N 3.05Å; L124-L126 PolarHBondContact O-N 2.8Å; L124-L127 PolarHBondContact O-N 2.81Å; L124-N128 VanDerWaalsContact O-CB 3.3Å; L124-N128 WeakPolarHBondContact O-CB 3.5Å; L124-N128 PolarHBondContact O-N 3.14Å; L124-I151 HydrophobicContact CD2-CD1 3.71Å; L124-I151 HydrophobicContact CG-CD1 4.48Å |
| 125 | S | 95.9 | Very high | 93.5 | Very high | 60 Ų | 60 | 41.4 Ų | 41.4 | 42% | 0.42 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -59.9 | -43 | 178.4 | -62.5 | 0 | 0 | 0 | 0 | 112.7 | E121 R123 N128 M129 | E121-S125 WeakPolarHBondContact O-CB 3.4Å; E121-S125 PolarHBondContact O-N 3.12Å; E121-S125 PolarHBondContact O-OG 2.92Å; R123-S125 VanDerWaalsContact C-N 3.34Å; R123-S125 PolarHBondContact O-N 2.94Å; S125-N128 WeakPolarHBondContact O-CB 3.47Å; S125-N128 PolarHBondContact O-N 3.42Å; S125-M129 WeakPolarHBondContact O-CG 3.5Å; S125-M129 PolarHBondContact O-N 3.5Å |
| 126 | L | 94.9 | Very high | 93.4 | Very high | 67 Ų | 67 | 42.2 Ų | 42.2 | 35% | 0.351 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -63.8 | -47.6 | 177.4 | -71.9 | 172.1 | 0 | 0 | 0 | 111.5 | T122 R123 L124 N128 M129 T130 M182 | T122-L126 WeakPolarHBondContact O-CG 3.48Å; T122-L126 PolarHBondContact O-N 3.07Å; R123-L126 PolarHBondContact O-N 2.86Å; L124-L126 PolarHBondContact O-N 2.8Å; L126-N128 VanDerWaalsContact C-N 3.28Å; L126-N128 PolarHBondContact O-N 3.02Å; L126-M129 PolarHBondContact O-N 3.35Å; L126-T130 PolarHBondContact O-N 3.42Å; L126-T130 PolarHBondContact O-OG1 2.98Å; L126-M182 HydrophobicContact CB-SD 4.02Å |
| 127 | L | 95.1 | Very high | 93.1 | Very high | 0 Ų | 0 | 45.1 Ų | 45.1 | 0% | 0 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -59.5 | -42.1 | 175.9 | -66.6 | 165.8 | 0 | 0 | 0 | 111 | F80 R123 L124 M129 T130 F131 V147 I151 M182 | F80-L127 HydrophobicContact CE2-CB 3.96Å; F80-L127 HydrophobicContact CE2-CD1 4.21Å; F80-L127 HydrophobicContact CZ-CB 3.87Å; R123-L127 WeakPolarHBondContact O-CG 3.48Å; R123-L127 PolarHBondContact O-N 3.44Å; L124-L127 PolarHBondContact O-N 2.81Å; L127-M129 PolarHBondContact O-N 3.32Å; L127-T130 PolarHBondContact O-N 2.94Å; L127-F131 HydrophobicContact CB-CD2 4.34Å; L127-F131 HydrophobicContact CD2-CD2 4.2Å; L127-F131 HydrophobicContact CD2-CE2 3.68Å; L127-F131 VanDerWaalsContact O-CD2 3.22Å; L127-F131 WeakPolarHBondContact O-CD2 3.41Å; L127-F131 PolarHBondContact O-N 3.24Å; L127-V147 HydrophobicContact CD1-CG1 3.5Å; L127-V147 VanDerWaalsContact CD1-CG1 3.5Å; L127-V147 HydrophobicContact CD2-CG1 4.36Å; L127-I151 HydrophobicContact CD1-CD1 4.33Å; L127-M182 HydrophobicContact CD2-CG 4.08Å; L127-M182 HydrophobicContact CD2-SD 4.32Å |
| 128 | N | 94.3 | Very high | 92.7 | Very high | 50 Ų | 50 | 52 Ų | 52 | 27% | 0.267 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -59.3 | -48.6 | 178 | -161.8 | 62.3 | 0 | 0 | 0 | 111.2 | F80 L124 S125 L126 T130 M132 | F80-N128 HydrophobicContact CE1-CB 4.25Å; F80-N128 HydrophobicContact CZ-CB 4.4Å; L124-N128 VanDerWaalsContact O-CB 3.3Å; L124-N128 WeakPolarHBondContact O-CB 3.5Å; L124-N128 PolarHBondContact O-N 3.14Å; S125-N128 WeakPolarHBondContact O-CB 3.47Å; S125-N128 PolarHBondContact O-N 3.42Å; L126-N128 VanDerWaalsContact C-N 3.28Å; L126-N128 PolarHBondContact O-N 3.02Å; N128-T130 PolarHBondContact O-N 2.74Å; N128-M132 HydrophobicContact CB-CG 4.47Å; N128-M132 WeakPolarHBondContact O-CB 3.33Å; N128-M132 WeakPolarHBondContact O-CG 3.47Å; N128-M132 PolarHBondContact O-N 3.22Å; N128-M132 WeakPolarHBondContact OD1-CG 3.48Å |
| 129 | M | 91.7 | Very high | 92.4 | Very high | 141 Ų | 141 | 52.2 Ų | 52.2 | 70% | 0.695 | 28% | 0.279 | S | S | * | . | H | α-helix | trans | -63.1 | -38.5 | 177.4 | -71.5 | -179.4 | 66 | 0 | 0 | 113.2 | S125 L126 L127 | S125-M129 WeakPolarHBondContact O-CG 3.5Å; S125-M129 PolarHBondContact O-N 3.5Å; L126-M129 PolarHBondContact O-N 3.35Å; L127-M129 PolarHBondContact O-N 3.32Å |
| 130 | T | 92.8 | Very high | 92 | Very high | 20 Ų | 20 | 52.2 Ų | 52.2 | 12% | 0.123 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -70.3 | -48.7 | -178.8 | -58.7 | 0 | 0 | 0 | 0 | 111.5 | L126 L127 N128 M182 F185 | L126-T130 PolarHBondContact O-N 3.42Å; L126-T130 PolarHBondContact O-OG1 2.98Å; L127-T130 PolarHBondContact O-N 2.94Å; N128-T130 PolarHBondContact O-N 2.74Å; T130-M182 HydrophobicContact CG2-CB 4.23Å; T130-M182 HydrophobicContact CG2-CG 4Å; T130-F185 HydrophobicContact CG2-CD1 3.75Å; T130-F185 HydrophobicContact CG2-CE1 4.29Å |
| 131 | F | 93.2 | Very high | 91.7 | Very high | 2 Ų | 2 | 52.2 Ų | 52.2 | 1% | 0.009 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -96.5 | -43.3 | -168.8 | -64.7 | -74.1 | 0 | 0 | 0 | 113.7 | L127 K133 Y134 V135 F142 P144 A181 M182 F185 | L127-F131 HydrophobicContact CB-CD2 4.34Å; L127-F131 HydrophobicContact CD2-CD2 4.2Å; L127-F131 HydrophobicContact CD2-CE2 3.68Å; L127-F131 VanDerWaalsContact O-CD2 3.22Å; L127-F131 WeakPolarHBondContact O-CD2 3.41Å; L127-F131 PolarHBondContact O-N 3.24Å; F131-K133 VanDerWaalsContact C-N 3.25Å; F131-K133 PolarHBondContact O-N 3.38Å; F131-K133 VanDerWaalsContact O-N 3.13Å; F131-Y134 PolarHBondContact O-N 2.98Å; F131-V135 WeakPolarHBondContact O-CG2 3.47Å; F131-V135 PolarHBondContact O-N 2.78Å; F131-V135 VanDerWaalsContact O-N 3.09Å; F131-F142 HydrophobicContact CB-CD2 4Å; F131-F142 HydrophobicContact CB-CE2 4.26Å; F131-F142 HydrophobicContact CD2-CD2 4.22Å; F131-F142 AromaticContact CD2-CE2 3.7Å; F131-F142 HydrophobicContact CD2-CE2 3.7Å; F131-F142 HydrophobicContact CE2-CE2 4.33Å; F131-F142 HydrophobicContact CG-CD2 4.09Å; F131-F142 HydrophobicContact CG-CE2 4.06Å; F131-P144 HydrophobicContact CE1-CG 4Å; F131-P144 HydrophobicContact CE2-CG 3.99Å; F131-P144 HydrophobicContact CZ-CG 3.56Å; F131-A181 HydrophobicContact CZ-CB 4.41Å; F131-M182 HydrophobicContact CE2-CG 4.15Å; F131-F185 HydrophobicContact CD1-CD1 4.14Å; F131-F185 AromaticContact CD1-CD2 3.84Å; F131-F185 HydrophobicContact CD1-CD2 3.84Å; F131-F185 HydrophobicContact CD1-CE1 4.21Å; F131-F185 AromaticContact CD1-CE2 3.94Å; F131-F185 HydrophobicContact CD1-CE2 3.94Å; F131-F185 AromaticContact CD1-CG 3.94Å; F131-F185 HydrophobicContact CD1-CG 3.94Å; F131-F185 HydrophobicContact CD1-CZ 4.12Å; F131-F185 HydrophobicContact CE1-CB 3.62Å; F131-F185 AromaticContact CE1-CD1 3.94Å; F131-F185 HydrophobicContact CE1-CD1 3.94Å; F131-F185 AromaticContact CE1-CD2 3.47Å; F131-F185 HydrophobicContact CE1-CD2 3.47Å; F131-F185 VanDerWaalsContact CE1-CD2 3.47Å; F131-F185 HydrophobicContact CE1-CE1 4.45Å; F131-F185 HydrophobicContact CE1-CE2 4.07Å; F131-F185 AromaticContact CE1-CG 3.39Å; F131-F185 HydrophobicContact CE1-CG 3.39Å; F131-F185 HydrophobicContact CZ-CB 3.99Å; F131-F185 HydrophobicContact CZ-CG 4.19Å |
| 132 | M | 91.2 | Very high | 91.5 | Very high | 18 Ų | 18 | 48.6 Ų | 48.6 | 9% | 0.089 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -62.1 | -31.9 | -166.6 | -70.4 | -53.1 | 104 | 0 | 0 | 113.3 | F80 N128 Y134 V135 D136 F142 | F80-M132 HydrophobicContact CD1-CE 3.66Å; F80-M132 HydrophobicContact CD1-SD 4.25Å; F80-M132 HydrophobicContact CE1-CE 3.97Å; F80-M132 HydrophobicContact CG-CE 4.37Å; N128-M132 HydrophobicContact CB-CG 4.47Å; N128-M132 WeakPolarHBondContact O-CB 3.33Å; N128-M132 WeakPolarHBondContact O-CG 3.47Å; N128-M132 PolarHBondContact O-N 3.22Å; N128-M132 WeakPolarHBondContact OD1-CG 3.48Å; M132-Y134 PolarHBondContact O-N 2.93Å; M132-Y134 VanDerWaalsContact O-N 3.13Å; M132-V135 HydrophobicContact CE-CB 4.36Å; M132-V135 HydrophobicContact CE-CG2 4.05Å; M132-V135 PolarHBondContact O-N 2.87Å; M132-V135 VanDerWaalsContact O-N 3.12Å; M132-V135 HydrophobicContact SD-CB 4.33Å; M132-V135 HydrophobicContact SD-CG1 4.47Å; M132-D136 WeakPolarHBondContact O-CB 3.36Å; M132-D136 PolarHBondContact O-N 2.86Å; M132-F142 HydrophobicContact CE-CD2 3.82Å |
| 133 | K | 90 | Very high | 90.9 | Very high | 103 Ų | 103 | 47.7 Ų | 47.7 | 45% | 0.448 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -57.3 | -33.6 | 176.6 | 81.4 | -178 | -160.4 | -105.6 | 0 | 113.3 | F131 S137 | F131-K133 VanDerWaalsContact C-N 3.25Å; F131-K133 PolarHBondContact O-N 3.38Å; F131-K133 VanDerWaalsContact O-N 3.13Å; K133-S137 WeakPolarHBondContact O-CB 3.27Å; K133-S137 PolarHBondContact O-OG 2.95Å |
| 134 | Y | 90.3 | Very high | 90.7 | Very high | 14 Ų | 14 | 45.7 Ų | 45.7 | 6% | 0.055 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -88.2 | -33.2 | 177.6 | -62.1 | -83.9 | 0 | 0 | 0 | 112.2 | F131 M132 S137 N138 L139 C140 F185 V190 L193 | F131-Y134 PolarHBondContact O-N 2.98Å; M132-Y134 PolarHBondContact O-N 2.93Å; M132-Y134 VanDerWaalsContact O-N 3.13Å; Y134-S137 PolarHBondContact O-N 3.44Å; Y134-N138 PolarHBondContact O-N 3.47Å; Y134-L139 HydrophobicContact CD1-CD1 3.9Å; Y134-L139 WeakPolarHBondContact O-CB 3.47Å; Y134-L139 PolarHBondContact O-N 3.35Å; Y134-C140 VanDerWaalsContact CB-SG 3.55Å; Y134-F185 AromaticContact CD2-CE1 3.45Å; Y134-F185 HydrophobicContact CD2-CE1 3.45Å; Y134-F185 VanDerWaalsContact CD2-CE1 3.45Å; Y134-F185 AromaticContact CD2-CZ 3.37Å; Y134-F185 HydrophobicContact CD2-CZ 3.37Å; Y134-F185 AromaticContact CE2-CE1 3.46Å; Y134-F185 HydrophobicContact CE2-CE1 3.46Å; Y134-F185 VanDerWaalsContact CE2-CE1 3.46Å; Y134-F185 AromaticContact CE2-CZ 3.8Å; Y134-F185 HydrophobicContact CE2-CZ 3.8Å; Y134-F185 HydrophobicContact CG-CE1 4.32Å; Y134-F185 AromaticContact CG-CZ 3.82Å; Y134-F185 HydrophobicContact CG-CZ 3.82Å; Y134-V190 HydrophobicContact CE2-CG2 3.99Å; Y134-V190 WeakPolarHBondContact OH-CG1 3.17Å; Y134-L193 HydrophobicContact CD1-CD1 3.74Å; Y134-L193 HydrophobicContact CE1-CD1 4.27Å; Y134-L193 HydrophobicContact CG-CD1 4.21Å |
| 135 | V | 89.7 | Confident | 90.6 | Very high | 11 Ų | 11 | 45.5 Ų | 45.5 | 7% | 0.067 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -66.2 | -47 | 176.8 | 178.2 | 0 | 0 | 0 | 0 | 111.2 | N77 F131 M132 S137 N138 C140 | N77-V135 HydrophobicContact CB-CG1 4.48Å; F131-V135 WeakPolarHBondContact O-CG2 3.47Å; F131-V135 PolarHBondContact O-N 2.78Å; F131-V135 VanDerWaalsContact O-N 3.09Å; M132-V135 HydrophobicContact CE-CB 4.36Å; M132-V135 HydrophobicContact CE-CG2 4.05Å; M132-V135 PolarHBondContact O-N 2.87Å; M132-V135 VanDerWaalsContact O-N 3.12Å; M132-V135 HydrophobicContact SD-CB 4.33Å; M132-V135 HydrophobicContact SD-CG1 4.47Å; V135-S137 PolarHBondContact O-N 3.49Å; V135-N138 WeakPolarHBondContact O-CA 3.42Å; V135-N138 PolarHBondContact O-N 3.43Å; V135-C140 VanDerWaalsContact CA-O 3.31Å; V135-C140 WeakPolarHBondContact CA-O 3.22Å |
| 136 | D | 88 | Confident | 90.6 | Very high | 120 Ų | 120 | 47 Ų | 47 | 64% | 0.642 | 25% | 0.245 | S | C | * | . | H | α-helix | trans | -64.4 | -32.3 | 178 | -64.9 | -24.2 | 0 | 0 | 0 | 111.8 | M132 N138 | M132-D136 WeakPolarHBondContact O-CB 3.36Å; M132-D136 PolarHBondContact O-N 2.86Å; D136-N138 PolarHBondContact O-N 3.36Å; D136-N138 PolarHBondContact O-ND2 3.27Å |
| 137 | S | 87.6 | Confident | 90.7 | Very high | 62 Ų | 62 | 44 Ų | 44 | 43% | 0.434 | 23% | 0.23 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -78.3 | 3.8 | 174.3 | -57.3 | 0 | 0 | 0 | 0 | 113.3 | K133 Y134 V135 L139 | K133-S137 WeakPolarHBondContact O-CB 3.27Å; K133-S137 PolarHBondContact O-OG 2.95Å; Y134-S137 PolarHBondContact O-N 3.44Å; V135-S137 PolarHBondContact O-N 3.49Å; S137-L139 PolarHBondContact O-N 3.25Å |
| 138 | N | 86.1 | Confident | 90.7 | Very high | 148 Ų | 148 | 44 Ų | 44 | 79% | 0.791 | 23% | 0.23 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 53.5 | 30 | -175.7 | -65.6 | -83.2 | 0 | 0 | 0 | 114 | Y134 V135 D136 | Y134-N138 PolarHBondContact O-N 3.47Å; V135-N138 WeakPolarHBondContact O-CA 3.42Å; V135-N138 PolarHBondContact O-N 3.43Å; D136-N138 PolarHBondContact O-N 3.36Å; D136-N138 PolarHBondContact O-ND2 3.27Å |
| 139 | L | 85.3 | Confident | 90.8 | Very high | 44 Ų | 44 | 43.6 Ų | 43.6 | 23% | 0.23 | 23% | 0.227 | C | C | . | . | S | Bend | trans | -86.7 | -31.9 | -179.9 | -63.1 | 178.8 | 0 | 0 | 0 | 112.4 | Y134 S137 L193 L197 L202 | Y134-L139 HydrophobicContact CD1-CD1 3.9Å; Y134-L139 WeakPolarHBondContact O-CB 3.47Å; Y134-L139 PolarHBondContact O-N 3.35Å; S137-L139 PolarHBondContact O-N 3.25Å; L139-L193 HydrophobicContact CB-CD1 4.38Å; L139-L193 HydrophobicContact CB-CD2 4.31Å; L139-L193 WeakPolarHBondContact O-CD2 3.36Å; L139-L197 HydrophobicContact CD1-CD1 4.33Å; L139-L197 HydrophobicContact CD2-CD1 3.38Å; L139-L197 HydrophobicContact CG-CD1 4.49Å; L139-L202 HydrophobicContact CD1-CD1 3.51Å |
| 140 | C | 87.8 | Confident | 91 | Very high | 22 Ų | 22 | 37.8 Ų | 37.8 | 15% | 0.149 | 20% | 0.199 | C | C | . | . | trans | -152 | 166.6 | 173 | 66.9 | 0 | 0 | 0 | 0 | 109.6 | Y134 V135 L193 | Y134-C140 VanDerWaalsContact CB-SG 3.55Å; V135-C140 VanDerWaalsContact CA-O 3.31Å; V135-C140 WeakPolarHBondContact CA-O 3.22Å; C140-L193 HydrophobicContact CB-CD1 4.29Å | ||
| 141 | C | 89.5 | Confident | 91.2 | Very high | 0 Ų | 0 | 36.8 Ų | 36.8 | 0% | 0 | 19% | 0.193 | C | C | . | . | trans | -92 | 175.3 | 163.8 | 78.6 | 0 | 0 | 0 | 0 | 110.4 | R62 Q73 N77 I143 | R62-C141 PolarHBondContact NH1-SG 2.83Å; Q73-C141 HydrophobicContact CB-CB 3.68Å; Q73-C141 HydrophobicContact CG-CB 3.63Å; N77-C141 WeakPolarHBondContact OD1-CA 3.32Å; N77-C141 WeakPolarHBondContact OD1-CB 3.37Å; C141-I143 PolarHBondContact O-N 3.36Å; C141-I143 VanDerWaalsContact O-N 3.15Å | ||
| 142 | F | 90 | Very high | 91.3 | Very high | 0 Ų | 0 | 39.8 Ų | 39.8 | 0% | 0 | 20% | 0.204 | C | C | . | . | trans | -64.7 | 110.9 | 164.5 | -165.9 | -94.7 | 0 | 0 | 0 | 109.1 | L76 N77 F80 F131 M132 P144 I148 | L76-F142 WeakPolarHBondContact CB-O 3.46Å; L76-F142 WeakPolarHBondContact CD1-O 3.36Å; N77-F142 PolarHBondContact OD1-N 3.12Å; F80-F142 HydrophobicContact CB-CD1 4.43Å; F80-F142 HydrophobicContact CB-CD2 4.35Å; F80-F142 HydrophobicContact CB-CG 4.26Å; F80-F142 HydrophobicContact CD2-CD2 4.09Å; F80-F142 HydrophobicContact CD2-CE1 4.01Å; F80-F142 AromaticContact CD2-CE2 3.52Å; F80-F142 HydrophobicContact CD2-CE2 3.52Å; F80-F142 AromaticContact CD2-CZ 3.47Å; F80-F142 HydrophobicContact CD2-CZ 3.47Å; F80-F142 VanDerWaalsContact CD2-CZ 3.47Å; F80-F142 AromaticContact CE2-CE2 3.72Å; F80-F142 HydrophobicContact CE2-CE2 3.72Å; F80-F142 AromaticContact CE2-CZ 3.8Å; F80-F142 HydrophobicContact CE2-CZ 3.8Å; F80-F142 HydrophobicContact CG-CD2 4.08Å; F80-F142 AromaticContact CG-CE2 3.97Å; F80-F142 HydrophobicContact CG-CE2 3.97Å; F80-F142 HydrophobicContact CG-CG 4.46Å; F80-F142 HydrophobicContact CG-CZ 4.26Å; F80-F142 HydrophobicContact CZ-CE2 4.33Å; F131-F142 HydrophobicContact CB-CD2 4Å; F131-F142 HydrophobicContact CB-CE2 4.26Å; F131-F142 HydrophobicContact CD2-CD2 4.22Å; F131-F142 AromaticContact CD2-CE2 3.7Å; F131-F142 HydrophobicContact CD2-CE2 3.7Å; F131-F142 HydrophobicContact CE2-CE2 4.33Å; F131-F142 HydrophobicContact CG-CD2 4.09Å; F131-F142 HydrophobicContact CG-CE2 4.06Å; M132-F142 HydrophobicContact CE-CD2 3.82Å; F142-P144 HydrophobicContact CE1-CB 4.05Å; F142-P144 HydrophobicContact CE1-CG 4.25Å; F142-P144 VanDerWaalsContact CE1-O 3.29Å; F142-P144 WeakPolarHBondContact CE1-O 3.46Å; F142-P144 HydrophobicContact CZ-CB 4.26Å; F142-P144 HydrophobicContact CZ-CG 4.19Å; F142-I148 HydrophobicContact CD1-CD1 3.67Å; F142-I148 HydrophobicContact CD1-CG1 4.16Å; F142-I148 HydrophobicContact CE1-CD1 3.71Å; F142-I148 HydrophobicContact CE1-CG1 3.64Å; F142-I148 HydrophobicContact CZ-CG1 4.47Å | ||
| 143 | I | 84.6 | Confident | 91.5 | Very high | 55 Ų | 55 | 44.4 Ų | 44.4 | 28% | 0.282 | 22% | 0.221 | S | C | . | . | trans | -82.3 | -38.9 | -177.1 | -58.6 | 162.3 | 0 | 0 | 0 | 113 | S59 C141 G145 F185 I189 | S59-I143 PolarHBondContact OG-O 3.46Å; C141-I143 PolarHBondContact O-N 3.36Å; C141-I143 VanDerWaalsContact O-N 3.15Å; I143-G145 VanDerWaalsContact C-N 3.34Å; I143-G145 PolarHBondContact O-N 3.33Å; I143-F185 HydrophobicContact CD1-CD2 4.27Å; I143-F185 HydrophobicContact CD1-CE2 4.45Å; I143-I189 HydrophobicContact CD1-CG1 4.29Å; I143-I189 HydrophobicContact CD1-CG2 4.3Å | ||
| 144 | P | 92.1 | Very high | 91.8 | Very high | 17 Ų | 17 | 39.5 Ų | 39.5 | 11% | 0.11 | 20% | 0.199 | C | C | . | . | trans | -77.2 | 71.1 | -170.2 | -14.9 | 30.7 | 0 | 0 | 0 | 114.6 | F131 F142 K146 V147 A181 | F131-P144 HydrophobicContact CE1-CG 4Å; F131-P144 HydrophobicContact CE2-CG 3.99Å; F131-P144 HydrophobicContact CZ-CG 3.56Å; F142-P144 HydrophobicContact CE1-CB 4.05Å; F142-P144 HydrophobicContact CE1-CG 4.25Å; F142-P144 VanDerWaalsContact CE1-O 3.29Å; F142-P144 WeakPolarHBondContact CE1-O 3.46Å; F142-P144 HydrophobicContact CZ-CB 4.26Å; F142-P144 HydrophobicContact CZ-CG 4.19Å; P144-K146 PolarHBondContact O-N 2.77Å; P144-V147 HydrophobicContact CB-CB 4Å; P144-V147 HydrophobicContact CB-CG2 3.41Å; P144-V147 VanDerWaalsContact CB-CG2 3.41Å; P144-V147 WeakPolarHBondContact O-CB 3.42Å; P144-V147 PolarHBondContact O-N 2.94Å; P144-A181 HydrophobicContact CB-CB 3.8Å; P144-A181 HydrophobicContact CG-CB 3.68Å | ||
| 145 | G | 93.6 | Very high | 92 | Very high | 1 Ų | 1 | 39 Ų | 39 | 1% | 0.01 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -53.1 | -48.9 | 179.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | Y55 S59 I143 V147 I148 D149 | Y55-G145 VanDerWaalsContact CB-O 3.3Å; Y55-G145 WeakPolarHBondContact CB-O 3.37Å; Y55-G145 WeakPolarHBondContact O-CA 3.43Å; S59-G145 WeakPolarHBondContact OG-CA 3.37Å; S59-G145 PolarHBondContact OG-N 3.34Å; I143-G145 VanDerWaalsContact C-N 3.34Å; I143-G145 PolarHBondContact O-N 3.33Å; G145-V147 PolarHBondContact O-N 3.48Å; G145-V147 VanDerWaalsContact O-N 3.07Å; G145-I148 WeakPolarHBondContact O-CB 3.37Å; G145-I148 PolarHBondContact O-N 3.14Å; G145-D149 PolarHBondContact O-N 3.3Å |
| 146 | K | 95.1 | Very high | 92.2 | Very high | 93 Ų | 93 | 47.4 Ų | 47.4 | 40% | 0.404 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -52.7 | -31.8 | 176 | -166.6 | 179.7 | 174.8 | -160.9 | 0 | 114.1 | D56 P144 D149 E150 E173 I177 | D56-K146 HydrophobicContact CB-CB 4.13Å; P144-K146 PolarHBondContact O-N 2.77Å; K146-D149 PolarHBondContact O-N 3.01Å; K146-E150 WeakPolarHBondContact O-CB 3.39Å; K146-E150 PolarHBondContact O-N 3.04Å; K146-E173 IonicContact NZ-OE1 3.52Å; K146-E173 PolarHBondContact NZ-OE1 3.3Å; K146-I177 HydrophobicContact CD-CG2 4.45Å; K146-I177 HydrophobicContact CG-CD1 4.21Å |
| 147 | V | 96.7 | Very high | 92.4 | Very high | 3 Ų | 3 | 44.8 Ų | 44.8 | 2% | 0.018 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -66.6 | -39.8 | 178 | -177.5 | 0 | 0 | 0 | 0 | 110.7 | L127 P144 G145 E150 I151 L174 I177 A181 | L127-V147 HydrophobicContact CD1-CG1 3.5Å; L127-V147 VanDerWaalsContact CD1-CG1 3.5Å; L127-V147 HydrophobicContact CD2-CG1 4.36Å; P144-V147 HydrophobicContact CB-CB 4Å; P144-V147 HydrophobicContact CB-CG2 3.41Å; P144-V147 VanDerWaalsContact CB-CG2 3.41Å; P144-V147 WeakPolarHBondContact O-CB 3.42Å; P144-V147 PolarHBondContact O-N 2.94Å; G145-V147 PolarHBondContact O-N 3.48Å; G145-V147 VanDerWaalsContact O-N 3.07Å; V147-E150 PolarHBondContact O-N 3.46Å; V147-I151 HydrophobicContact CG1-CD1 4Å; V147-I151 WeakPolarHBondContact O-CD1 3.31Å; V147-I151 WeakPolarHBondContact O-CG1 3.29Å; V147-I151 PolarHBondContact O-N 2.79Å; V147-L174 HydrophobicContact CG1-CD1 4.14Å; V147-I177 HydrophobicContact CB-CD1 4.44Å; V147-I177 HydrophobicContact CG2-CD1 4.16Å; V147-I177 HydrophobicContact CG2-CG1 4.02Å; V147-A181 HydrophobicContact CG2-CB 4.23Å |
| 148 | I | 95.8 | Very high | 92.6 | Very high | 0 Ų | 0 | 42.1 Ų | 42.1 | 0% | 0 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -64.9 | -45.8 | 177.3 | -60.4 | 170.1 | 0 | 0 | 0 | 110.1 | Y55 L76 F80 V83 F142 G145 E150 I151 Y152 | Y55-I148 HydrophobicContact CD1-CD1 4.15Å; Y55-I148 HydrophobicContact CD1-CG2 4.39Å; Y55-I148 HydrophobicContact CD2-CB 3.9Å; Y55-I148 HydrophobicContact CD2-CG2 3.33Å; Y55-I148 HydrophobicContact CE2-CG2 3.5Å; Y55-I148 HydrophobicContact CG-CB 3.98Å; Y55-I148 HydrophobicContact CG-CD1 4.23Å; Y55-I148 HydrophobicContact CG-CG2 3.81Å; L76-I148 HydrophobicContact CD2-CD1 4.47Å; F80-I148 HydrophobicContact CB-CD1 4.26Å; F80-I148 HydrophobicContact CD2-CG1 4.46Å; V83-I148 HydrophobicContact CB-CG2 4.46Å; V83-I148 HydrophobicContact CG1-CG2 4.39Å; F142-I148 HydrophobicContact CD1-CD1 3.67Å; F142-I148 HydrophobicContact CD1-CG1 4.16Å; F142-I148 HydrophobicContact CE1-CD1 3.71Å; F142-I148 HydrophobicContact CE1-CG1 3.64Å; F142-I148 HydrophobicContact CZ-CG1 4.47Å; G145-I148 WeakPolarHBondContact O-CB 3.37Å; G145-I148 PolarHBondContact O-N 3.14Å; I148-E150 VanDerWaalsContact C-N 3.3Å; I148-E150 PolarHBondContact O-N 3.42Å; I148-I151 PolarHBondContact O-N 3.41Å; I148-Y152 HydrophobicContact CG2-CD2 3.76Å; I148-Y152 HydrophobicContact CG2-CE2 3.62Å; I148-Y152 WeakPolarHBondContact O-CD2 3.44Å; I148-Y152 PolarHBondContact O-N 2.64Å |
| 149 | D | 95.6 | Very high | 92.8 | Very high | 41 Ų | 41 | 39.9 Ų | 39.9 | 22% | 0.219 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -57.4 | -45.8 | 178.1 | -65.9 | -42.5 | 0 | 0 | 0 | 111.4 | Y55 D56 G145 K146 I151 Y152 R153 | Y55-D149 WeakPolarHBondContact CD2-OD1 3.4Å; Y55-D149 VanDerWaalsContact N-CG 3.34Å; Y55-D149 PolarHBondContact N-OD1 3.39Å; Y55-D149 PolarHBondContact N-OD2 2.71Å; D56-D149 PolarHBondContact N-OD2 2.82Å; G145-D149 PolarHBondContact O-N 3.3Å; K146-D149 PolarHBondContact O-N 3.01Å; D149-I151 PolarHBondContact O-N 3.01Å; D149-Y152 PolarHBondContact O-N 3.24Å; D149-R153 PolarHBondContact O-N 3.4Å |
| 150 | E | 96.4 | Very high | 93 | Very high | 19 Ų | 19 | 42 Ų | 42 | 9% | 0.089 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -67 | -36.8 | -179.8 | -173.3 | 57.1 | -158.1 | 0 | 0 | 112.4 | K146 V147 I148 R153 V154 E173 L174 I177 | K146-E150 WeakPolarHBondContact O-CB 3.39Å; K146-E150 PolarHBondContact O-N 3.04Å; V147-E150 PolarHBondContact O-N 3.46Å; I148-E150 VanDerWaalsContact C-N 3.3Å; I148-E150 PolarHBondContact O-N 3.42Å; E150-R153 WeakPolarHBondContact O-CB 3.37Å; E150-R153 PolarHBondContact O-N 2.89Å; E150-R153 IonicContact OE1-CZ 3.11Å; E150-R153 IonicContact OE1-NE 3.54Å; E150-R153 PolarHBondContact OE1-NE 3.44Å; E150-R153 IonicContact OE1-NH2 3.29Å; E150-R153 PolarHBondContact OE1-NH2 3.05Å; E150-R153 WeakPolarHBondContact OE2-CD 3.3Å; E150-R153 IonicContact OE2-CZ 3.63Å; E150-R153 IonicContact OE2-NE 2.88Å; E150-R153 PolarHBondContact OE2-NE 3.03Å; E150-V154 WeakPolarHBondContact O-CG2 3.34Å; E150-V154 PolarHBondContact O-N 3.18Å; E150-E173 HydrophobicContact CG-CB 4.5Å; E150-E173 HydrophobicContact CG-CG 4.16Å; E150-L174 HydrophobicContact CB-CD1 4.3Å; E150-L174 HydrophobicContact CG-CB 3.83Å; E150-L174 HydrophobicContact CG-CD1 4.09Å; E150-I177 HydrophobicContact CB-CD1 3.48Å; E150-I177 VanDerWaalsContact CB-CD1 3.48Å; E150-I177 HydrophobicContact CG-CD1 3.74Å |
| 151 | I | 96.2 | Very high | 93.1 | Very high | 0 Ų | 0 | 42.9 Ų | 42.9 | 0% | 0 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -62.3 | -46.2 | 172.5 | -63.9 | 159.2 | 0 | 0 | 0 | 110 | V83 V120 L124 L127 V147 I148 D149 R153 V154 L155 L174 | V83-I151 HydrophobicContact CG1-CD1 4.36Å; V83-I151 HydrophobicContact CG1-CG2 4.43Å; V83-I151 HydrophobicContact CG2-CB 3.95Å; V83-I151 HydrophobicContact CG2-CG2 3.35Å; V120-I151 HydrophobicContact CG1-CG2 4.14Å; L124-I151 HydrophobicContact CD2-CD1 3.71Å; L124-I151 HydrophobicContact CG-CD1 4.48Å; L127-I151 HydrophobicContact CD1-CD1 4.33Å; V147-I151 HydrophobicContact CG1-CD1 4Å; V147-I151 WeakPolarHBondContact O-CD1 3.31Å; V147-I151 WeakPolarHBondContact O-CG1 3.29Å; V147-I151 PolarHBondContact O-N 2.79Å; I148-I151 PolarHBondContact O-N 3.41Å; D149-I151 PolarHBondContact O-N 3.01Å; I151-R153 VanDerWaalsContact C-N 3.31Å; I151-R153 PolarHBondContact O-N 2.89Å; I151-V154 PolarHBondContact O-N 2.91Å; I151-L155 HydrophobicContact CG2-CD1 3.74Å; I151-L155 HydrophobicContact CG2-CG 4.1Å; I151-L155 WeakPolarHBondContact O-CB 3.18Å; I151-L155 VanDerWaalsContact O-CG 3.25Å; I151-L155 WeakPolarHBondContact O-CG 3.36Å; I151-L155 PolarHBondContact O-N 2.91Å; I151-L174 HydrophobicContact CD1-CD1 4.36Å; I151-L174 HydrophobicContact CG1-CD1 3.5Å; I151-L174 HydrophobicContact CG1-CD2 4.13Å; I151-L174 HydrophobicContact CG1-CG 4.49Å |
| 152 | Y | 95.7 | Very high | 92.7 | Very high | 65 Ų | 65 | 54.2 Ų | 54.2 | 26% | 0.255 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -62.1 | -38.8 | 176.4 | -83.4 | -65.3 | 0 | 0 | 0 | 112.3 | Y55 V83 Y86 I148 D149 L155 R156 | Y55-Y152 HydrophobicContact CE2-CD2 4.14Å; Y55-Y152 AromaticContact CE2-CE2 3.76Å; Y55-Y152 HydrophobicContact CE2-CE2 3.76Å; V83-Y152 HydrophobicContact CB-CD2 4.37Å; V83-Y152 HydrophobicContact CB-CE1 4.27Å; V83-Y152 HydrophobicContact CB-CE2 3.74Å; V83-Y152 HydrophobicContact CG2-CD1 4.05Å; V83-Y152 HydrophobicContact CG2-CD2 3.96Å; V83-Y152 HydrophobicContact CG2-CE1 3.88Å; V83-Y152 HydrophobicContact CG2-CE2 3.79Å; V83-Y152 HydrophobicContact CG2-CG 4.09Å; V83-Y152 PolarHBondContact N-OH 3.33Å; Y86-Y152 HydrophobicContact CD1-CD1 4.14Å; Y86-Y152 AromaticContact CD1-CE1 3.95Å; Y86-Y152 HydrophobicContact CD1-CE1 3.95Å; Y86-Y152 HydrophobicContact CE1-CD1 4.48Å; Y86-Y152 HydrophobicContact CG-CE1 4.43Å; I148-Y152 HydrophobicContact CG2-CD2 3.76Å; I148-Y152 HydrophobicContact CG2-CE2 3.62Å; I148-Y152 WeakPolarHBondContact O-CD2 3.44Å; I148-Y152 PolarHBondContact O-N 2.64Å; D149-Y152 PolarHBondContact O-N 3.24Å; Y152-L155 PolarHBondContact O-N 3.13Å; Y152-R156 VanDerWaalsContact O-CB 3.27Å; Y152-R156 WeakPolarHBondContact O-CB 3.25Å; Y152-R156 PolarHBondContact O-N 2.98Å |
| 153 | R | 95.4 | Very high | 92.3 | Very high | 115 Ų | 115 | 57 Ų | 57 | 43% | 0.434 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -58.3 | -50.3 | 174.5 | -168.8 | -164.1 | 70.3 | 74.8 | 2.3 | 111 | D149 E150 I151 R156 Y157 V170 | D149-R153 PolarHBondContact O-N 3.4Å; E150-R153 WeakPolarHBondContact O-CB 3.37Å; E150-R153 PolarHBondContact O-N 2.89Å; E150-R153 IonicContact OE1-CZ 3.11Å; E150-R153 IonicContact OE1-NE 3.54Å; E150-R153 PolarHBondContact OE1-NE 3.44Å; E150-R153 IonicContact OE1-NH2 3.29Å; E150-R153 PolarHBondContact OE1-NH2 3.05Å; E150-R153 WeakPolarHBondContact OE2-CD 3.3Å; E150-R153 IonicContact OE2-CZ 3.63Å; E150-R153 IonicContact OE2-NE 2.88Å; E150-R153 PolarHBondContact OE2-NE 3.03Å; I151-R153 VanDerWaalsContact C-N 3.31Å; I151-R153 PolarHBondContact O-N 2.89Å; R153-R156 PolarHBondContact O-N 3.02Å; R153-Y157 WeakPolarHBondContact O-CB 3.37Å; R153-Y157 PolarHBondContact O-N 3.5Å; R153-V170 PolarHBondContact NH2-O 3.15Å |
| 154 | V | 95.6 | Very high | 92.3 | Very high | 0 Ų | 0 | 54.4 Ų | 54.4 | 0% | 0 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -63.1 | -46.9 | 178.1 | 172.6 | 0 | 0 | 0 | 0 | 111.1 | I116 V120 E150 I151 R156 Y157 V158 V170 L171 | I116-V154 HydrophobicContact CG2-CG1 4.23Å; V120-V154 HydrophobicContact CG2-CG1 3.73Å; E150-V154 WeakPolarHBondContact O-CG2 3.34Å; E150-V154 PolarHBondContact O-N 3.18Å; I151-V154 PolarHBondContact O-N 2.91Å; V154-R156 PolarHBondContact O-N 3.05Å; V154-Y157 WeakPolarHBondContact O-CB 3.44Å; V154-Y157 PolarHBondContact O-N 3.33Å; V154-V158 HydrophobicContact CG1-CG2 4.43Å; V154-V158 VanDerWaalsContact O-CG2 3.31Å; V154-V158 WeakPolarHBondContact O-CG2 3.46Å; V154-V158 PolarHBondContact O-N 3.45Å; V154-V170 HydrophobicContact CG1-CG1 4.07Å; V154-V170 HydrophobicContact CG2-CG1 4.38Å; V154-L171 HydrophobicContact CG1-CD1 4Å |
| 155 | L | 94.4 | Very high | 92.1 | Very high | 2 Ų | 2 | 58.8 Ų | 58.8 | 1% | 0.01 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -63.6 | -40.1 | -179.9 | -69.4 | 177 | 0 | 0 | 0 | 112.3 | V83 Y86 H87 L117 V120 I151 Y152 V158 N159 | V83-L155 HydrophobicContact CG2-CD1 3.91Å; Y86-L155 HydrophobicContact CD1-CB 4.19Å; Y86-L155 HydrophobicContact CD1-CD1 3.6Å; Y86-L155 HydrophobicContact CE1-CB 3.83Å; Y86-L155 HydrophobicContact CE1-CD1 4.13Å; H87-L155 HydrophobicContact CB-CD1 3.98Å; H87-L155 HydrophobicContact CB-CD2 4.26Å; L117-L155 HydrophobicContact CD2-CD2 3.57Å; V120-L155 HydrophobicContact CG1-CD2 4.43Å; I151-L155 HydrophobicContact CG2-CD1 3.74Å; I151-L155 HydrophobicContact CG2-CG 4.1Å; I151-L155 WeakPolarHBondContact O-CB 3.18Å; I151-L155 VanDerWaalsContact O-CG 3.25Å; I151-L155 WeakPolarHBondContact O-CG 3.36Å; I151-L155 PolarHBondContact O-N 2.91Å; Y152-L155 PolarHBondContact O-N 3.13Å; L155-V158 PolarHBondContact O-N 3.27Å; L155-N159 WeakPolarHBondContact O-CB 3.35Å; L155-N159 PolarHBondContact O-N 3.35Å |
| 156 | R | 94.1 | Very high | 91.8 | Very high | 188 Ų | 188 | 67.2 Ų | 67.2 | 71% | 0.709 | 31% | 0.305 | S | S | * | . | H | α-helix | trans | -66.7 | -40.3 | 174.7 | -178.2 | 177.9 | -90.3 | 168.8 | -6.1 | 111.4 | Y152 R153 V154 N159 S160 | Y152-R156 VanDerWaalsContact O-CB 3.27Å; Y152-R156 WeakPolarHBondContact O-CB 3.25Å; Y152-R156 PolarHBondContact O-N 2.98Å; R153-R156 PolarHBondContact O-N 3.02Å; V154-R156 PolarHBondContact O-N 3.05Å; R156-N159 PolarHBondContact O-N 2.99Å; R156-S160 WeakPolarHBondContact O-CB 3.13Å; R156-S160 PolarHBondContact O-N 3.42Å; R156-S160 PolarHBondContact O-OG 3.16Å |
| 157 | Y | 93.1 | Very high | 91.5 | Very high | 65 Ų | 65 | 63.9 Ų | 63.9 | 26% | 0.255 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -60.3 | -46.4 | 175.4 | 174.2 | -99.1 | 0 | 0 | 0 | 111.8 | R153 V154 N159 S160 T161 P164 Q165 V170 | R153-Y157 WeakPolarHBondContact O-CB 3.37Å; R153-Y157 PolarHBondContact O-N 3.5Å; V154-Y157 WeakPolarHBondContact O-CB 3.44Å; V154-Y157 PolarHBondContact O-N 3.33Å; Y157-N159 PolarHBondContact O-N 2.96Å; Y157-S160 PolarHBondContact O-N 2.96Å; Y157-T161 HydrophobicContact CE2-CG2 4.44Å; Y157-T161 WeakPolarHBondContact CE2-OG1 3.43Å; Y157-T161 WeakPolarHBondContact O-CB 3.3Å; Y157-T161 PolarHBondContact O-N 3.11Å; Y157-T161 PolarHBondContact O-OG1 2.86Å; Y157-P164 HydrophobicContact CE1-CB 3.94Å; Y157-Q165 PolarHBondContact OH-N 3.36Å; Y157-V170 HydrophobicContact CD1-CG1 3.72Å; Y157-V170 HydrophobicContact CD1-CG2 4.33Å; Y157-V170 HydrophobicContact CE1-CG1 3.96Å; Y157-V170 HydrophobicContact CE1-CG2 3.69Å |
| 158 | V | 91.8 | Very high | 91.1 | Very high | 6 Ų | 6 | 67.8 Ų | 67.8 | 4% | 0.036 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -61.8 | -42.8 | 177.4 | 174 | 0 | 0 | 0 | 0 | 111.4 | H113 I116 L117 V154 L155 | H113-V158 HydrophobicContact CB-CG1 4.09Å; H113-V158 PolarHBondContact CD2-O 3.24Å; H113-V158 PolarHBondContact NE2-O 2.97Å; I116-V158 HydrophobicContact CB-CG2 4.18Å; I116-V158 HydrophobicContact CD1-CG2 4.39Å; I116-V158 HydrophobicContact CG2-CG2 3.38Å; L117-V158 HydrophobicContact CD1-CG1 4.38Å; L117-V158 HydrophobicContact CD2-CG1 4.33Å; L117-V158 HydrophobicContact CG-CG1 4.18Å; V154-V158 HydrophobicContact CG1-CG2 4.43Å; V154-V158 VanDerWaalsContact O-CG2 3.31Å; V154-V158 WeakPolarHBondContact O-CG2 3.46Å; V154-V158 PolarHBondContact O-N 3.45Å; L155-V158 PolarHBondContact O-N 3.27Å |
| 159 | N | 89.5 | Confident | 90.9 | Very high | 101 Ų | 101 | 72.2 Ų | 72.2 | 54% | 0.54 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -74 | -26.9 | -177.5 | -159.3 | 29.6 | 0 | 0 | 0 | 113.3 | L155 R156 Y157 | L155-N159 WeakPolarHBondContact O-CB 3.35Å; L155-N159 PolarHBondContact O-N 3.35Å; R156-N159 PolarHBondContact O-N 2.99Å; Y157-N159 PolarHBondContact O-N 2.96Å |
| 160 | S | 90.6 | Very high | 90.7 | Very high | 90 Ų | 90 | 70.7 Ų | 70.7 | 63% | 0.629 | 33% | 0.326 | S | S | * | . | H | α-helix | trans | -92.5 | -21.5 | -177.2 | -48.6 | 0 | 0 | 0 | 0 | 113.1 | R156 Y157 | R156-S160 WeakPolarHBondContact O-CB 3.13Å; R156-S160 PolarHBondContact O-N 3.42Å; R156-S160 PolarHBondContact O-OG 3.16Å; Y157-S160 PolarHBondContact O-N 2.96Å |
| 161 | T | 88.9 | Confident | 90.6 | Very high | 39 Ų | 39 | 69.8 Ų | 69.8 | 24% | 0.239 | 32% | 0.322 | C | S | . | . | trans | -100.5 | 125.6 | -172.5 | -53.7 | 0 | 0 | 0 | 0 | 111.2 | H113 Y157 | H113-T161 PolarHBondContact NE2-O 3.49Å; Y157-T161 HydrophobicContact CE2-CG2 4.44Å; Y157-T161 WeakPolarHBondContact CE2-OG1 3.43Å; Y157-T161 WeakPolarHBondContact O-CB 3.3Å; Y157-T161 PolarHBondContact O-N 3.11Å; Y157-T161 PolarHBondContact O-OG1 2.86Å | ||
| 162 | R | 81.1 | Confident | 90.6 | Very high | 238 Ų | 238 | 74 Ų | 74 | 90% | 0.898 | 34% | 0.342 | S | S | * | . | S | Bend | trans | -76 | -23.9 | 178.2 | -66.2 | -172.3 | 179.9 | -167.8 | 0.9 | 114.2 | H113 | H113-R162 PolarHBondContact CE1-O 3.3Š|
| 163 | A | 81.3 | Confident | 90.5 | Very high | 60 Ų | 60 | 74.7 Ų | 74.7 | 50% | 0.496 | 35% | 0.347 | S | S | . | . | S | Bend | trans | -138.3 | 78.4 | -179.7 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||
| 164 | P | 84.5 | Confident | 90.6 | Very high | 0 Ų | 0 | 69.2 Ų | 69.2 | 0% | 0 | 33% | 0.327 | C | S | . | . | P | Polyproline II helix | trans | -67.3 | 151.9 | -176.3 | 27.2 | -33.9 | 0 | 0 | 0 | 111.8 | R112 H113 I116 Y157 | R112-P164 HydrophobicContact CB-CG 4.05Å; R112-P164 PolarHBondContact NH1-O 2.94Å; H113-P164 WeakPolarHBondContact CE1-CD 3.3Å; I116-P164 HydrophobicContact CD1-CB 3.55Å; I116-P164 HydrophobicContact CD1-CG 3.78Å; Y157-P164 HydrophobicContact CE1-CB 3.94Å |
| 165 | Q | 88.5 | Confident | 90.6 | Very high | 109 Ų | 109 | 72.7 Ų | 72.7 | 51% | 0.509 | 34% | 0.34 | S | S | . | . | P | Polyproline II helix | trans | -62 | 172.5 | 170.8 | -80.6 | -179 | -25.3 | 0 | 0 | 111.9 | Y157 E169 V170 | Y157-Q165 PolarHBondContact OH-N 3.36Å; Q165-E169 WeakPolarHBondContact CB-OE2 3.38Å; Q165-V170 HydrophobicContact CB-CG2 3.86Å |
| 166 | R | 87.1 | Confident | 90.7 | Very high | 177 Ų | 177 | 76 Ų | 76 | 67% | 0.668 | 36% | 0.357 | S | S | * | . | P | Polyproline II helix | trans | -62.6 | 145.2 | 179.8 | -71.7 | -178.8 | 174.7 | -168.5 | 2.8 | 110.1 | H168 E169 V170 | R166-H168 VanDerWaalsContact CB-CE1 3.48Å; R166-H168 WeakPolarHBondContact CB-CE1 3.38Å; R166-H168 WeakPolarHBondContact CB-ND1 3.44Å; R166-H168 PolarHBondContact O-N 3.42Å; R166-H168 VanDerWaalsContact O-N 3.07Å; R166-E169 PolarHBondContact O-N 2.77Å; R166-V170 PolarHBondContact O-N 3.2Å |
| 167 | A | 88.8 | Confident | 90.8 | Very high | 24 Ų | 24 | 67.9 Ų | 67.9 | 20% | 0.198 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -57.6 | -30.2 | -174.2 | 0 | 0 | 0 | 0 | 0 | 114.2 | I116 L171 | I116-A167 HydrophobicContact CG1-CB 3.73Å; A167-L171 VanDerWaalsContact O-CB 3.27Å; A167-L171 WeakPolarHBondContact O-CB 3.26Å; A167-L171 WeakPolarHBondContact O-CD1 3.25Å; A167-L171 PolarHBondContact O-N 3.36Å; A167-L171 VanDerWaalsContact O-N 3.07Å |
| 168 | H | 88.6 | Confident | 90.9 | Very high | 85 Ų | 85 | 64.8 Ų | 64.8 | 39% | 0.394 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -69.6 | -36.4 | 178 | 70.5 | -82.6 | 0 | 0 | 0 | 112.9 | R166 Q172 | R166-H168 VanDerWaalsContact CB-CE1 3.48Å; R166-H168 WeakPolarHBondContact CB-CE1 3.38Å; R166-H168 WeakPolarHBondContact CB-ND1 3.44Å; R166-H168 PolarHBondContact O-N 3.42Å; R166-H168 VanDerWaalsContact O-N 3.07Å; H168-Q172 WeakPolarHBondContact O-CB 3.49Å; H168-Q172 PolarHBondContact O-N 3.18Å |
| 169 | E | 90.9 | Very high | 91.1 | Very high | 92 Ų | 92 | 67 Ų | 67 | 43% | 0.43 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -68.3 | -46 | 177.2 | -65.9 | 162.8 | -152 | 0 | 0 | 110.5 | Q165 R166 L171 | Q165-E169 WeakPolarHBondContact CB-OE2 3.38Å; R166-E169 PolarHBondContact O-N 2.77Å; E169-L171 PolarHBondContact O-N 3.46Å |
| 170 | V | 91.8 | Very high | 91.4 | Very high | 9 Ų | 9 | 68.4 Ų | 68.4 | 6% | 0.055 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -69.4 | -36.1 | -176.4 | -177.8 | 0 | 0 | 0 | 0 | 112 | I116 R153 V154 Y157 Q165 R166 | I116-V170 HydrophobicContact CD1-CG2 4.47Å; R153-V170 PolarHBondContact NH2-O 3.15Å; V154-V170 HydrophobicContact CG1-CG1 4.07Å; V154-V170 HydrophobicContact CG2-CG1 4.38Å; Y157-V170 HydrophobicContact CD1-CG1 3.72Å; Y157-V170 HydrophobicContact CD1-CG2 4.33Å; Y157-V170 HydrophobicContact CE1-CG1 3.96Å; Y157-V170 HydrophobicContact CE1-CG2 3.69Å; Q165-V170 HydrophobicContact CB-CG2 3.86Å; R166-V170 PolarHBondContact O-N 3.2Å |
| 171 | L | 94.5 | Very high | 91.7 | Very high | 1 Ų | 1 | 65 Ų | 65 | 1% | 0.005 | 31% | 0.313 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -95.6 | 3.2 | -175.7 | -84 | 69.4 | 0 | 0 | 0 | 113.7 | I116 A119 V120 V154 A167 E169 E173 L174 R175 | I116-L171 HydrophobicContact CG2-CD1 3.66Å; A119-L171 HydrophobicContact CB-CD2 3.4Å; A119-L171 VanDerWaalsContact CB-CD2 3.4Å; V120-L171 HydrophobicContact CG2-CD1 4.2Å; V120-L171 HydrophobicContact CG2-CD2 3.97Å; V120-L171 HydrophobicContact CG2-CG 4.22Å; V154-L171 HydrophobicContact CG1-CD1 4Å; A167-L171 VanDerWaalsContact O-CB 3.27Å; A167-L171 WeakPolarHBondContact O-CB 3.26Å; A167-L171 WeakPolarHBondContact O-CD1 3.25Å; A167-L171 PolarHBondContact O-N 3.36Å; A167-L171 VanDerWaalsContact O-N 3.07Å; E169-L171 PolarHBondContact O-N 3.46Å; L171-E173 PolarHBondContact O-N 3.07Å; L171-L174 HydrophobicContact CG-CD2 4.33Å; L171-L174 PolarHBondContact O-N 3.47Å; L171-R175 HydrophobicContact CB-CG 4.31Å; L171-R175 WeakPolarHBondContact O-CB 3.45Å; L171-R175 WeakPolarHBondContact O-CG 3.31Å; L171-R175 PolarHBondContact O-N 3.38Å |
| 172 | Q | 95.4 | Very high | 92 | Very high | 88 Ų | 88 | 64.4 Ų | 64.4 | 41% | 0.411 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -55.4 | -57.9 | -174.2 | -173.1 | 58.1 | 43.1 | 0 | 0 | 111.4 | H168 L174 R175 D176 | H168-Q172 WeakPolarHBondContact O-CB 3.49Å; H168-Q172 PolarHBondContact O-N 3.18Å; Q172-L174 VanDerWaalsContact C-N 3.34Å; Q172-L174 PolarHBondContact O-N 2.94Å; Q172-R175 WeakPolarHBondContact O-CB 3.45Å; Q172-R175 PolarHBondContact O-N 3.04Å; Q172-R175 VanDerWaalsContact O-N 3.11Å; Q172-D176 VanDerWaalsContact NE2-CG 3.32Å; Q172-D176 PolarHBondContact NE2-OD1 3.05Å; Q172-D176 PolarHBondContact NE2-OD2 3.45Å; Q172-D176 VanDerWaalsContact O-CG 3.26Å; Q172-D176 PolarHBondContact O-N 3.23Å |
| 173 | E | 95.6 | Very high | 92.7 | Very high | 80 Ų | 80 | 58.4 Ų | 58.4 | 37% | 0.374 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -56.5 | -47.4 | 177.6 | -178.4 | 70.8 | -172.6 | 0 | 0 | 111.1 | K146 E150 L171 R175 D176 I177 | K146-E173 IonicContact NZ-OE1 3.52Å; K146-E173 PolarHBondContact NZ-OE1 3.3Å; E150-E173 HydrophobicContact CG-CB 4.5Å; E150-E173 HydrophobicContact CG-CG 4.16Å; L171-E173 PolarHBondContact O-N 3.07Å; E173-R175 VanDerWaalsContact C-N 3.28Å; E173-R175 PolarHBondContact O-N 3.26Å; E173-D176 PolarHBondContact O-N 3.45Å; E173-D176 VanDerWaalsContact O-N 3.13Å; E173-I177 HydrophobicContact CG-CG2 4.31Å; E173-I177 VanDerWaalsContact O-CG1 3.3Å; E173-I177 WeakPolarHBondContact O-CG1 3.4Å; E173-I177 PolarHBondContact O-N 3.24Å; E173-I177 WeakPolarHBondContact OE1-CG2 3.4Å |
| 174 | L | 96.2 | Very high | 93.3 | Very high | 0 Ų | 0 | 62 Ų | 62 | 0% | 0 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -56.1 | -42 | 178.5 | -179.6 | 58.1 | 0 | 0 | 0 | 112.4 | V120 R123 V147 E150 I151 L171 Q172 S178 | V120-L174 HydrophobicContact CG2-CD2 4.25Å; R123-L174 HydrophobicContact CG-CD2 4.44Å; R123-L174 HydrophobicContact CG-CG 4.47Å; V147-L174 HydrophobicContact CG1-CD1 4.14Å; E150-L174 HydrophobicContact CB-CD1 4.3Å; E150-L174 HydrophobicContact CG-CB 3.83Å; E150-L174 HydrophobicContact CG-CD1 4.09Å; I151-L174 HydrophobicContact CD1-CD1 4.36Å; I151-L174 HydrophobicContact CG1-CD1 3.5Å; I151-L174 HydrophobicContact CG1-CD2 4.13Å; I151-L174 HydrophobicContact CG1-CG 4.49Å; L171-L174 HydrophobicContact CG-CD2 4.33Å; L171-L174 PolarHBondContact O-N 3.47Å; Q172-L174 VanDerWaalsContact C-N 3.34Å; Q172-L174 PolarHBondContact O-N 2.94Å; L174-S178 WeakPolarHBondContact O-CB 3.26Å; L174-S178 PolarHBondContact O-N 3.36Å; L174-S178 VanDerWaalsContact O-N 3.07Å; L174-S178 PolarHBondContact O-OG 3.13Å |
| 175 | R | 95.7 | Very high | 93.7 | Very high | 73 Ų | 73 | 62.1 Ų | 62.1 | 28% | 0.275 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -67.2 | -44.7 | 178.6 | -69.9 | 171.1 | -172.3 | -169.2 | 3.7 | 110.6 | L171 Q172 E173 S178 S179 | L171-R175 HydrophobicContact CB-CG 4.31Å; L171-R175 WeakPolarHBondContact O-CB 3.45Å; L171-R175 WeakPolarHBondContact O-CG 3.31Å; L171-R175 PolarHBondContact O-N 3.38Å; Q172-R175 WeakPolarHBondContact O-CB 3.45Å; Q172-R175 PolarHBondContact O-N 3.04Å; Q172-R175 VanDerWaalsContact O-N 3.11Å; E173-R175 VanDerWaalsContact C-N 3.28Å; E173-R175 PolarHBondContact O-N 3.26Å; R175-S178 PolarHBondContact O-N 2.68Å; R175-S179 WeakPolarHBondContact O-CB 3.43Å; R175-S179 PolarHBondContact O-N 2.93Å; R175-S179 PolarHBondContact O-OG 2.84Å |
| 176 | D | 96.3 | Very high | 93.9 | Very high | 70 Ų | 70 | 60.9 Ų | 60.9 | 37% | 0.374 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -65.6 | -53.4 | -175.6 | -64.3 | -19.6 | 0 | 0 | 0 | 109.9 | Q172 E173 S178 S179 M180 | Q172-D176 VanDerWaalsContact NE2-CG 3.32Å; Q172-D176 PolarHBondContact NE2-OD1 3.05Å; Q172-D176 PolarHBondContact NE2-OD2 3.45Å; Q172-D176 VanDerWaalsContact O-CG 3.26Å; Q172-D176 PolarHBondContact O-N 3.23Å; E173-D176 PolarHBondContact O-N 3.45Å; E173-D176 VanDerWaalsContact O-N 3.13Å; D176-S178 VanDerWaalsContact C-N 3.32Å; D176-S178 PolarHBondContact O-N 3.48Å; D176-S179 PolarHBondContact O-N 3.33Å; D176-M180 VanDerWaalsContact O-CG 3.32Å; D176-M180 WeakPolarHBondContact O-CG 3.4Å; D176-M180 PolarHBondContact O-N 3.02Å |
| 177 | I | 96.1 | Very high | 94.2 | Very high | 18 Ų | 18 | 57.7 Ų | 57.7 | 9% | 0.092 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -65.9 | -33.3 | 179.3 | 69.3 | 177.3 | 0 | 0 | 0 | 112.8 | K146 V147 E150 E173 A181 | K146-I177 HydrophobicContact CD-CG2 4.45Å; K146-I177 HydrophobicContact CG-CD1 4.21Å; V147-I177 HydrophobicContact CB-CD1 4.44Å; V147-I177 HydrophobicContact CG2-CD1 4.16Å; V147-I177 HydrophobicContact CG2-CG1 4.02Å; E150-I177 HydrophobicContact CB-CD1 3.48Å; E150-I177 VanDerWaalsContact CB-CD1 3.48Å; E150-I177 HydrophobicContact CG-CD1 3.74Å; E173-I177 HydrophobicContact CG-CG2 4.31Å; E173-I177 VanDerWaalsContact O-CG1 3.3Å; E173-I177 WeakPolarHBondContact O-CG1 3.4Å; E173-I177 PolarHBondContact O-N 3.24Å; E173-I177 WeakPolarHBondContact OE1-CG2 3.4Å; I177-A181 WeakPolarHBondContact O-CB 3.49Å; I177-A181 PolarHBondContact O-N 3.3Å |
| 178 | S | 96.2 | Very high | 94.4 | Very high | 0 Ų | 0 | 61.9 Ų | 61.9 | 0% | 0 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -67.1 | -43.5 | 175.7 | -63.3 | 0 | 0 | 0 | 0 | 110.8 | L174 R175 D176 A181 M182 | L174-S178 WeakPolarHBondContact O-CB 3.26Å; L174-S178 PolarHBondContact O-N 3.36Å; L174-S178 VanDerWaalsContact O-N 3.07Å; L174-S178 PolarHBondContact O-OG 3.13Å; R175-S178 PolarHBondContact O-N 2.68Å; D176-S178 VanDerWaalsContact C-N 3.32Å; D176-S178 PolarHBondContact O-N 3.48Å; S178-A181 PolarHBondContact O-N 3.29Å; S178-M182 WeakPolarHBondContact O-CE 2.9Å; S178-M182 VanDerWaalsContact O-CG 3.28Å; S178-M182 WeakPolarHBondContact O-CG 3.2Å; S178-M182 PolarHBondContact O-N 3.49Å |
| 179 | S | 95.8 | Very high | 94.5 | Very high | 54 Ų | 54 | 59.4 Ų | 59.4 | 38% | 0.378 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -66 | -47.7 | -179.6 | -53.3 | 0 | 0 | 0 | 0 | 110.6 | R175 D176 A181 M182 E183 | R175-S179 WeakPolarHBondContact O-CB 3.43Å; R175-S179 PolarHBondContact O-N 2.93Å; R175-S179 PolarHBondContact O-OG 2.84Å; D176-S179 PolarHBondContact O-N 3.33Å; S179-A181 VanDerWaalsContact C-N 3.28Å; S179-A181 PolarHBondContact O-N 2.85Å; S179-M182 PolarHBondContact O-N 3.26Å; S179-E183 WeakPolarHBondContact O-CB 3.48Å; S179-E183 PolarHBondContact O-N 3.19Å |
| 180 | M | 96.4 | Very high | 94.4 | Very high | 129 Ų | 129 | 55.4 Ų | 55.4 | 64% | 0.635 | 27% | 0.268 | S | S | * | . | H | α-helix | trans | -57.5 | -41.7 | 174.7 | -70.6 | -179.6 | 70 | 0 | 0 | 112.2 | D176 Y184 | D176-M180 VanDerWaalsContact O-CG 3.32Å; D176-M180 WeakPolarHBondContact O-CG 3.4Å; D176-M180 PolarHBondContact O-N 3.02Å; M180-Y184 VanDerWaalsContact O-CB 3.25Å; M180-Y184 WeakPolarHBondContact O-CB 3.33Å; M180-Y184 PolarHBondContact O-N 3.48Å |
| 181 | A | 95.1 | Very high | 94.4 | Very high | 18 Ų | 18 | 57.5 Ų | 57.5 | 15% | 0.149 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -65.3 | -42.5 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | F131 P144 V147 I177 S178 S179 F185 | F131-A181 HydrophobicContact CZ-CB 4.41Å; P144-A181 HydrophobicContact CB-CB 3.8Å; P144-A181 HydrophobicContact CG-CB 3.68Å; V147-A181 HydrophobicContact CG2-CB 4.23Å; I177-A181 WeakPolarHBondContact O-CB 3.49Å; I177-A181 PolarHBondContact O-N 3.3Å; S178-A181 PolarHBondContact O-N 3.29Å; S179-A181 VanDerWaalsContact C-N 3.28Å; S179-A181 PolarHBondContact O-N 2.85Å; A181-F185 VanDerWaalsContact O-CB 3.24Å; A181-F185 WeakPolarHBondContact O-CB 3.36Å; A181-F185 PolarHBondContact O-N 3.28Å |
| 182 | M | 95.8 | Very high | 94.1 | Very high | 28 Ų | 28 | 62 Ų | 62 | 14% | 0.138 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -67.1 | -45.4 | 177.9 | -68.6 | -177.7 | -68.6 | 0 | 0 | 111.4 | L126 L127 T130 F131 S178 S179 F185 D186 | L126-M182 HydrophobicContact CB-SD 4.02Å; L127-M182 HydrophobicContact CD2-CG 4.08Å; L127-M182 HydrophobicContact CD2-SD 4.32Å; T130-M182 HydrophobicContact CG2-CB 4.23Å; T130-M182 HydrophobicContact CG2-CG 4Å; F131-M182 HydrophobicContact CE2-CG 4.15Å; S178-M182 WeakPolarHBondContact O-CE 2.9Å; S178-M182 VanDerWaalsContact O-CG 3.28Å; S178-M182 WeakPolarHBondContact O-CG 3.2Å; S178-M182 PolarHBondContact O-N 3.49Å; S179-M182 PolarHBondContact O-N 3.26Å; M182-F185 WeakPolarHBondContact O-CB 3.22Å; M182-F185 PolarHBondContact O-N 3.47Å; M182-D186 PolarHBondContact O-N 3.07Å |
| 183 | E | 95.3 | Very high | 93.7 | Very high | 112 Ų | 112 | 59 Ų | 59 | 52% | 0.523 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -60.7 | -50.3 | 177.8 | -176.7 | 178.5 | -178.8 | 0 | 0 | 111.3 | S179 F185 D186 E187 | S179-E183 WeakPolarHBondContact O-CB 3.48Å; S179-E183 PolarHBondContact O-N 3.19Å; E183-F185 VanDerWaalsContact C-N 3.25Å; E183-F185 PolarHBondContact O-N 2.93Å; E183-D186 PolarHBondContact O-N 3.07Å; E183-E187 HydrophobicContact CG-CG 4.45Å; E183-E187 WeakPolarHBondContact O-CB 3.27Å; E183-E187 WeakPolarHBondContact O-CG 3.12Å; E183-E187 PolarHBondContact O-N 2.63Å |
| 184 | Y | 93.9 | Very high | 93.1 | Very high | 135 Ų | 135 | 61 Ų | 61 | 53% | 0.529 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -59 | -39.5 | 176.7 | -178 | -94.2 | 0 | 0 | 0 | 112.2 | M180 K188 I189 | M180-Y184 VanDerWaalsContact O-CB 3.25Å; M180-Y184 WeakPolarHBondContact O-CB 3.33Å; M180-Y184 PolarHBondContact O-N 3.48Å; Y184-K188 HydrophobicContact CD2-CB 4.33Å; Y184-K188 HydrophobicContact CD2-CG 3.77Å; Y184-K188 HydrophobicContact CE1-CB 4.31Å; Y184-K188 HydrophobicContact CE2-CB 4.03Å; Y184-K188 HydrophobicContact CE2-CG 3.63Å; Y184-K188 HydrophobicContact CG-CG 4.41Å; Y184-K188 WeakPolarHBondContact O-CB 3.22Å; Y184-K188 PolarHBondContact O-N 3.34Å; Y184-I189 HydrophobicContact CD1-CG1 4.23Å; Y184-I189 HydrophobicContact CE1-CD1 3.91Å; Y184-I189 HydrophobicContact CE1-CG1 3.99Å |
| 185 | F | 94.1 | Very high | 92.4 | Very high | 2 Ų | 2 | 69.4 Ų | 69.4 | 1% | 0.009 | 34% | 0.335 | C | S | . | . | I | π-helix | trans | -64 | -49 | 178 | -177.5 | -103 | 0 | 0 | 0 | 111.7 | T130 F131 Y134 I143 A181 M182 E183 I189 V190 L193 | T130-F185 HydrophobicContact CG2-CD1 3.75Å; T130-F185 HydrophobicContact CG2-CE1 4.29Å; F131-F185 HydrophobicContact CD1-CD1 4.14Å; F131-F185 AromaticContact CD1-CD2 3.84Å; F131-F185 HydrophobicContact CD1-CD2 3.84Å; F131-F185 HydrophobicContact CD1-CE1 4.21Å; F131-F185 AromaticContact CD1-CE2 3.94Å; F131-F185 HydrophobicContact CD1-CE2 3.94Å; F131-F185 AromaticContact CD1-CG 3.94Å; F131-F185 HydrophobicContact CD1-CG 3.94Å; F131-F185 HydrophobicContact CD1-CZ 4.12Å; F131-F185 HydrophobicContact CE1-CB 3.62Å; F131-F185 AromaticContact CE1-CD1 3.94Å; F131-F185 HydrophobicContact CE1-CD1 3.94Å; F131-F185 AromaticContact CE1-CD2 3.47Å; F131-F185 HydrophobicContact CE1-CD2 3.47Å; F131-F185 VanDerWaalsContact CE1-CD2 3.47Å; F131-F185 HydrophobicContact CE1-CE1 4.45Å; F131-F185 HydrophobicContact CE1-CE2 4.07Å; F131-F185 AromaticContact CE1-CG 3.39Å; F131-F185 HydrophobicContact CE1-CG 3.39Å; F131-F185 HydrophobicContact CZ-CB 3.99Å; F131-F185 HydrophobicContact CZ-CG 4.19Å; Y134-F185 AromaticContact CD2-CE1 3.45Å; Y134-F185 HydrophobicContact CD2-CE1 3.45Å; Y134-F185 VanDerWaalsContact CD2-CE1 3.45Å; Y134-F185 AromaticContact CD2-CZ 3.37Å; Y134-F185 HydrophobicContact CD2-CZ 3.37Å; Y134-F185 AromaticContact CE2-CE1 3.46Å; Y134-F185 HydrophobicContact CE2-CE1 3.46Å; Y134-F185 VanDerWaalsContact CE2-CE1 3.46Å; Y134-F185 AromaticContact CE2-CZ 3.8Å; Y134-F185 HydrophobicContact CE2-CZ 3.8Å; Y134-F185 HydrophobicContact CG-CE1 4.32Å; Y134-F185 AromaticContact CG-CZ 3.82Å; Y134-F185 HydrophobicContact CG-CZ 3.82Å; I143-F185 HydrophobicContact CD1-CD2 4.27Å; I143-F185 HydrophobicContact CD1-CE2 4.45Å; A181-F185 VanDerWaalsContact O-CB 3.24Å; A181-F185 WeakPolarHBondContact O-CB 3.36Å; A181-F185 PolarHBondContact O-N 3.28Å; M182-F185 WeakPolarHBondContact O-CB 3.22Å; M182-F185 PolarHBondContact O-N 3.47Å; E183-F185 VanDerWaalsContact C-N 3.25Å; E183-F185 PolarHBondContact O-N 2.93Å; F185-I189 HydrophobicContact CD2-CB 3.67Å; F185-I189 HydrophobicContact CD2-CG1 4.08Å; F185-I189 HydrophobicContact CD2-CG2 3.76Å; F185-I189 HydrophobicContact CE2-CB 4.04Å; F185-I189 HydrophobicContact CE2-CG2 3.62Å; F185-I189 HydrophobicContact CG-CB 4.36Å; F185-I189 WeakPolarHBondContact O-CA 3.32Å; F185-I189 WeakPolarHBondContact O-CB 3.35Å; F185-I189 PolarHBondContact O-N 3.13Å; F185-V190 HydrophobicContact CD1-CG2 3.73Å; F185-V190 HydrophobicContact CE1-CG2 3.52Å; F185-V190 HydrophobicContact CG-CG2 4.49Å; F185-V190 HydrophobicContact CZ-CG2 4.11Å; F185-V190 WeakPolarHBondContact O-CG2 3.38Å; F185-V190 PolarHBondContact O-N 2.91Å; F185-L193 HydrophobicContact CE2-CD1 4.45Å; F185-L193 HydrophobicContact CZ-CD1 4.35Å |
| 186 | D | 92.5 | Very high | 91.1 | Very high | 84 Ų | 84 | 74 Ų | 74 | 45% | 0.449 | 36% | 0.357 | S | S | . | . | I | π-helix | trans | -67 | -37.2 | -179.4 | -77.8 | -20.8 | 0 | 0 | 0 | 112.6 | M182 E183 P191 | M182-D186 PolarHBondContact O-N 3.07Å; E183-D186 PolarHBondContact O-N 3.07Å; D186-P191 WeakPolarHBondContact O-CD 3.46Å |
| 187 | E | 93.8 | Very high | 89.4 | Confident | 110 Ų | 110 | 73.6 Ų | 73.6 | 51% | 0.514 | 35% | 0.354 | S | S | . | . | I | π-helix | trans | -81.4 | -40.5 | -178.3 | -70.2 | -166.3 | 162.8 | 0 | 0 | 114.2 | E183 P191 | E183-E187 HydrophobicContact CG-CG 4.45Å; E183-E187 WeakPolarHBondContact O-CB 3.27Å; E183-E187 WeakPolarHBondContact O-CG 3.12Å; E183-E187 PolarHBondContact O-N 2.63Å; E187-P191 WeakPolarHBondContact O-CG 3.48Å |
| 188 | K | 91.7 | Very high | 87.3 | Confident | 111 Ų | 111 | 78.8 Ų | 78.8 | 48% | 0.483 | 39% | 0.389 | S | S | . | . | I | π-helix | trans | -107.2 | -38.3 | -169.5 | -54.3 | -57.1 | 180 | -170.8 | 0 | 112.5 | Y184 I192 | Y184-K188 HydrophobicContact CD2-CB 4.33Å; Y184-K188 HydrophobicContact CD2-CG 3.77Å; Y184-K188 HydrophobicContact CE1-CB 4.31Å; Y184-K188 HydrophobicContact CE2-CB 4.03Å; Y184-K188 HydrophobicContact CE2-CG 3.63Å; Y184-K188 HydrophobicContact CG-CG 4.41Å; Y184-K188 WeakPolarHBondContact O-CB 3.22Å; Y184-K188 PolarHBondContact O-N 3.34Å; K188-I192 WeakPolarHBondContact O-CD1 3.48Å; K188-I192 VanDerWaalsContact O-CG1 3.3Å; K188-I192 WeakPolarHBondContact O-CG1 3.47Å |
| 189 | I | 90.8 | Very high | 85.3 | Confident | 33 Ų | 33 | 82.6 Ų | 82.6 | 17% | 0.169 | 43% | 0.429 | C | S | . | . | I | π-helix | trans | -91.6 | -49.2 | -171.3 | -53.8 | -58.2 | 0 | 0 | 0 | 111.4 | I143 Y184 F185 I192 L193 | I143-I189 HydrophobicContact CD1-CG1 4.29Å; I143-I189 HydrophobicContact CD1-CG2 4.3Å; Y184-I189 HydrophobicContact CD1-CG1 4.23Å; Y184-I189 HydrophobicContact CE1-CD1 3.91Å; Y184-I189 HydrophobicContact CE1-CG1 3.99Å; F185-I189 HydrophobicContact CD2-CB 3.67Å; F185-I189 HydrophobicContact CD2-CG1 4.08Å; F185-I189 HydrophobicContact CD2-CG2 3.76Å; F185-I189 HydrophobicContact CE2-CB 4.04Å; F185-I189 HydrophobicContact CE2-CG2 3.62Å; F185-I189 HydrophobicContact CG-CB 4.36Å; F185-I189 WeakPolarHBondContact O-CA 3.32Å; F185-I189 WeakPolarHBondContact O-CB 3.35Å; F185-I189 PolarHBondContact O-N 3.13Å; I189-I192 WeakPolarHBondContact O-CB 3.35Å; I189-I192 PolarHBondContact O-N 3.09Å; I189-L193 HydrophobicContact CG2-CD1 3.9Å; I189-L193 HydrophobicContact CG2-CG 4.07Å; I189-L193 WeakPolarHBondContact O-CG 3.41Å; I189-L193 PolarHBondContact O-N 3.12Å |
| 190 | V | 90.4 | Very high | 83.2 | Confident | 9 Ų | 9 | 84.1 Ų | 84.1 | 6% | 0.055 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -54.8 | -42.5 | -178.7 | 170.5 | 0 | 0 | 0 | 0 | 112.8 | Y134 F185 I192 L193 K194 | Y134-V190 HydrophobicContact CE2-CG2 3.99Å; Y134-V190 WeakPolarHBondContact OH-CG1 3.17Å; F185-V190 HydrophobicContact CD1-CG2 3.73Å; F185-V190 HydrophobicContact CE1-CG2 3.52Å; F185-V190 HydrophobicContact CG-CG2 4.49Å; F185-V190 HydrophobicContact CZ-CG2 4.11Å; F185-V190 WeakPolarHBondContact O-CG2 3.38Å; F185-V190 PolarHBondContact O-N 2.91Å; V190-I192 VanDerWaalsContact C-N 3.32Å; V190-I192 PolarHBondContact O-N 2.98Å; V190-L193 PolarHBondContact O-N 3.34Å; V190-K194 HydrophobicContact CG1-CD 3.99Å; V190-K194 HydrophobicContact CG1-CG 4.32Å; V190-K194 WeakPolarHBondContact O-CB 3.28Å; V190-K194 WeakPolarHBondContact O-CG 3.41Å; V190-K194 PolarHBondContact O-N 2.81Å |
| 191 | P | 90.2 | Very high | 80.9 | Confident | 52 Ų | 52 | 84.5 Ų | 84.5 | 34% | 0.338 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -63.9 | -35.6 | 177.5 | -25.3 | 37.3 | 0 | 0 | 0 | 113.2 | D186 E187 K195 | D186-P191 WeakPolarHBondContact O-CD 3.46Å; E187-P191 WeakPolarHBondContact O-CG 3.48Å; P191-K195 VanDerWaalsContact O-CG 3.31Å; P191-K195 WeakPolarHBondContact O-CG 3.47Å; P191-K195 PolarHBondContact O-N 3.13Å |
| 192 | I | 88.8 | Confident | 79.1 | Confident | 96 Ų | 96 | 87.8 Ų | 87.8 | 49% | 0.492 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -68.9 | -45.2 | 177.3 | -59.8 | 171.3 | 0 | 0 | 0 | 109.8 | K188 I189 V190 K194 K195 K196 | K188-I192 WeakPolarHBondContact O-CD1 3.48Å; K188-I192 VanDerWaalsContact O-CG1 3.3Å; K188-I192 WeakPolarHBondContact O-CG1 3.47Å; I189-I192 WeakPolarHBondContact O-CB 3.35Å; I189-I192 PolarHBondContact O-N 3.09Å; V190-I192 VanDerWaalsContact C-N 3.32Å; V190-I192 PolarHBondContact O-N 2.98Å; I192-K194 VanDerWaalsContact C-N 3.33Å; I192-K194 PolarHBondContact O-N 2.94Å; I192-K195 PolarHBondContact O-N 3.34Å; I192-K196 WeakPolarHBondContact O-CG 3.24Å; I192-K196 PolarHBondContact O-N 2.82Å |
| 193 | L | 86.5 | Confident | 76.9 | Confident | 24 Ų | 24 | 91.2 Ų | 91.2 | 13% | 0.126 | 48% | 0.482 | C | S | . | . | H | α-helix | trans | -60.7 | -43 | 177.4 | -65.3 | -179.4 | 0 | 0 | 0 | 111.5 | Y134 L139 C140 F185 I189 V190 K196 | Y134-L193 HydrophobicContact CD1-CD1 3.74Å; Y134-L193 HydrophobicContact CE1-CD1 4.27Å; Y134-L193 HydrophobicContact CG-CD1 4.21Å; L139-L193 HydrophobicContact CB-CD1 4.38Å; L139-L193 HydrophobicContact CB-CD2 4.31Å; L139-L193 WeakPolarHBondContact O-CD2 3.36Å; C140-L193 HydrophobicContact CB-CD1 4.29Å; F185-L193 HydrophobicContact CE2-CD1 4.45Å; F185-L193 HydrophobicContact CZ-CD1 4.35Å; I189-L193 HydrophobicContact CG2-CD1 3.9Å; I189-L193 HydrophobicContact CG2-CG 4.07Å; I189-L193 WeakPolarHBondContact O-CG 3.41Å; I189-L193 PolarHBondContact O-N 3.12Å; V190-L193 PolarHBondContact O-N 3.34Å; L193-K196 PolarHBondContact O-N 2.85Å |
| 194 | K | 83.3 | Confident | 74.5 | Confident | 124 Ų | 124 | 87.9 Ų | 87.9 | 54% | 0.539 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -63.8 | -39.5 | 176 | -74 | 179.3 | 175.8 | -179.9 | 0 | 112.5 | V190 I192 K196 L197 | V190-K194 HydrophobicContact CG1-CD 3.99Å; V190-K194 HydrophobicContact CG1-CG 4.32Å; V190-K194 WeakPolarHBondContact O-CB 3.28Å; V190-K194 WeakPolarHBondContact O-CG 3.41Å; V190-K194 PolarHBondContact O-N 2.81Å; I192-K194 VanDerWaalsContact C-N 3.33Å; I192-K194 PolarHBondContact O-N 2.94Å; K194-K196 VanDerWaalsContact C-N 3.34Å; K194-K196 PolarHBondContact O-N 3.06Å; K194-L197 CarbonylContact O-C 3.56Å; K194-L197 PolarHBondContact O-N 3.45Å |
| 195 | K | 81.4 | Confident | 72.2 | Confident | 176 Ų | 176 | 93 Ų | 93 | 77% | 0.765 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -68.1 | -30.9 | 177.1 | -75.9 | 177.6 | -179.7 | -176.9 | 0 | 113.2 | P191 I192 L197 | P191-K195 VanDerWaalsContact O-CG 3.31Å; P191-K195 WeakPolarHBondContact O-CG 3.47Å; P191-K195 PolarHBondContact O-N 3.13Å; I192-K195 PolarHBondContact O-N 3.34Å; K195-L197 VanDerWaalsContact C-N 3.25Å; K195-L197 PolarHBondContact O-N 3.01Å |
| 196 | K | 68.1 | Low | 70 | Confident | 169 Ų | 169 | 101.2 Ų | 101.2 | 74% | 0.735 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -73.1 | -14.9 | 178 | -71.1 | -74.5 | -177.6 | -177.8 | 0 | 113.4 | I192 L193 K194 | I192-K196 WeakPolarHBondContact O-CG 3.24Å; I192-K196 PolarHBondContact O-N 2.82Å; L193-K196 PolarHBondContact O-N 2.85Å; K194-K196 VanDerWaalsContact C-N 3.34Å; K194-K196 PolarHBondContact O-N 3.06Å |
| 197 | L | 62.1 | Low | 67.8 | Low | 62 Ų | 62 | 104.2 Ų | 104.2 | 33% | 0.325 | 55% | 0.553 | S | S | . | * | S | Bend | trans | -120.7 | 83.3 | 173.2 | -75.2 | 115.6 | 0 | 0 | 0 | 111.3 | L139 K194 K195 G199 | L139-L197 HydrophobicContact CD1-CD1 4.33Å; L139-L197 HydrophobicContact CD2-CD1 3.38Å; L139-L197 HydrophobicContact CG-CD1 4.49Å; K194-L197 CarbonylContact O-C 3.56Å; K194-L197 PolarHBondContact O-N 3.45Å; K195-L197 VanDerWaalsContact C-N 3.25Å; K195-L197 PolarHBondContact O-N 3.01Å; L197-G199 PolarHBondContact O-N 3.11Å |
| 198 | P | 50.2 | Low | 65.5 | Low | 127 Ų | 127 | 102.4 Ų | 102.4 | 83% | 0.825 | 56% | 0.564 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.6 | 107.1 | 166.4 | 27.1 | -29.9 | 0 | 0 | 0 | 108.9 | ||
| 199 | G | 54.3 | Low | 63 | Low | 80 Ų | 80 | 102.7 Ų | 102.7 | 83% | 0.825 | 58% | 0.58 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 116.3 | 2.6 | 163.6 | 0 | 0 | 0 | 0 | 0 | 118.1 | L197 | L197-G199 PolarHBondContact O-N 3.11Š|
| 200 | T | 52.6 | Low | 60.4 | Low | 85 Ų | 85 | 105.8 Ų | 105.8 | 52% | 0.521 | 61% | 0.61 | S | S | . | * | trans | -110.1 | 98.1 | 169 | -54.9 | 0 | 0 | 0 | 0 | 109.4 | L202 | T200-L202 HydrophobicContact CG2-CD2 3.64Å; T200-L202 HydrophobicContact CG2-CG 4.06Å; T200-L202 PolarHBondContact O-N 2.93Å | ||
| 201 | D | 48.3 | Very low | 58.1 | Low | 137 Ų | 137 | 111.4 Ų | 111.4 | 73% | 0.733 | 65% | 0.647 | S | S | * | * | trans | -64.1 | 84 | 167.7 | -107.1 | -53.9 | 0 | 0 | 0 | 109.6 | S203 G204 | D201-S203 PolarHBondContact O-N 3.2Å; D201-G204 PolarHBondContact O-N 3.34Å | ||
| 202 | L | 56.4 | Low | 55.6 | Low | 88 Ų | 88 | 116 Ų | 116 | 46% | 0.461 | 67% | 0.674 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -66.4 | -11.4 | 174.9 | -61.3 | 165.7 | 0 | 0 | 0 | 111.7 | L139 T200 | L139-L202 HydrophobicContact CD1-CD1 3.51Å; T200-L202 HydrophobicContact CG2-CD2 3.64Å; T200-L202 HydrophobicContact CG2-CG 4.06Å; T200-L202 PolarHBondContact O-N 2.93Å |
| 203 | S | 51.3 | Low | 53.2 | Low | 100 Ų | 100 | 116.3 Ų | 116.3 | 70% | 0.699 | 69% | 0.691 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.9 | -5.5 | -176.8 | -139.9 | 0 | 0 | 0 | 0 | 114.3 | D201 | D201-S203 PolarHBondContact O-N 3.2Š|
| 204 | G | 43.1 | Very low | 50.6 | Low | 42 Ų | 42 | 118.4 Ų | 118.4 | 43% | 0.433 | 72% | 0.718 | S | S | . | * | S | Bend | trans | -110.1 | -5 | -166.6 | 0 | 0 | 0 | 0 | 0 | 117.6 | D201 | D201-G204 PolarHBondContact O-N 3.34Š|
| 205 | R | 46.9 | Very low | 48.7 | Very low | 243 Ų | 243 | 118.9 Ų | 118.9 | 92% | 0.917 | 73% | 0.734 | S | S | * | * | S | Bend | trans | -95.5 | 8.9 | -172.3 | -74.5 | -164.3 | -176.8 | -135.9 | 3.8 | 116.5 | ||
| 206 | L | 47.7 | Very low | 46.9 | Very low | 174 Ų | 174 | 116.1 Ų | 116.1 | 91% | 0.911 | 74% | 0.737 | S | S | * | * | S | Bend | trans | -125.9 | -0.6 | 173.1 | -79.3 | 169.8 | 0 | 0 | 0 | 115.6 | ||
| 207 | I | 45.9 | Very low | 45.6 | Very low | 147 Ų | 147 | 114.3 Ų | 114.3 | 75% | 0.754 | 74% | 0.74 | S | S | * | * | S | Bend | trans | -137.2 | 109.3 | 167.1 | -55.7 | 179.4 | 0 | 0 | 0 | 106.8 | S209 | I207-S209 PolarHBondContact O-N 2.69Å; I207-S209 VanDerWaalsContact O-N 3.13Å |
| 208 | G | 45.1 | Very low | 44.3 | Very low | 72 Ų | 72 | 116.6 Ų | 116.6 | 74% | 0.742 | 76% | 0.762 | S | S | * | * | trans | -59.6 | 116.3 | 178.8 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 209 | S | 38.8 | Very low | 43.9 | Very low | 116 Ų | 116 | 118.6 Ų | 118.6 | 81% | 0.811 | 76% | 0.764 | S | S | * | * | trans | 168.2 | 118 | 142.2 | -73.2 | 0 | 0 | 0 | 0 | 107.8 | I207 | I207-S209 PolarHBondContact O-N 2.69Å; I207-S209 VanDerWaalsContact O-N 3.13Å | ||
| 210 | A | 36.1 | Very low | 43 | Very low | 98 Ų | 98 | 121.4 Ų | 121.4 | 81% | 0.81 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -73.9 | 139.7 | 170.8 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||
| 211 | P | 43.2 | Very low | 42.2 | Very low | 128 Ų | 128 | 123 Ų | 123 | 83% | 0.831 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -80.5 | 127.9 | 171.2 | 32.5 | -28.7 | 0 | 0 | 0 | 108.9 | ||
| 212 | V | 38.3 | Very low | 41.8 | Very low | 147 Ų | 147 | 124.6 Ų | 124.6 | 89% | 0.891 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -92.4 | 123.1 | 165.3 | 106.7 | 0 | 0 | 0 | 0 | 107.4 | ||
| 213 | A | 37.9 | Very low | 40.8 | Very low | 104 Ų | 104 | 126.5 Ų | 126.5 | 86% | 0.86 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -90.7 | 132.6 | 173.6 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||
| 214 | G | 32.7 | Very low | 40.4 | Very low | 68 Ų | 68 | 128.6 Ų | 128.6 | 70% | 0.701 | 80% | 0.804 | S | S | * | * | trans | -173.6 | 145.9 | 170 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 215 | P | 42.9 | Very low | 40.5 | Very low | 133 Ų | 133 | 134.9 Ų | 134.9 | 86% | 0.864 | 83% | 0.827 | S | S | * | * | trans | -87.3 | 159.9 | -136.5 | 33.6 | -36.3 | 0 | 0 | 0 | 116 | ||||
| 216 | S | 43.7 | Very low | 39.9 | Very low | 119 Ų | 119 | 128.2 Ų | 128.2 | 83% | 0.832 | 82% | 0.823 | S | S | * | * | trans | -43.9 | 130.5 | 179.3 | -51.4 | 0 | 0 | 0 | 0 | 116 | ||||
| 217 | T | 39.8 | Very low | 39.5 | Very low | 130 Ų | 130 | 129.7 Ų | 129.7 | 80% | 0.798 | 82% | 0.822 | S | S | * | * | trans | -161.3 | 125.2 | 133 | 37.3 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 218 | S | 34.6 | Very low | 39.3 | Very low | 111 Ų | 111 | 129.7 Ų | 129.7 | 78% | 0.776 | 82% | 0.824 | S | S | * | * | trans | 57.7 | 113.2 | 139.3 | -45.5 | 0 | 0 | 0 | 0 | 121.4 | ||||
| 219 | L | 41.6 | Very low | 39.6 | Very low | 168 Ų | 168 | 132.2 Ų | 132.2 | 88% | 0.88 | 83% | 0.825 | S | S | * | * | trans | 8.5 | 128.3 | 141.6 | -61.4 | 164.6 | 0 | 0 | 0 | 117.6 | ||||
| 220 | T | 36.4 | Very low | 40 | Very low | 139 Ų | 139 | 131 Ų | 131 | 85% | 0.853 | 81% | 0.814 | S | S | * | * | -172.2 | 146.8 | 126 | -67.4 | 0 | 0 | 0 | 0 | 111.1 | |||||
| 221 | T | 35.8 | Very low | 41.3 | Very low | 119 Ų | 119 | 128.8 Ų | 128.8 | 73% | 0.73 | 79% | 0.793 | S | S | * | * | trans | -55.6 | 150.9 | -176.2 | 51.1 | 0 | 0 | 0 | 0 | 118 | ||||
| 222 | M | 40.7 | Very low | 42.1 | Very low | 171 Ų | 171 | 133.5 Ų | 133.5 | 84% | 0.842 | 79% | 0.794 | S | S | * | * | trans | 25.5 | 113.9 | 144.7 | -65.4 | -85.5 | 92.6 | 0 | 0 | 118.3 | ||||
| 223 | S | 35 | Very low | 43.1 | Very low | 128 Ų | 128 | 129.8 Ų | 129.8 | 90% | 0.895 | 78% | 0.775 | S | S | * | * | trans | -150 | 121 | 144.9 | -158 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 224 | L | 42.7 | Very low | 44.4 | Very low | 144 Ų | 144 | 129.7 Ų | 129.7 | 75% | 0.754 | 76% | 0.757 | S | S | * | * | trans | -79.9 | 154.2 | 172.6 | -70.9 | 161.9 | 0 | 0 | 0 | 109.8 | ||||
| 225 | L | 44.1 | Very low | 46.2 | Very low | 174 Ų | 174 | 132.6 Ų | 132.6 | 91% | 0.911 | 75% | 0.753 | S | S | * | * | trans | 69.3 | 92.7 | 160.8 | -60.3 | 152.6 | 0 | 0 | 0 | 117 | ||||
| 226 | A | 35.6 | Very low | 47.5 | Very low | 102 Ų | 102 | 130.4 Ų | 130.4 | 84% | 0.843 | 74% | 0.738 | S | S | * | * | trans | -146.9 | 132.1 | 153.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | N228 | A226-N228 PolarHBondContact O-N 2.94Š| ||
| 227 | K | 39.7 | Very low | 49.1 | Very low | 205 Ų | 205 | 132.1 Ų | 132.1 | 89% | 0.891 | 73% | 0.73 | S | S | * | * | trans | -54.1 | 122.4 | -176.8 | -64.9 | 159.3 | 175.3 | 175.6 | 0 | 111.3 | T229 | K227-T229 PolarHBondContact O-N 3.47Š| ||
| 228 | N | 42 | Very low | 50.7 | Low | 148 Ų | 148 | 130.3 Ų | 130.3 | 79% | 0.791 | 72% | 0.719 | S | S | * | * | trans | -88.7 | 89.4 | 177.6 | -166 | 21.7 | 0 | 0 | 0 | 110.6 | A226 | A226-N228 PolarHBondContact O-N 2.94Š| ||
| 229 | T | 50.3 | Low | 52.7 | Low | 124 Ų | 124 | 131.5 Ų | 131.5 | 76% | 0.761 | 71% | 0.712 | S | S | * | * | trans | -91 | 113.6 | 157.4 | 46.8 | 0 | 0 | 0 | 0 | 107.5 | K227 S231 | K227-T229 PolarHBondContact O-N 3.47Å; T229-S231 PolarHBondContact O-N 3.37Å | ||
| 230 | P | 47.8 | Very low | 54.5 | Low | 90 Ų | 90 | 129.1 Ų | 129.1 | 58% | 0.584 | 70% | 0.696 | S | S | * | * | trans | -61.9 | 132.8 | -177.7 | 23.7 | -31.6 | 0 | 0 | 0 | 110 | ||||
| 231 | S | 62.7 | Low | 56.6 | Low | 52 Ų | 52 | 127.7 Ų | 127.7 | 36% | 0.364 | 68% | 0.68 | S | S | . | * | trans | -65.4 | 143.8 | -178.5 | 64.9 | 0 | 0 | 0 | 0 | 110.4 | T229 S233 E234 M235 | T229-S231 PolarHBondContact O-N 3.37Å; S231-S233 PolarHBondContact O-N 3.01Å; S231-S233 PolarHBondContact OG-OG 2.95Å; S231-E234 PolarHBondContact N-OE2 3.04Å; S231-E234 VanDerWaalsContact N-OE2 3.14Å; S231-E234 PolarHBondContact O-N 2.92Å; S231-E234 VanDerWaalsContact OG-CG 3.27Å; S231-E234 WeakPolarHBondContact OG-CG 3.46Å; S231-E234 PolarHBondContact OG-OE2 2.9Å; S231-M235 PolarHBondContact O-N 3.24Å | ||
| 232 | R | 59.8 | Low | 58.7 | Low | 228 Ų | 228 | 126.4 Ų | 126.4 | 86% | 0.86 | 67% | 0.672 | S | S | * | * | H | α-helix | trans | -54.3 | -23.3 | -177.5 | -170.6 | 176.7 | -178.8 | -176.6 | 0.7 | 113.4 | T236 | R232-T236 PolarHBondContact O-OG1 2.86Å |
| 233 | S | 60 | Low | 60.8 | Low | 68 Ų | 68 | 125.7 Ų | 125.7 | 48% | 0.476 | 66% | 0.664 | S | S | . | * | H | α-helix | trans | -83.1 | -27.2 | 177.6 | 60.5 | 0 | 0 | 0 | 0 | 113.9 | S231 T236 K237 | S231-S233 PolarHBondContact O-N 3.01Å; S231-S233 PolarHBondContact OG-OG 2.95Å; S233-T236 WeakPolarHBondContact CA-OG1 3.37Å; S233-T236 PolarHBondContact O-OG1 3.21Å; S233-K237 WeakPolarHBondContact O-CG 3.49Å; S233-K237 PolarHBondContact O-N 3.33Å |
| 234 | E | 64.7 | Low | 62.9 | Low | 103 Ų | 103 | 123.3 Ų | 123.3 | 48% | 0.481 | 64% | 0.644 | S | S | . | * | H | α-helix | trans | -75.1 | -38.1 | 173.8 | -72.2 | 168.5 | 137 | 0 | 0 | 110.7 | S231 T236 K237 V238 | S231-E234 PolarHBondContact N-OE2 3.04Å; S231-E234 VanDerWaalsContact N-OE2 3.14Å; S231-E234 PolarHBondContact O-N 2.92Å; S231-E234 VanDerWaalsContact OG-CG 3.27Å; S231-E234 WeakPolarHBondContact OG-CG 3.46Å; S231-E234 PolarHBondContact OG-OE2 2.9Å; E234-T236 VanDerWaalsContact C-N 3.35Å; E234-T236 PolarHBondContact O-N 3.29Å; E234-K237 PolarHBondContact O-N 3.24Å; E234-V238 WeakPolarHBondContact O-CG2 3.48Å; E234-V238 PolarHBondContact O-N 3.33Å |
| 235 | M | 69.8 | Low | 64.6 | Low | 128 Ų | 128 | 120.2 Ų | 120.2 | 63% | 0.631 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -62.8 | -39.6 | 177.2 | -165.1 | 173.6 | -154.5 | 0 | 0 | 112.3 | S231 V238 Q239 | S231-M235 PolarHBondContact O-N 3.24Å; M235-V238 PolarHBondContact O-N 2.99Å; M235-Q239 WeakPolarHBondContact O-CB 3.32Å; M235-Q239 PolarHBondContact O-N 2.93Å |
| 236 | T | 71.8 | Confident | 66.5 | Low | 88 Ų | 88 | 113.6 Ų | 113.6 | 54% | 0.54 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -69.1 | -36.4 | 176.8 | 46.2 | 0 | 0 | 0 | 0 | 112.6 | R232 S233 E234 Q239 Q240 | R232-T236 PolarHBondContact O-OG1 2.86Å; S233-T236 WeakPolarHBondContact CA-OG1 3.37Å; S233-T236 PolarHBondContact O-OG1 3.21Å; E234-T236 VanDerWaalsContact C-N 3.35Å; E234-T236 PolarHBondContact O-N 3.29Å; T236-Q239 PolarHBondContact O-N 2.94Å; T236-Q240 WeakPolarHBondContact O-CB 3.37Å; T236-Q240 PolarHBondContact O-N 3.04Å |
| 237 | K | 76.7 | Confident | 68.9 | Low | 155 Ų | 155 | 111.6 Ų | 111.6 | 67% | 0.674 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -64.9 | -43.5 | 173 | -72.1 | 176.2 | -178.2 | 179.6 | 0 | 111.9 | S233 E234 Q240 Q241 | S233-K237 WeakPolarHBondContact O-CG 3.49Å; S233-K237 PolarHBondContact O-N 3.33Å; E234-K237 PolarHBondContact O-N 3.24Å; K237-Q240 PolarHBondContact O-N 2.91Å; K237-Q241 WeakPolarHBondContact O-CB 3.44Å; K237-Q241 PolarHBondContact O-N 3.37Å |
| 238 | V | 74.3 | Confident | 70.8 | Confident | 92 Ų | 92 | 105.4 Ų | 105.4 | 56% | 0.558 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -63.3 | -42.5 | 175.5 | 173.4 | 0 | 0 | 0 | 0 | 110.9 | E234 M235 Q240 Q241 V242 | E234-V238 WeakPolarHBondContact O-CG2 3.48Å; E234-V238 PolarHBondContact O-N 3.33Å; M235-V238 PolarHBondContact O-N 2.99Å; V238-Q240 PolarHBondContact O-N 3.4Å; V238-Q241 PolarHBondContact O-N 3.04Å; V238-V242 HydrophobicContact CG1-CG2 4.36Å; V238-V242 VanDerWaalsContact O-CG2 3.28Å; V238-V242 WeakPolarHBondContact O-CG2 3.31Å; V238-V242 PolarHBondContact O-N 3.48Å |
| 239 | Q | 75.5 | Confident | 72.9 | Confident | 136 Ų | 136 | 103 Ų | 103 | 64% | 0.636 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -61.6 | -42.6 | 177 | -166.9 | 109.6 | 61.7 | 0 | 0 | 112.1 | M235 T236 V242 K243 | M235-Q239 WeakPolarHBondContact O-CB 3.32Å; M235-Q239 PolarHBondContact O-N 2.93Å; T236-Q239 PolarHBondContact O-N 2.94Å; Q239-V242 PolarHBondContact O-N 3.02Å; Q239-K243 PolarHBondContact O-N 3.47Å |
| 240 | Q | 80.3 | Confident | 74.6 | Confident | 117 Ų | 117 | 100.2 Ų | 100.2 | 55% | 0.547 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -65.9 | -41.4 | 176.2 | -171.9 | 68.1 | 1.7 | 0 | 0 | 111.3 | T236 K237 V238 V242 K243 V244 | T236-Q240 WeakPolarHBondContact O-CB 3.37Å; T236-Q240 PolarHBondContact O-N 3.04Å; K237-Q240 PolarHBondContact O-N 2.91Å; V238-Q240 PolarHBondContact O-N 3.4Å; Q240-V242 PolarHBondContact O-N 3.47Å; Q240-K243 WeakPolarHBondContact O-CB 3.47Å; Q240-K243 PolarHBondContact O-N 2.98Å; Q240-V244 WeakPolarHBondContact O-CG2 3.49Å; Q240-V244 PolarHBondContact O-N 3.32Å |
| 241 | Q | 80.2 | Confident | 76.5 | Confident | 110 Ų | 110 | 97.9 Ų | 97.9 | 51% | 0.514 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -62.8 | -42.3 | 176 | -170.4 | 64.9 | 47 | 0 | 0 | 111.8 | K237 V238 K243 V244 N245 | K237-Q241 WeakPolarHBondContact O-CB 3.44Å; K237-Q241 PolarHBondContact O-N 3.37Å; V238-Q241 PolarHBondContact O-N 3.04Å; Q241-K243 VanDerWaalsContact C-N 3.28Å; Q241-K243 PolarHBondContact O-N 3.44Å; Q241-V244 PolarHBondContact O-N 3.05Å; Q241-N245 PolarHBondContact NE2-OD1 3.18Å; Q241-N245 VanDerWaalsContact O-CB 3.24Å; Q241-N245 WeakPolarHBondContact O-CB 3.33Å; Q241-N245 PolarHBondContact O-N 2.96Å; Q241-N245 PolarHBondContact O-OD1 3.49Å |
| 242 | V | 79.2 | Confident | 77.7 | Confident | 91 Ų | 91 | 100.3 Ų | 100.3 | 55% | 0.552 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -62.5 | -37.1 | 175.6 | 170.9 | 0 | 0 | 0 | 0 | 111 | V238 Q239 Q240 G246 | V238-V242 HydrophobicContact CG1-CG2 4.36Å; V238-V242 VanDerWaalsContact O-CG2 3.28Å; V238-V242 WeakPolarHBondContact O-CG2 3.31Å; V238-V242 PolarHBondContact O-N 3.48Å; Q239-V242 PolarHBondContact O-N 3.02Å; Q240-V242 PolarHBondContact O-N 3.47Å; V242-G246 PolarHBondContact O-N 3.35Å |
| 243 | K | 84.4 | Confident | 79.2 | Confident | 157 Ų | 157 | 97.2 Ų | 97.2 | 68% | 0.683 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -67.5 | -45.1 | 177.1 | -166 | 175.3 | -179.3 | -178.3 | 0 | 112.4 | Q239 Q240 Q241 G246 A247 | Q239-K243 PolarHBondContact O-N 3.47Å; Q240-K243 WeakPolarHBondContact O-CB 3.47Å; Q240-K243 PolarHBondContact O-N 2.98Å; Q241-K243 VanDerWaalsContact C-N 3.28Å; Q241-K243 PolarHBondContact O-N 3.44Å; K243-G246 PolarHBondContact O-N 3.04Å; K243-A247 PolarHBondContact O-N 3.23Å; K243-A247 VanDerWaalsContact O-N 3.09Å |
| 244 | V | 78.8 | Confident | 80.8 | Confident | 78 Ų | 78 | 101.9 Ų | 101.9 | 47% | 0.473 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -64.8 | -43.3 | 175.5 | 175 | 0 | 0 | 0 | 0 | 110.8 | Q240 Q241 G246 A247 S248 | Q240-V244 WeakPolarHBondContact O-CG2 3.49Å; Q240-V244 PolarHBondContact O-N 3.32Å; Q241-V244 PolarHBondContact O-N 3.05Å; V244-G246 VanDerWaalsContact C-N 3.31Å; V244-G246 PolarHBondContact O-N 3.4Å; V244-A247 PolarHBondContact O-N 3.49Å; V244-S248 PolarHBondContact O-N 2.98Å |
| 245 | N | 79.3 | Confident | 82.1 | Confident | 79 Ų | 79 | 102.6 Ų | 102.6 | 42% | 0.422 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -63.8 | -36.5 | 176.1 | -70.1 | -2.3 | 0 | 0 | 0 | 111.7 | Q241 S248 M249 | Q241-N245 PolarHBondContact NE2-OD1 3.18Å; Q241-N245 VanDerWaalsContact O-CB 3.24Å; Q241-N245 WeakPolarHBondContact O-CB 3.33Å; Q241-N245 PolarHBondContact O-N 2.96Å; Q241-N245 PolarHBondContact O-OD1 3.49Å; N245-S248 PolarHBondContact O-N 3.23Å; N245-M249 WeakPolarHBondContact O-CB 3.36Å; N245-M249 VanDerWaalsContact O-CG 3.28Å; N245-M249 WeakPolarHBondContact O-CG 3.36Å; N245-M249 PolarHBondContact O-N 3.48Å |
| 246 | G | 84.4 | Confident | 83.1 | Confident | 35 Ų | 35 | 102.4 Ų | 102.4 | 36% | 0.361 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -63.7 | -42.8 | 174.4 | 0 | 0 | 0 | 0 | 0 | 113 | V242 K243 V244 M249 T250 | V242-G246 PolarHBondContact O-N 3.35Å; K243-G246 PolarHBondContact O-N 3.04Å; V244-G246 VanDerWaalsContact C-N 3.31Å; V244-G246 PolarHBondContact O-N 3.4Å; G246-M249 PolarHBondContact O-N 3.06Å; G246-T250 PolarHBondContact O-N 2.97Å; G246-T250 VanDerWaalsContact O-N 3.08Å; G246-T250 PolarHBondContact O-OG1 3.23Å |
| 247 | A | 84.5 | Confident | 84.1 | Confident | 59 Ų | 59 | 104.6 Ų | 104.6 | 49% | 0.488 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -62.8 | -44.3 | 173.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | K243 V244 M249 T250 A251 | K243-A247 PolarHBondContact O-N 3.23Å; K243-A247 VanDerWaalsContact O-N 3.09Å; V244-A247 PolarHBondContact O-N 3.49Å; A247-M249 PolarHBondContact O-N 2.85Å; A247-T250 PolarHBondContact O-N 3.01Å; A247-T250 PolarHBondContact O-OG1 2.9Å; A247-A251 PolarHBondContact O-N 3.4Å |
| 248 | S | 80.8 | Confident | 84.9 | Confident | 75 Ų | 75 | 102.1 Ų | 102.1 | 52% | 0.524 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -61 | -43.5 | 175.2 | -177.1 | 0 | 0 | 0 | 0 | 112.5 | V244 N245 T250 A251 L252 | V244-S248 PolarHBondContact O-N 2.98Å; N245-S248 PolarHBondContact O-N 3.23Å; S248-T250 VanDerWaalsContact C-N 3.31Å; S248-T250 PolarHBondContact O-N 2.86Å; S248-A251 PolarHBondContact O-N 2.99Å; S248-L252 WeakPolarHBondContact O-CB 3.47Å; S248-L252 PolarHBondContact O-N 3.41Å |
| 249 | M | 84.9 | Confident | 85.8 | Confident | 99 Ų | 99 | 102 Ų | 102 | 49% | 0.488 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -62.6 | -34.7 | 176.7 | -78.6 | -67.5 | -67.9 | 0 | 0 | 113.1 | N245 G246 A247 R253 | N245-M249 WeakPolarHBondContact O-CB 3.36Å; N245-M249 VanDerWaalsContact O-CG 3.28Å; N245-M249 WeakPolarHBondContact O-CG 3.36Å; N245-M249 PolarHBondContact O-N 3.48Å; G246-M249 PolarHBondContact O-N 3.06Å; A247-M249 PolarHBondContact O-N 2.85Å; M249-R253 VanDerWaalsContact O-CG 3.29Å; M249-R253 WeakPolarHBondContact O-CG 3.13Å; M249-R253 PolarHBondContact O-N 3.04Å; M249-R253 VanDerWaalsContact O-N 3.11Å |
| 250 | T | 86.6 | Confident | 86.7 | Confident | 64 Ų | 64 | 104 Ų | 104 | 39% | 0.393 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -74.5 | -35.3 | 175.5 | 52.3 | 0 | 0 | 0 | 0 | 112.5 | G246 A247 S248 R253 R254 | G246-T250 PolarHBondContact O-N 2.97Å; G246-T250 VanDerWaalsContact O-N 3.08Å; G246-T250 PolarHBondContact O-OG1 3.23Å; A247-T250 PolarHBondContact O-N 3.01Å; A247-T250 PolarHBondContact O-OG1 2.9Å; S248-T250 VanDerWaalsContact C-N 3.31Å; S248-T250 PolarHBondContact O-N 2.86Å; T250-R253 PolarHBondContact O-N 3.48Å; T250-R254 PolarHBondContact O-N 2.95Å |
| 251 | A | 88.9 | Confident | 87.4 | Confident | 41 Ų | 41 | 102.7 Ų | 102.7 | 34% | 0.339 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -62.4 | -49 | 171.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | A247 S248 R253 R254 E255 | A247-A251 PolarHBondContact O-N 3.4Å; S248-A251 PolarHBondContact O-N 2.99Å; A251-R253 VanDerWaalsContact C-N 3.27Å; A251-R253 PolarHBondContact O-N 3.43Å; A251-R254 WeakPolarHBondContact O-CB 3.42Å; A251-R254 PolarHBondContact O-N 3.31Å; A251-E255 PolarHBondContact O-N 3.45Å |
| 252 | L | 87.3 | Confident | 88.1 | Confident | 103 Ų | 103 | 102.7 Ų | 102.7 | 54% | 0.539 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -59.9 | -37 | 178 | -169.6 | 70.8 | 0 | 0 | 0 | 112.4 | S248 R254 E255 L256 | S248-L252 WeakPolarHBondContact O-CB 3.47Å; S248-L252 PolarHBondContact O-N 3.41Å; L252-R254 VanDerWaalsContact C-N 3.33Å; L252-R254 PolarHBondContact O-N 3.14Å; L252-E255 PolarHBondContact O-N 2.81Å; L252-L256 WeakPolarHBondContact O-CB 3.47Å; L252-L256 PolarHBondContact O-N 3.36Å |
| 253 | R | 90.3 | Very high | 88.6 | Confident | 163 Ų | 163 | 104.5 Ų | 104.5 | 62% | 0.615 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -63.6 | -36.1 | 173.9 | -79.3 | 177.1 | 179.4 | 176.5 | 1.1 | 112.8 | M249 T250 A251 Q257 | M249-R253 VanDerWaalsContact O-CG 3.29Å; M249-R253 WeakPolarHBondContact O-CG 3.13Å; M249-R253 PolarHBondContact O-N 3.04Å; M249-R253 VanDerWaalsContact O-N 3.11Å; T250-R253 PolarHBondContact O-N 3.48Å; A251-R253 VanDerWaalsContact C-N 3.27Å; A251-R253 PolarHBondContact O-N 3.43Å; R253-Q257 WeakPolarHBondContact O-CG 3.23Å; R253-Q257 PolarHBondContact O-N 3.18Å |
| 254 | R | 94.4 | Very high | 89.1 | Confident | 167 Ų | 167 | 101.9 Ų | 101.9 | 63% | 0.63 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -69.8 | -45.4 | 175.5 | -68.6 | -171.3 | -166.1 | 102.1 | -1.5 | 111.2 | T250 A251 L252 L256 Q257 E258 | T250-R254 PolarHBondContact O-N 2.95Å; A251-R254 WeakPolarHBondContact O-CB 3.42Å; A251-R254 PolarHBondContact O-N 3.31Å; L252-R254 VanDerWaalsContact C-N 3.33Å; L252-R254 PolarHBondContact O-N 3.14Å; R254-L256 VanDerWaalsContact C-N 3.3Å; R254-L256 PolarHBondContact O-N 3.43Å; R254-Q257 WeakPolarHBondContact O-CB 3.46Å; R254-Q257 PolarHBondContact O-N 2.92Å; R254-Q257 VanDerWaalsContact O-N 3.12Å; R254-E258 PolarHBondContact O-N 3.35Å |
| 255 | E | 91.8 | Very high | 89.9 | Confident | 117 Ų | 117 | 104.4 Ų | 104.4 | 55% | 0.547 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -59.8 | -41.7 | 176.2 | -69.8 | -178.1 | 176.3 | 0 | 0 | 111.5 | A251 L252 Q257 E258 V259 | A251-E255 PolarHBondContact O-N 3.45Å; L252-E255 PolarHBondContact O-N 2.81Å; E255-Q257 VanDerWaalsContact C-N 3.32Å; E255-Q257 PolarHBondContact O-N 2.92Å; E255-E258 PolarHBondContact O-N 3.36Å; E255-V259 WeakPolarHBondContact O-CB 3.41Å; E255-V259 VanDerWaalsContact O-CG2 3.3Å; E255-V259 WeakPolarHBondContact O-CG2 3.48Å; E255-V259 PolarHBondContact O-N 3.24Å |
| 256 | L | 91.1 | Very high | 90.4 | Very high | 125 Ų | 125 | 106.7 Ų | 106.7 | 65% | 0.654 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -62.1 | -38.7 | 175.9 | -173.5 | 67.7 | 0 | 0 | 0 | 112.3 | L252 R254 R260 | L252-L256 WeakPolarHBondContact O-CB 3.47Å; L252-L256 PolarHBondContact O-N 3.36Å; R254-L256 VanDerWaalsContact C-N 3.3Å; R254-L256 PolarHBondContact O-N 3.43Å; L256-R260 WeakPolarHBondContact O-CB 3.3Å; L256-R260 PolarHBondContact O-N 3.44Å |
| 257 | Q | 93.5 | Very high | 90.9 | Very high | 134 Ų | 134 | 110.3 Ų | 110.3 | 63% | 0.626 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -67.4 | -42.3 | 174.8 | -75.9 | 178.5 | -10.7 | 0 | 0 | 111.6 | R253 R254 E255 R260 V261 | R253-Q257 WeakPolarHBondContact O-CG 3.23Å; R253-Q257 PolarHBondContact O-N 3.18Å; R254-Q257 WeakPolarHBondContact O-CB 3.46Å; R254-Q257 PolarHBondContact O-N 2.92Å; R254-Q257 VanDerWaalsContact O-N 3.12Å; E255-Q257 VanDerWaalsContact C-N 3.32Å; E255-Q257 PolarHBondContact O-N 2.92Å; Q257-R260 WeakPolarHBondContact O-CB 3.27Å; Q257-R260 PolarHBondContact O-N 3.4Å; Q257-V261 WeakPolarHBondContact O-CG2 3.48Å; Q257-V261 PolarHBondContact O-N 2.92Å |
| 258 | E | 92.9 | Very high | 91.4 | Very high | 102 Ų | 102 | 113.7 Ų | 113.7 | 48% | 0.477 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -63 | -44.8 | 177.2 | -169.3 | -175 | 158.8 | 0 | 0 | 111.7 | R254 E255 R260 V261 K262 | R254-E258 PolarHBondContact O-N 3.35Å; E255-E258 PolarHBondContact O-N 3.36Å; E258-R260 VanDerWaalsContact C-N 3.29Å; E258-R260 PolarHBondContact O-N 2.88Å; E258-V261 PolarHBondContact O-N 3.48Å; E258-K262 WeakPolarHBondContact O-CG 3.46Å; E258-K262 PolarHBondContact O-N 3.34Å; E258-K262 VanDerWaalsContact OE1-CE 3.26Å; E258-K262 WeakPolarHBondContact OE1-CE 3.22Å; E258-K262 IonicContact OE1-NZ 2.81Å; E258-K262 PolarHBondContact OE1-NZ 2.84Å |
| 259 | V | 92.6 | Very high | 92.1 | Very high | 89 Ų | 89 | 115.8 Ų | 115.8 | 54% | 0.539 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -60.9 | -40.2 | 174.8 | 171.1 | 0 | 0 | 0 | 0 | 110.9 | E255 V261 K262 Q263 | E255-V259 WeakPolarHBondContact O-CB 3.41Å; E255-V259 VanDerWaalsContact O-CG2 3.3Å; E255-V259 WeakPolarHBondContact O-CG2 3.48Å; E255-V259 PolarHBondContact O-N 3.24Å; V259-V261 PolarHBondContact O-N 2.9Å; V259-K262 PolarHBondContact O-N 3.08Å; V259-Q263 WeakPolarHBondContact O-CB 3.25Å; V259-Q263 PolarHBondContact O-N 3.32Å |
| 260 | R | 93.6 | Very high | 92.5 | Very high | 178 Ų | 178 | 116.6 Ų | 116.6 | 67% | 0.672 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -65 | -37.9 | 177.3 | -168.8 | 175.7 | -173.7 | 139.4 | 1.3 | 112.5 | L256 Q257 E258 Q263 L264 | L256-R260 WeakPolarHBondContact O-CB 3.3Å; L256-R260 PolarHBondContact O-N 3.44Å; Q257-R260 WeakPolarHBondContact O-CB 3.27Å; Q257-R260 PolarHBondContact O-N 3.4Å; E258-R260 VanDerWaalsContact C-N 3.29Å; E258-R260 PolarHBondContact O-N 2.88Å; R260-Q263 PolarHBondContact O-N 3.42Å; R260-L264 WeakPolarHBondContact O-CG 3.44Å; R260-L264 PolarHBondContact O-N 3.07Å; R260-L264 VanDerWaalsContact O-N 3.16Å |
| 261 | V | 95.9 | Very high | 92.9 | Very high | 91 Ų | 91 | 118.9 Ų | 118.9 | 55% | 0.552 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -66.6 | -47.7 | 174.4 | 172.9 | 0 | 0 | 0 | 0 | 110.4 | Q257 E258 V259 Q263 L264 E265 | Q257-V261 WeakPolarHBondContact O-CG2 3.48Å; Q257-V261 PolarHBondContact O-N 2.92Å; E258-V261 PolarHBondContact O-N 3.48Å; V259-V261 PolarHBondContact O-N 2.9Å; V261-Q263 VanDerWaalsContact C-N 3.25Å; V261-Q263 PolarHBondContact O-N 3.03Å; V261-L264 PolarHBondContact O-N 3.04Å; V261-L264 VanDerWaalsContact O-N 3.11Å; V261-E265 PolarHBondContact O-N 3.28Å |
| 262 | K | 94.1 | Very high | 93.2 | Very high | 109 Ų | 109 | 120.5 Ų | 120.5 | 47% | 0.474 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -58.8 | -37.5 | 176.2 | -71.8 | 178.3 | -176.2 | 168.3 | 0 | 112.1 | E258 V259 E265 Q266 | E258-K262 WeakPolarHBondContact O-CG 3.46Å; E258-K262 PolarHBondContact O-N 3.34Å; E258-K262 VanDerWaalsContact OE1-CE 3.26Å; E258-K262 WeakPolarHBondContact OE1-CE 3.22Å; E258-K262 IonicContact OE1-NZ 2.81Å; E258-K262 PolarHBondContact OE1-NZ 2.84Å; V259-K262 PolarHBondContact O-N 3.08Å; K262-E265 PolarHBondContact O-N 3.24Å; K262-Q266 WeakPolarHBondContact O-CG 3.48Å; K262-Q266 PolarHBondContact O-N 2.99Å |
| 263 | Q | 91.3 | Very high | 93.6 | Very high | 129 Ų | 129 | 120.8 Ų | 120.8 | 60% | 0.603 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -63.4 | -43.8 | 175.6 | -175.4 | -178.9 | 21.4 | 0 | 0 | 112.2 | V259 R260 V261 Q267 | V259-Q263 WeakPolarHBondContact O-CB 3.25Å; V259-Q263 PolarHBondContact O-N 3.32Å; R260-Q263 PolarHBondContact O-N 3.42Å; V261-Q263 VanDerWaalsContact C-N 3.25Å; V261-Q263 PolarHBondContact O-N 3.03Å; Q263-Q267 WeakPolarHBondContact O-CB 3.45Å; Q263-Q267 PolarHBondContact O-N 2.96Å |
| 264 | L | 94.1 | Very high | 93.8 | Very high | 103 Ų | 103 | 119 Ų | 119 | 54% | 0.539 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -67.2 | -37.8 | 177.3 | -72.4 | 172.4 | 0 | 0 | 0 | 111.9 | R260 V261 Q267 K268 | R260-L264 WeakPolarHBondContact O-CG 3.44Å; R260-L264 PolarHBondContact O-N 3.07Å; R260-L264 VanDerWaalsContact O-N 3.16Å; V261-L264 PolarHBondContact O-N 3.04Å; V261-L264 VanDerWaalsContact O-N 3.11Å; L264-Q267 PolarHBondContact O-N 3.26Å; L264-K268 PolarHBondContact O-N 2.98Å |
| 265 | E | 95.3 | Very high | 93.9 | Very high | 130 Ų | 130 | 116.3 Ų | 116.3 | 61% | 0.607 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -64.8 | -45.7 | 176.2 | -171.9 | 171.7 | -164.4 | 0 | 0 | 111.7 | V261 K262 Q267 K268 Q269 | V261-E265 PolarHBondContact O-N 3.28Å; K262-E265 PolarHBondContact O-N 3.24Å; E265-Q267 VanDerWaalsContact C-N 3.32Å; E265-Q267 PolarHBondContact O-N 3.38Å; E265-K268 PolarHBondContact O-N 3.34Å; E265-Q269 PolarHBondContact O-N 2.81Å |
| 266 | Q | 91.3 | Very high | 94.1 | Very high | 128 Ų | 128 | 117.1 Ų | 117.1 | 60% | 0.598 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -60.9 | -40.2 | 173.4 | -75.6 | -175.5 | -6.9 | 0 | 0 | 112.3 | K262 Q269 L270 | K262-Q266 WeakPolarHBondContact O-CG 3.48Å; K262-Q266 PolarHBondContact O-N 2.99Å; Q266-Q269 PolarHBondContact O-N 3.11Å; Q266-L270 WeakPolarHBondContact O-CG 3.5Å; Q266-L270 PolarHBondContact O-N 3.44Å |
| 267 | Q | 93.1 | Very high | 94.3 | Very high | 110 Ų | 110 | 116.6 Ų | 116.6 | 51% | 0.514 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -62.7 | -42 | 176.5 | -178.6 | 174.6 | 57.6 | 0 | 0 | 112 | Q263 L264 E265 L270 Q271 | Q263-Q267 WeakPolarHBondContact O-CB 3.45Å; Q263-Q267 PolarHBondContact O-N 2.96Å; L264-Q267 PolarHBondContact O-N 3.26Å; E265-Q267 VanDerWaalsContact C-N 3.32Å; E265-Q267 PolarHBondContact O-N 3.38Å; Q267-L270 PolarHBondContact O-N 3.23Å; Q267-Q271 PolarHBondContact O-N 3.49Å; Q267-Q271 VanDerWaalsContact O-N 3.14Å |
| 268 | K | 96.3 | Very high | 94.4 | Very high | 131 Ų | 131 | 115.8 Ų | 115.8 | 57% | 0.57 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -63.7 | -44.4 | 175.1 | -173.6 | -174.3 | 174.2 | -172.7 | 0 | 111.2 | L264 E265 L270 Q271 D272 | L264-K268 PolarHBondContact O-N 2.98Å; E265-K268 PolarHBondContact O-N 3.34Å; K268-L270 VanDerWaalsContact C-N 3.27Å; K268-L270 PolarHBondContact O-N 3.45Å; K268-Q271 WeakPolarHBondContact O-CB 3.41Å; K268-Q271 PolarHBondContact O-N 3.09Å; K268-Q271 VanDerWaalsContact O-N 3.12Å; K268-D272 PolarHBondContact O-N 2.86Å |
| 269 | Q | 94.4 | Very high | 94.5 | Very high | 118 Ų | 118 | 115.7 Ų | 115.7 | 55% | 0.551 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -62.8 | -35.7 | 179.6 | -163.9 | 172 | 27.2 | 0 | 0 | 112.3 | E265 Q266 D272 Q273 | E265-Q269 PolarHBondContact O-N 2.81Å; Q266-Q269 PolarHBondContact O-N 3.11Å; Q269-D272 PolarHBondContact O-N 3.27Å; Q269-Q273 WeakPolarHBondContact O-CG 3.39Å; Q269-Q273 PolarHBondContact O-N 3.03Å |
| 270 | L | 93.1 | Very high | 94.6 | Very high | 116 Ų | 116 | 117.5 Ų | 117.5 | 61% | 0.607 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -64.6 | -43.3 | 172.4 | -77.3 | 172.4 | 0 | 0 | 0 | 112.1 | Q266 Q267 K268 Q273 E274 | Q266-L270 WeakPolarHBondContact O-CG 3.5Å; Q266-L270 PolarHBondContact O-N 3.44Å; Q267-L270 PolarHBondContact O-N 3.23Å; K268-L270 VanDerWaalsContact C-N 3.27Å; K268-L270 PolarHBondContact O-N 3.45Å; L270-Q273 PolarHBondContact O-N 3.18Å; L270-E274 WeakPolarHBondContact O-CB 3.3Å; L270-E274 PolarHBondContact O-N 3.2Å |
| 271 | Q | 94.8 | Very high | 94.6 | Very high | 113 Ų | 113 | 112.3 Ų | 112.3 | 53% | 0.528 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -62.5 | -42.2 | 175.7 | -74.5 | -179.9 | -2.7 | 0 | 0 | 112 | Q267 K268 Q273 E274 Q275 | Q267-Q271 PolarHBondContact O-N 3.49Å; Q267-Q271 VanDerWaalsContact O-N 3.14Å; K268-Q271 WeakPolarHBondContact O-CB 3.41Å; K268-Q271 PolarHBondContact O-N 3.09Å; K268-Q271 VanDerWaalsContact O-N 3.12Å; Q271-Q273 VanDerWaalsContact C-N 3.3Å; Q271-Q273 PolarHBondContact O-N 3.35Å; Q271-E274 PolarHBondContact O-N 3.05Å; Q271-Q275 PolarHBondContact O-N 3.12Å |
| 272 | D | 96.4 | Very high | 94.6 | Very high | 74 Ų | 74 | 113.8 Ų | 113.8 | 40% | 0.396 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -63.9 | -36.7 | 177.2 | -69.3 | -13.8 | 0 | 0 | 0 | 111.5 | K268 Q269 K276 | K268-D272 PolarHBondContact O-N 2.86Å; Q269-D272 PolarHBondContact O-N 3.27Å; D272-K276 WeakPolarHBondContact O-CG 3.46Å; D272-K276 PolarHBondContact O-N 3.17Å; D272-K276 VanDerWaalsContact O-N 3.16Å |
| 273 | Q | 95.4 | Very high | 94.7 | Very high | 110 Ų | 110 | 112 Ų | 112 | 51% | 0.514 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -69.1 | -40 | 173.8 | -75.3 | -173.3 | 9.8 | 0 | 0 | 112.4 | Q269 L270 Q271 Q275 K276 L277 | Q269-Q273 WeakPolarHBondContact O-CG 3.39Å; Q269-Q273 PolarHBondContact O-N 3.03Å; L270-Q273 PolarHBondContact O-N 3.18Å; Q271-Q273 VanDerWaalsContact C-N 3.3Å; Q271-Q273 PolarHBondContact O-N 3.35Å; Q273-Q275 VanDerWaalsContact C-N 3.33Å; Q273-K276 PolarHBondContact O-N 3.39Å; Q273-L277 WeakPolarHBondContact O-CG 3.21Å; Q273-L277 PolarHBondContact O-N 2.94Å |
| 274 | E | 95.3 | Very high | 94.8 | Very high | 125 Ų | 125 | 111 Ų | 111 | 58% | 0.584 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -63 | -40.9 | 176.5 | -171.5 | 172.6 | -163.1 | 0 | 0 | 111.4 | L270 Q271 L277 L278 | L270-E274 WeakPolarHBondContact O-CB 3.3Å; L270-E274 PolarHBondContact O-N 3.2Å; Q271-E274 PolarHBondContact O-N 3.05Å; E274-L277 PolarHBondContact O-N 3Å; E274-L278 PolarHBondContact O-N 3.42Å |
| 275 | Q | 96.4 | Very high | 94.8 | Very high | 110 Ų | 110 | 108.1 Ų | 108.1 | 51% | 0.514 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -62.1 | -45.6 | 174.1 | -177.3 | 171.9 | -6.4 | 0 | 0 | 112.1 | Q271 Q273 L277 L278 E279 | Q271-Q275 PolarHBondContact O-N 3.12Å; Q273-Q275 VanDerWaalsContact C-N 3.33Å; Q275-L277 VanDerWaalsContact C-N 3.29Å; Q275-L277 PolarHBondContact O-N 2.86Å; Q275-L278 WeakPolarHBondContact O-CB 3.48Å; Q275-L278 PolarHBondContact O-N 3.45Å; Q275-E279 PolarHBondContact NE2-OE1 3.48Å; Q275-E279 WeakPolarHBondContact O-CG 3.5Å; Q275-E279 PolarHBondContact O-N 3.44Å |
| 276 | K | 96.2 | Very high | 94.8 | Very high | 135 Ų | 135 | 106.2 Ų | 106.2 | 59% | 0.587 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -62 | -36 | 176.3 | -75.5 | 178.2 | -179.4 | 180 | 0 | 112.8 | D272 Q273 Q280 | D272-K276 WeakPolarHBondContact O-CG 3.46Å; D272-K276 PolarHBondContact O-N 3.17Å; D272-K276 VanDerWaalsContact O-N 3.16Å; Q273-K276 PolarHBondContact O-N 3.39Å; K276-Q280 PolarHBondContact O-N 2.97Å |
| 277 | L | 94.4 | Very high | 94.9 | Very high | 113 Ų | 113 | 105.5 Ų | 105.5 | 59% | 0.592 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -66.7 | -40.4 | 175.1 | -79.2 | 169.1 | 0 | 0 | 0 | 111.7 | Q273 E274 Q275 Q280 S281 | Q273-L277 WeakPolarHBondContact O-CG 3.21Å; Q273-L277 PolarHBondContact O-N 2.94Å; E274-L277 PolarHBondContact O-N 3Å; Q275-L277 VanDerWaalsContact C-N 3.29Å; Q275-L277 PolarHBondContact O-N 2.86Å; L277-Q280 PolarHBondContact O-N 3.22Å; L277-S281 WeakPolarHBondContact O-CB 3.34Å; L277-S281 PolarHBondContact O-N 2.91Å |
| 278 | L | 94.7 | Very high | 95 | Very high | 117 Ų | 117 | 105.3 Ų | 105.3 | 61% | 0.613 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -62.6 | -44.2 | 174.6 | -76.7 | 166.7 | 0 | 0 | 0 | 111.8 | E274 Q275 S281 Q282 | E274-L278 PolarHBondContact O-N 3.42Å; Q275-L278 WeakPolarHBondContact O-CB 3.48Å; Q275-L278 PolarHBondContact O-N 3.45Å; L278-S281 WeakPolarHBondContact O-CB 3.44Å; L278-S281 PolarHBondContact O-N 2.68Å; L278-Q282 PolarHBondContact O-N 3.28Å |
| 279 | E | 96.5 | Very high | 94.9 | Very high | 101 Ų | 101 | 101.5 Ų | 101.5 | 47% | 0.472 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -61.6 | -45.4 | 176 | -71.6 | 171.4 | -170.1 | 0 | 0 | 111.6 | Q275 S281 Q282 V283 | Q275-E279 PolarHBondContact NE2-OE1 3.48Å; Q275-E279 WeakPolarHBondContact O-CG 3.5Å; Q275-E279 PolarHBondContact O-N 3.44Å; E279-S281 VanDerWaalsContact C-N 3.34Å; E279-S281 PolarHBondContact O-N 3.01Å; E279-Q282 PolarHBondContact O-N 2.97Å; E279-V283 WeakPolarHBondContact O-CG2 3.36Å; E279-V283 PolarHBondContact O-N 3.1Å |
| 280 | Q | 94.1 | Very high | 94.9 | Very high | 127 Ų | 127 | 103.7 Ų | 103.7 | 59% | 0.593 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -62.3 | -40.3 | 174.4 | -80.7 | -174 | 35.9 | 0 | 0 | 112.5 | K276 L277 Q282 V283 M284 | K276-Q280 PolarHBondContact O-N 2.97Å; L277-Q280 PolarHBondContact O-N 3.22Å; Q280-Q282 VanDerWaalsContact C-N 3.31Å; Q280-Q282 PolarHBondContact O-N 3.02Å; Q280-V283 PolarHBondContact O-N 3.46Å; Q280-M284 WeakPolarHBondContact O-CG 3.45Å; Q280-M284 PolarHBondContact O-N 3.44Å |
| 281 | S | 93.6 | Very high | 94.9 | Very high | 69 Ų | 69 | 102.7 Ų | 102.7 | 48% | 0.483 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -61.3 | -41.1 | 176.5 | -170.6 | 0 | 0 | 0 | 0 | 111.6 | L277 L278 E279 M284 G285 | L277-S281 WeakPolarHBondContact O-CB 3.34Å; L277-S281 PolarHBondContact O-N 2.91Å; L278-S281 WeakPolarHBondContact O-CB 3.44Å; L278-S281 PolarHBondContact O-N 2.68Å; E279-S281 VanDerWaalsContact C-N 3.34Å; E279-S281 PolarHBondContact O-N 3.01Å; S281-M284 PolarHBondContact O-N 2.68Å; S281-G285 PolarHBondContact O-N 3.03Å |
| 282 | Q | 96.1 | Very high | 94.8 | Very high | 122 Ų | 122 | 99.9 Ų | 99.9 | 57% | 0.57 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -63 | -47.4 | 174.6 | -176.1 | 177.1 | 2.3 | 0 | 0 | 111.6 | L278 E279 Q280 M284 G285 E286 | L278-Q282 PolarHBondContact O-N 3.28Å; E279-Q282 PolarHBondContact O-N 2.97Å; Q280-Q282 VanDerWaalsContact C-N 3.31Å; Q280-Q282 PolarHBondContact O-N 3.02Å; Q282-M284 VanDerWaalsContact C-N 3.33Å; Q282-M284 PolarHBondContact O-N 3.39Å; Q282-G285 WeakPolarHBondContact O-CA 3.41Å; Q282-G285 PolarHBondContact O-N 3.47Å; Q282-G285 VanDerWaalsContact O-N 3.08Å; Q282-E286 PolarHBondContact O-N 3.22Å |
| 283 | V | 96.7 | Very high | 94.7 | Very high | 72 Ų | 72 | 102.9 Ų | 102.9 | 44% | 0.436 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -60.8 | -42.1 | 177.8 | 173.1 | 0 | 0 | 0 | 0 | 111.4 | E279 Q280 G285 E286 Q287 | E279-V283 WeakPolarHBondContact O-CG2 3.36Å; E279-V283 PolarHBondContact O-N 3.1Å; Q280-V283 PolarHBondContact O-N 3.46Å; V283-G285 VanDerWaalsContact C-N 3.31Å; V283-G285 PolarHBondContact O-N 3.18Å; V283-E286 PolarHBondContact O-N 3.31Å; V283-Q287 HydrophobicContact CG1-CG 4.45Å; V283-Q287 WeakPolarHBondContact O-CB 3.34Å; V283-Q287 WeakPolarHBondContact O-CG 3.28Å; V283-Q287 PolarHBondContact O-N 3.02Å |
| 284 | M | 92.8 | Very high | 94.5 | Very high | 108 Ų | 108 | 102.7 Ų | 102.7 | 53% | 0.532 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -62.2 | -39.4 | 174 | -73.2 | -168.3 | -60.9 | 0 | 0 | 111.9 | Q280 S281 Q282 Q287 N288 | Q280-M284 WeakPolarHBondContact O-CG 3.45Å; Q280-M284 PolarHBondContact O-N 3.44Å; S281-M284 PolarHBondContact O-N 2.68Å; Q282-M284 VanDerWaalsContact C-N 3.33Å; Q282-M284 PolarHBondContact O-N 3.39Å; M284-Q287 PolarHBondContact O-N 2.87Å; M284-N288 WeakPolarHBondContact O-CB 3.37Å; M284-N288 PolarHBondContact O-N 3.11Å |
| 285 | G | 94.5 | Very high | 94.3 | Very high | 41 Ų | 41 | 101.8 Ų | 101.8 | 42% | 0.423 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -60.4 | -45 | 174 | 0 | 0 | 0 | 0 | 0 | 112.6 | S281 Q282 V283 N288 A289 | S281-G285 PolarHBondContact O-N 3.03Å; Q282-G285 WeakPolarHBondContact O-CA 3.41Å; Q282-G285 PolarHBondContact O-N 3.47Å; Q282-G285 VanDerWaalsContact O-N 3.08Å; V283-G285 VanDerWaalsContact C-N 3.31Å; V283-G285 PolarHBondContact O-N 3.18Å; G285-N288 PolarHBondContact O-N 3.21Å; G285-A289 PolarHBondContact O-N 3.46Å |
| 286 | E | 95.4 | Very high | 94 | Very high | 91 Ų | 91 | 101.6 Ų | 101.6 | 43% | 0.425 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -65.5 | -41.3 | 176.5 | -70.1 | 176.8 | -167.1 | 0 | 0 | 112.3 | Q282 V283 A289 R290 | Q282-E286 PolarHBondContact O-N 3.22Å; V283-E286 PolarHBondContact O-N 3.31Å; E286-A289 PolarHBondContact O-N 3.35Å; E286-R290 WeakPolarHBondContact O-CG 3.39Å; E286-R290 PolarHBondContact O-N 3.26Å |
| 287 | Q | 93.1 | Very high | 93.9 | Very high | 112 Ų | 112 | 101.6 Ų | 101.6 | 52% | 0.523 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -63.8 | -42.2 | 175.4 | -74.3 | -176 | -9.2 | 0 | 0 | 111.8 | V283 M284 A289 R290 L291 | V283-Q287 HydrophobicContact CG1-CG 4.45Å; V283-Q287 WeakPolarHBondContact O-CB 3.34Å; V283-Q287 WeakPolarHBondContact O-CG 3.28Å; V283-Q287 PolarHBondContact O-N 3.02Å; M284-Q287 PolarHBondContact O-N 2.87Å; Q287-A289 VanDerWaalsContact C-N 3.34Å; Q287-A289 PolarHBondContact O-N 3.08Å; Q287-R290 PolarHBondContact O-N 3.05Å; Q287-L291 WeakPolarHBondContact O-CB 3.4Å; Q287-L291 WeakPolarHBondContact O-CG 3.23Å; Q287-L291 PolarHBondContact O-N 3.21Å |
| 288 | N | 94 | Very high | 93.5 | Very high | 107 Ų | 107 | 101.5 Ų | 101.5 | 57% | 0.572 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -63.1 | -39.2 | 175 | -79.4 | -14.8 | 0 | 0 | 0 | 112.2 | M284 G285 L291 A292 | M284-N288 WeakPolarHBondContact O-CB 3.37Å; M284-N288 PolarHBondContact O-N 3.11Å; G285-N288 PolarHBondContact O-N 3.21Å; N288-L291 PolarHBondContact O-N 3.3Å; N288-A292 WeakPolarHBondContact O-CB 3.48Å; N288-A292 PolarHBondContact O-N 2.85Å |
| 289 | A | 94.4 | Very high | 93.2 | Very high | 51 Ų | 51 | 103 Ų | 103 | 42% | 0.421 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -63.7 | -45.3 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | G285 E286 Q287 L291 A292 E293 | G285-A289 PolarHBondContact O-N 3.46Å; E286-A289 PolarHBondContact O-N 3.35Å; Q287-A289 VanDerWaalsContact C-N 3.34Å; Q287-A289 PolarHBondContact O-N 3.08Å; A289-L291 VanDerWaalsContact C-N 3.34Å; A289-L291 PolarHBondContact O-N 2.83Å; A289-A292 WeakPolarHBondContact O-CB 3.37Å; A289-A292 PolarHBondContact O-N 3.4Å; A289-E293 PolarHBondContact O-N 3.37Å |
| 290 | R | 94.3 | Very high | 92.9 | Very high | 164 Ų | 164 | 103.4 Ų | 103.4 | 62% | 0.619 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -63 | -38.8 | 175.4 | -71.4 | 179.7 | -175.8 | 176.6 | 5.2 | 112.6 | E286 Q287 E293 L294 | E286-R290 WeakPolarHBondContact O-CG 3.39Å; E286-R290 PolarHBondContact O-N 3.26Å; Q287-R290 PolarHBondContact O-N 3.05Å; R290-E293 PolarHBondContact O-N 2.97Å; R290-L294 WeakPolarHBondContact O-CG 3.38Å; R290-L294 PolarHBondContact O-N 3.05Å |
| 291 | L | 93.6 | Very high | 92.5 | Very high | 95 Ų | 95 | 102.5 Ų | 102.5 | 50% | 0.497 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -61.9 | -45.4 | 173.7 | -78.1 | 170.7 | 0 | 0 | 0 | 111 | Q287 N288 A289 E293 L294 E295 | Q287-L291 WeakPolarHBondContact O-CB 3.4Å; Q287-L291 WeakPolarHBondContact O-CG 3.23Å; Q287-L291 PolarHBondContact O-N 3.21Å; N288-L291 PolarHBondContact O-N 3.3Å; A289-L291 VanDerWaalsContact C-N 3.34Å; A289-L291 PolarHBondContact O-N 2.83Å; L291-E293 VanDerWaalsContact C-N 3.33Å; L291-E293 PolarHBondContact O-N 2.87Å; L291-L294 PolarHBondContact O-N 3.47Å; L291-E295 WeakPolarHBondContact O-CG 3.44Å; L291-E295 PolarHBondContact O-N 3.29Å |
| 292 | A | 93.4 | Very high | 92 | Very high | 54 Ų | 54 | 105.6 Ų | 105.6 | 45% | 0.446 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -61.7 | -38.9 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | N288 A289 E295 H296 | N288-A292 WeakPolarHBondContact O-CB 3.48Å; N288-A292 PolarHBondContact O-N 2.85Å; A289-A292 WeakPolarHBondContact O-CB 3.37Å; A289-A292 PolarHBondContact O-N 3.4Å; A292-E295 PolarHBondContact O-N 3.48Å; A292-H296 WeakPolarHBondContact O-CB 3.4Å; A292-H296 PolarHBondContact O-N 3.46Å |
| 293 | E | 93.6 | Very high | 91.4 | Very high | 137 Ų | 137 | 105.2 Ų | 105.2 | 64% | 0.64 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -63.9 | -42.7 | 173.7 | -74.6 | 176.6 | -173.9 | 0 | 0 | 112.2 | A289 R290 L291 H296 K297 | A289-E293 PolarHBondContact O-N 3.37Å; R290-E293 PolarHBondContact O-N 2.97Å; L291-E293 VanDerWaalsContact C-N 3.33Å; L291-E293 PolarHBondContact O-N 2.87Å; E293-H296 PolarHBondContact O-N 3.09Å; E293-K297 WeakPolarHBondContact O-CB 3.15Å; E293-K297 PolarHBondContact O-N 3.42Å |
| 294 | L | 91.2 | Very high | 90.7 | Very high | 106 Ų | 106 | 104.8 Ų | 104.8 | 56% | 0.555 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -65.7 | -40.7 | 176.4 | -72 | 174.8 | 0 | 0 | 0 | 111.9 | R290 L291 H296 K297 L298 | R290-L294 WeakPolarHBondContact O-CG 3.38Å; R290-L294 PolarHBondContact O-N 3.05Å; L291-L294 PolarHBondContact O-N 3.47Å; L294-H296 VanDerWaalsContact C-N 3.32Å; L294-H296 PolarHBondContact O-N 2.85Å; L294-K297 PolarHBondContact O-N 3.33Å; L294-L298 PolarHBondContact O-N 3.09Å |
| 295 | E | 91.1 | Very high | 90 | Very high | 105 Ų | 105 | 103.4 Ų | 103.4 | 49% | 0.491 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -62.3 | -39.3 | 173.5 | -74.6 | -178.7 | -177.8 | 0 | 0 | 112.2 | L291 A292 R299 | L291-E295 WeakPolarHBondContact O-CG 3.44Å; L291-E295 PolarHBondContact O-N 3.29Å; A292-E295 PolarHBondContact O-N 3.48Å; E295-R299 WeakPolarHBondContact O-CG 3.5Å; E295-R299 PolarHBondContact O-N 3.32Å; E295-R299 VanDerWaalsContact O-N 3.08Å; E295-R299 IonicContact OE2-NH2 3.87Å |
| 296 | H | 91.3 | Very high | 88.9 | Confident | 107 Ų | 107 | 103.9 Ų | 103.9 | 50% | 0.495 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -64.3 | -45.7 | 175 | -170.3 | -84.6 | 0 | 0 | 0 | 111.2 | A292 E293 L294 L298 R299 E300 | A292-H296 WeakPolarHBondContact O-CB 3.4Å; A292-H296 PolarHBondContact O-N 3.46Å; E293-H296 PolarHBondContact O-N 3.09Å; L294-H296 VanDerWaalsContact C-N 3.32Å; L294-H296 PolarHBondContact O-N 2.85Å; H296-L298 VanDerWaalsContact C-N 3.31Å; H296-L298 PolarHBondContact O-N 3.28Å; H296-R299 WeakPolarHBondContact O-CB 3.19Å; H296-R299 PolarHBondContact O-N 2.89Å; H296-R299 VanDerWaalsContact O-N 3.11Å; H296-E300 IonicContact CE1-OE1 3.42Å; H296-E300 PolarHBondContact CE1-OE1 2.97Å; H296-E300 IonicContact ND1-OE1 2.68Å; H296-E300 IonicContact ND1-OE2 2.89Å; H296-E300 PolarHBondContact O-N 3.38Å |
| 297 | K | 93.3 | Very high | 87.7 | Confident | 134 Ų | 134 | 102.6 Ų | 102.6 | 58% | 0.583 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -64.1 | -36.1 | 179.4 | -158.6 | 171.8 | -171.1 | 174 | 0 | 112.4 | E293 L294 L301 | E293-K297 WeakPolarHBondContact O-CB 3.15Å; E293-K297 PolarHBondContact O-N 3.42Å; L294-K297 PolarHBondContact O-N 3.33Å; K297-L301 WeakPolarHBondContact O-CG 3.28Å; K297-L301 PolarHBondContact O-N 3.13Å |
| 298 | L | 86.5 | Confident | 86.5 | Confident | 111 Ų | 111 | 100.1 Ų | 100.1 | 58% | 0.581 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -64.4 | -42.4 | 171.7 | -81.8 | 168.9 | 0 | 0 | 0 | 111.9 | L294 H296 L301 M302 | L294-L298 PolarHBondContact O-N 3.09Å; H296-L298 VanDerWaalsContact C-N 3.31Å; H296-L298 PolarHBondContact O-N 3.28Å; L298-L301 PolarHBondContact O-N 2.87Å; L298-M302 WeakPolarHBondContact O-CG 3.28Å; L298-M302 PolarHBondContact O-N 3.42Å |
| 299 | R | 87.9 | Confident | 84.9 | Confident | 150 Ų | 150 | 97.7 Ų | 97.7 | 57% | 0.566 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -61.7 | -45.9 | 174.9 | -74.2 | -179.1 | -124.1 | -169.7 | -1.9 | 111.9 | E295 H296 L301 M302 D303 | E295-R299 WeakPolarHBondContact O-CG 3.5Å; E295-R299 PolarHBondContact O-N 3.32Å; E295-R299 VanDerWaalsContact O-N 3.08Å; E295-R299 IonicContact OE2-NH2 3.87Å; H296-R299 WeakPolarHBondContact O-CB 3.19Å; H296-R299 PolarHBondContact O-N 2.89Å; H296-R299 VanDerWaalsContact O-N 3.11Å; R299-L301 VanDerWaalsContact C-N 3.32Å; R299-L301 PolarHBondContact O-N 2.84Å; R299-M302 WeakPolarHBondContact O-CB 3.29Å; R299-M302 PolarHBondContact O-N 3.41Å; R299-M302 VanDerWaalsContact O-N 3.15Å; R299-D303 WeakPolarHBondContact O-CB 3.39Å; R299-D303 PolarHBondContact O-N 3.05Å |
| 300 | E | 89.3 | Confident | 83.3 | Confident | 108 Ų | 108 | 102.4 Ų | 102.4 | 51% | 0.505 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -61.1 | -38.3 | 176.2 | -72.4 | -177.5 | 152.5 | 0 | 0 | 112.9 | H296 D303 S304 | H296-E300 IonicContact CE1-OE1 3.42Å; H296-E300 PolarHBondContact CE1-OE1 2.97Å; H296-E300 IonicContact ND1-OE1 2.68Å; H296-E300 IonicContact ND1-OE2 2.89Å; H296-E300 PolarHBondContact O-N 3.38Å; E300-D303 PolarHBondContact O-N 3.2Å; E300-S304 VanDerWaalsContact O-CB 3.32Å; E300-S304 WeakPolarHBondContact O-CB 3.24Å; E300-S304 PolarHBondContact O-N 3.26Å; E300-S304 PolarHBondContact O-OG 2.92Å |
| 301 | L | 87.1 | Confident | 81.4 | Confident | 109 Ų | 109 | 97.2 Ų | 97.2 | 57% | 0.571 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -67.8 | -37.7 | 174.6 | -74.6 | 176 | 0 | 0 | 0 | 112.3 | K297 L298 R299 S304 S305 | K297-L301 WeakPolarHBondContact O-CG 3.28Å; K297-L301 PolarHBondContact O-N 3.13Å; L298-L301 PolarHBondContact O-N 2.87Å; R299-L301 VanDerWaalsContact C-N 3.32Å; R299-L301 PolarHBondContact O-N 2.84Å; L301-S304 WeakPolarHBondContact CA-OG 3.43Å; L301-S304 PolarHBondContact O-OG 3.5Å; L301-S305 WeakPolarHBondContact O-CB 3.28Å; L301-S305 PolarHBondContact O-N 3.45Å |
| 302 | M | 82.6 | Confident | 79.3 | Confident | 133 Ų | 133 | 99.7 Ų | 99.7 | 66% | 0.655 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -65.9 | -43.1 | 173.7 | -72.6 | 179.9 | 63.4 | 0 | 0 | 111.6 | L298 R299 S305 A306 | L298-M302 WeakPolarHBondContact O-CG 3.28Å; L298-M302 PolarHBondContact O-N 3.42Å; R299-M302 WeakPolarHBondContact O-CB 3.29Å; R299-M302 PolarHBondContact O-N 3.41Å; R299-M302 VanDerWaalsContact O-N 3.15Å; M302-S305 PolarHBondContact O-N 3.43Å; M302-A306 VanDerWaalsContact O-CB 3.32Å; M302-A306 WeakPolarHBondContact O-CB 3.47Å; M302-A306 PolarHBondContact O-N 2.96Å |
| 303 | D | 83.8 | Confident | 77 | Confident | 114 Ų | 114 | 100.3 Ų | 100.3 | 61% | 0.61 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -69.2 | -39.5 | 179.8 | -70 | -21.1 | 0 | 0 | 0 | 112 | R299 E300 A306 A307 | R299-D303 WeakPolarHBondContact O-CB 3.39Å; R299-D303 PolarHBondContact O-N 3.05Å; E300-D303 PolarHBondContact O-N 3.2Å; D303-A306 PolarHBondContact O-N 3.36Å; D303-A307 WeakPolarHBondContact O-CB 3.42Å; D303-A307 PolarHBondContact O-N 3.43Å |
| 304 | S | 82.3 | Confident | 74.5 | Confident | 64 Ų | 64 | 105.2 Ų | 105.2 | 45% | 0.448 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -70.2 | -36.2 | 175.1 | 53.9 | 0 | 0 | 0 | 0 | 112.9 | E300 L301 A307 A308 | E300-S304 VanDerWaalsContact O-CB 3.32Å; E300-S304 WeakPolarHBondContact O-CB 3.24Å; E300-S304 PolarHBondContact O-N 3.26Å; E300-S304 PolarHBondContact O-OG 2.92Å; L301-S304 WeakPolarHBondContact CA-OG 3.43Å; L301-S304 PolarHBondContact O-OG 3.5Å; S304-A307 PolarHBondContact O-N 2.92Å; S304-A308 WeakPolarHBondContact O-CB 3.48Å; S304-A308 PolarHBondContact O-N 3.31Å |
| 305 | S | 76.8 | Confident | 72.2 | Confident | 78 Ų | 78 | 104.8 Ų | 104.8 | 55% | 0.545 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -65.1 | -42.8 | 170.8 | 179.7 | 0 | 0 | 0 | 0 | 111.9 | L301 M302 A308 A309 | L301-S305 WeakPolarHBondContact O-CB 3.28Å; L301-S305 PolarHBondContact O-N 3.45Å; M302-S305 PolarHBondContact O-N 3.43Å; S305-A308 PolarHBondContact O-N 3.28Å; S305-A309 WeakPolarHBondContact O-CB 3.4Å; S305-A309 PolarHBondContact O-N 3.43Å |
| 306 | A | 72 | Confident | 69.8 | Low | 52 Ų | 52 | 104.4 Ų | 104.4 | 43% | 0.43 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -64.6 | -39 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | M302 D303 A309 M310 | M302-A306 VanDerWaalsContact O-CB 3.32Å; M302-A306 WeakPolarHBondContact O-CB 3.47Å; M302-A306 PolarHBondContact O-N 2.96Å; D303-A306 PolarHBondContact O-N 3.36Å; A306-A309 PolarHBondContact O-N 3Å; A306-M310 WeakPolarHBondContact O-CB 3.35Å; A306-M310 VanDerWaalsContact O-CG 3.23Å; A306-M310 WeakPolarHBondContact O-CG 3.4Å; A306-M310 PolarHBondContact O-N 2.94Å |
| 307 | A | 70.9 | Confident | 67 | Low | 64 Ų | 64 | 103.9 Ų | 103.9 | 53% | 0.529 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -66.8 | -38.1 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | D303 S304 M310 G311 | D303-A307 WeakPolarHBondContact O-CB 3.42Å; D303-A307 PolarHBondContact O-N 3.43Å; S304-A307 PolarHBondContact O-N 2.92Å; A307-M310 PolarHBondContact O-N 3.41Å; A307-G311 PolarHBondContact O-N 3.36Å |
| 308 | A | 68.1 | Low | 65.1 | Low | 59 Ų | 59 | 103.6 Ų | 103.6 | 49% | 0.488 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -65.8 | -43 | 173.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | S304 S305 M310 G311 E312 | S304-A308 WeakPolarHBondContact O-CB 3.48Å; S304-A308 PolarHBondContact O-N 3.31Å; S305-A308 PolarHBondContact O-N 3.28Å; A308-M310 PolarHBondContact O-N 3Å; A308-G311 WeakPolarHBondContact O-CA 3.27Å; A308-G311 PolarHBondContact O-N 3.37Å; A308-G311 VanDerWaalsContact O-N 3.1Å; A308-E312 PolarHBondContact O-N 2.7Å |
| 309 | A | 60.4 | Low | 62.5 | Low | 57 Ų | 57 | 103.4 Ų | 103.4 | 47% | 0.471 | 63% | 0.625 | S | S | . | * | H | α-helix | trans | -64.1 | -37.3 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | S305 A306 G311 E312 A313 | S305-A309 WeakPolarHBondContact O-CB 3.4Å; S305-A309 PolarHBondContact O-N 3.43Å; A306-A309 PolarHBondContact O-N 3Å; A309-G311 VanDerWaalsContact C-N 3.31Å; A309-E312 PolarHBondContact O-N 3.14Å; A309-A313 VanDerWaalsContact O-CB 3.29Å; A309-A313 WeakPolarHBondContact O-CB 3.5Å; A309-A313 PolarHBondContact O-N 2.96Å |
| 310 | M | 59.1 | Low | 60 | Low | 149 Ų | 149 | 100.3 Ų | 100.3 | 73% | 0.734 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -69.3 | -27.5 | 172.6 | -73.6 | -91.5 | -150.3 | 0 | 0 | 112.8 | A306 A307 A308 | A306-M310 WeakPolarHBondContact O-CB 3.35Å; A306-M310 VanDerWaalsContact O-CG 3.23Å; A306-M310 WeakPolarHBondContact O-CG 3.4Å; A306-M310 PolarHBondContact O-N 2.94Å; A307-M310 PolarHBondContact O-N 3.41Å; A308-M310 PolarHBondContact O-N 3Å |
| 311 | G | 55.5 | Low | 57.3 | Low | 55 Ų | 55 | 101.4 Ų | 101.4 | 57% | 0.567 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -72.3 | -38.9 | 173.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | A307 A308 A309 | A307-G311 PolarHBondContact O-N 3.36Å; A308-G311 WeakPolarHBondContact O-CA 3.27Å; A308-G311 PolarHBondContact O-N 3.37Å; A308-G311 VanDerWaalsContact O-N 3.1Å; A309-G311 VanDerWaalsContact C-N 3.31Å |
| 312 | E | 49.9 | Very low | 54.8 | Low | 147 Ų | 147 | 101.4 Ų | 101.4 | 69% | 0.687 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -76.8 | -30.8 | 175.2 | -84.6 | -178.4 | 136.2 | 0 | 0 | 113.2 | A308 A309 R314 S315 | A308-E312 PolarHBondContact O-N 2.7Å; A309-E312 PolarHBondContact O-N 3.14Å; E312-R314 PolarHBondContact O-N 3.37Å; E312-R314 VanDerWaalsContact O-N 3.13Å; E312-S315 PolarHBondContact O-N 3.43Å; E312-S315 PolarHBondContact O-OG 3.31Å |
| 313 | A | 44.9 | Very low | 52.4 | Low | 68 Ų | 68 | 99.3 Ų | 99.3 | 56% | 0.562 | 66% | 0.659 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68 | -8 | 180 | 0 | 0 | 0 | 0 | 0 | 115 | A309 S315 | A309-A313 VanDerWaalsContact O-CB 3.29Å; A309-A313 WeakPolarHBondContact O-CB 3.5Å; A309-A313 PolarHBondContact O-N 2.96Å; A313-S315 VanDerWaalsContact C-N 3.31Å |
| 314 | R | 39.8 | Very low | 50 | Low | 240 Ų | 240 | 99.7 Ų | 99.7 | 91% | 0.906 | 67% | 0.67 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.5 | -2.9 | 169.8 | -82.9 | -172.4 | 171.5 | -170.3 | -1.4 | 114.2 | E312 | E312-R314 PolarHBondContact O-N 3.37Å; E312-R314 VanDerWaalsContact O-N 3.13Å |
| 315 | S | 43 | Very low | 47.8 | Very low | 97 Ų | 97 | 101 Ų | 101 | 68% | 0.678 | 69% | 0.685 | S | S | * | * | S | Bend | trans | -111.2 | -1.6 | -177.7 | 69.1 | 0 | 0 | 0 | 0 | 115.6 | E312 A313 | E312-S315 PolarHBondContact O-N 3.43Å; E312-S315 PolarHBondContact O-OG 3.31Å; A313-S315 VanDerWaalsContact C-N 3.31Å |
| 316 | S | 40.8 | Very low | 46.3 | Very low | 97 Ų | 97 | 102.8 Ų | 102.8 | 68% | 0.678 | 70% | 0.695 | S | S | * | * | trans | -159.8 | 121.7 | 172.9 | 52.4 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 317 | A | 33.5 | Very low | 44.5 | Very low | 95 Ų | 95 | 108.7 Ų | 108.7 | 79% | 0.785 | 72% | 0.716 | S | S | * | * | trans | -155.9 | 156.5 | 156.5 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 318 | P | 53.1 | Low | 42.6 | Very low | 129 Ų | 129 | 113.7 Ų | 113.7 | 84% | 0.838 | 73% | 0.733 | S | S | * | * | cis | -136.7 | 170.2 | -44.1 | 35.4 | -19 | 0 | 0 | 0 | 112 | ||||
| 319 | A | 32.4 | Very low | 40.9 | Very low | 106 Ų | 106 | 115.1 Ų | 115.1 | 88% | 0.876 | 75% | 0.745 | S | S | * | * | trans | -146.2 | 139.2 | 160.6 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 320 | A | 35.1 | Very low | 39.7 | Very low | 85 Ų | 85 | 118 Ų | 118 | 70% | 0.702 | 76% | 0.761 | S | S | * | * | trans | -85.3 | 159.1 | -163 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 321 | T | 33.4 | Very low | 38.5 | Very low | 131 Ų | 131 | 116.9 Ų | 116.9 | 80% | 0.804 | 77% | 0.768 | S | S | * | * | 161.4 | 136.2 | 105.3 | 40.3 | 0 | 0 | 0 | 0 | 114.1 | |||||
| 322 | S | 33.7 | Very low | 37.3 | Very low | 109 Ų | 109 | 118 Ų | 118 | 76% | 0.762 | 78% | 0.78 | S | S | * | * | trans | 61 | 112.3 | 143.4 | 65.7 | 0 | 0 | 0 | 0 | 123.3 | ||||
| 323 | A | 32.8 | Very low | 36.5 | Very low | 90 Ų | 90 | 115.7 Ų | 115.7 | 74% | 0.744 | 79% | 0.786 | S | S | * | * | 103.4 | 128.7 | 112.3 | 0 | 0 | 0 | 0 | 0 | 121.1 | |||||
| 324 | S | 33.1 | Very low | 35.9 | Very low | 121 Ų | 121 | 118.4 Ų | 118.4 | 85% | 0.846 | 80% | 0.801 | S | S | * | * | trans | 98.7 | 116.8 | 144.4 | -51.8 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 325 | A | 35.8 | Very low | 35.5 | Very low | 92 Ų | 92 | 114 Ų | 114 | 76% | 0.76 | 80% | 0.8 | S | S | * | * | trans | -73.6 | 176.2 | 172.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 326 | P | 45.5 | Very low | 34.9 | Very low | 116 Ų | 116 | 114.1 Ų | 114.1 | 75% | 0.753 | 81% | 0.807 | S | S | * | * | cis | -148.5 | 164.2 | 45.7 | 36.4 | -12.6 | 0 | 0 | 0 | 119.6 | ||||
| 327 | M | 33 | Very low | 34.4 | Very low | 175 Ų | 175 | 114.5 Ų | 114.5 | 86% | 0.862 | 82% | 0.816 | S | S | * | * | trans | 50.4 | 121.2 | 139.9 | -61.6 | -80.8 | 161.5 | 0 | 0 | 122.2 | ||||
| 328 | L | 32.3 | Very low | 34.4 | Very low | 169 Ų | 169 | 114.4 Ų | 114.4 | 89% | 0.885 | 82% | 0.816 | S | S | * | * | -178.9 | 123.4 | 110.5 | -97.1 | 156.6 | 0 | 0 | 0 | 114.1 | |||||
| 329 | A | 31.4 | Very low | 33.2 | Very low | 89 Ų | 89 | 118.1 Ų | 118.1 | 74% | 0.736 | 82% | 0.821 | S | S | * | * | trans | 30 | 125.2 | 147.2 | 0 | 0 | 0 | 0 | 0 | 122.2 | ||||
| 330 | S | 34.6 | Very low | 33.1 | Very low | 117 Ų | 117 | 116.9 Ų | 116.9 | 82% | 0.818 | 82% | 0.818 | S | S | * | * | -178.1 | 133 | 96.8 | 62 | 0 | 0 | 0 | 0 | 113.4 | |||||
| 331 | S | 34.6 | Very low | 32.7 | Very low | 126 Ų | 126 | 116.2 Ų | 116.2 | 88% | 0.881 | 82% | 0.82 | S | S | * | * | trans | -34.5 | 147.2 | 165.4 | -36.9 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 332 | G | 31.2 | Very low | 32.6 | Very low | 80 Ų | 80 | 114.6 Ų | 114.6 | 83% | 0.825 | 82% | 0.82 | S | S | * | * | trans | 171.6 | 73.3 | 164.4 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 333 | A | 32.7 | Very low | 32.4 | Very low | 97 Ų | 97 | 118.9 Ų | 118.9 | 80% | 0.802 | 83% | 0.828 | S | S | * | * | trans | -60.5 | 140.5 | 166.2 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 334 | S | 31.9 | Very low | 32.1 | Very low | 125 Ų | 125 | 118.3 Ų | 118.3 | 87% | 0.874 | 83% | 0.831 | S | S | * | * | trans | -161.9 | 126.9 | 146 | -78.3 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 335 | V | 32.4 | Very low | 31.9 | Very low | 148 Ų | 148 | 122.3 Ų | 122.3 | 90% | 0.897 | 84% | 0.836 | S | S | * | * | P | Polyproline II helix | trans | -77.8 | 128.2 | -174.2 | -147.3 | 0 | 0 | 0 | 0 | 108.8 | ||
| 336 | A | 29.8 | Very low | 31.6 | Very low | 99 Ų | 99 | 121.7 Ų | 121.7 | 82% | 0.818 | 84% | 0.839 | S | S | * | * | P | Polyproline II helix | trans | -79 | 127.2 | 173.2 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||
| 337 | A | 30.6 | Very low | 30.9 | Very low | 106 Ų | 106 | 122.9 Ų | 122.9 | 88% | 0.876 | 84% | 0.844 | S | S | * | * | P | Polyproline II helix | trans | -94.8 | 116.5 | 160.8 | 0 | 0 | 0 | 0 | 0 | 108.2 | ||
| 338 | A | 32.9 | Very low | 30.8 | Very low | 93 Ų | 93 | 120 Ų | 120 | 77% | 0.769 | 84% | 0.841 | S | S | * | * | P | Polyproline II helix | trans | -77.8 | 146 | -178.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||
| 339 | H | 28.5 | Very low | 30.8 | Very low | 207 Ų | 207 | 117.1 Ų | 117.1 | 96% | 0.958 | 84% | 0.835 | S | S | * | * | trans | -133 | 124.8 | 153.8 | -116.3 | 64.3 | 0 | 0 | 0 | 108.7 | ||||
| 340 | G | 28.9 | Very low | 30.9 | Very low | 79 Ų | 79 | 120.8 Ų | 120.8 | 81% | 0.814 | 84% | 0.841 | S | S | * | * | trans | 159.7 | 127.1 | 178.6 | 0 | 0 | 0 | 0 | 0 | 106 | ||||
| 341 | G | 26.8 | Very low | 30.8 | Very low | 72 Ų | 72 | 125.6 Ų | 125.6 | 74% | 0.742 | 85% | 0.848 | S | S | * | * | cis | 137.3 | 145.6 | 17.7 | 0 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 342 | A | 31.2 | Very low | 30.6 | Very low | 97 Ų | 97 | 129.4 Ų | 129.4 | 80% | 0.802 | 84% | 0.843 | S | S | * | * | trans | 76 | 149.6 | 171.8 | 0 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 343 | E | 29.5 | Very low | 30.5 | Very low | 198 Ų | 198 | 131.5 Ų | 131.5 | 93% | 0.925 | 85% | 0.845 | S | S | * | * | cis | -169.5 | 161.1 | -12.8 | -106.1 | -177.4 | 162.6 | 0 | 0 | 105.2 | ||||
| 344 | G | 28.1 | Very low | 30.5 | Very low | 78 Ų | 78 | 136.2 Ų | 136.2 | 80% | 0.804 | 84% | 0.842 | S | S | * | * | trans | 166.5 | 115.4 | 169.6 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 345 | E | 29.2 | Very low | 30.5 | Very low | 206 Ų | 206 | 139.7 Ų | 139.7 | 96% | 0.963 | 84% | 0.841 | S | S | * | * | trans | -61.2 | 161.2 | -169.7 | -62.6 | 166.3 | 109.2 | 0 | 0 | 117.6 | ||||
| 346 | G | 28.1 | Very low | 30.2 | Very low | 79 Ų | 79 | 137 Ų | 137 | 81% | 0.814 | 83% | 0.829 | S | S | * | * | trans | 164 | 101.6 | 162.2 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 347 | T | 31.4 | Very low | 30.3 | Very low | 141 Ų | 141 | 137.3 Ų | 137.3 | 87% | 0.865 | 83% | 0.825 | S | S | * | * | trans | -64.6 | 140.9 | -175.6 | 53.7 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 348 | S | 31.6 | Very low | 30.4 | Very low | 114 Ų | 114 | 140.3 Ų | 140.3 | 80% | 0.797 | 83% | 0.826 | S | S | * | * | -177.4 | 110 | 129.3 | 60.8 | 0 | 0 | 0 | 0 | 114.4 | |||||
| 349 | S | 31.5 | Very low | 30.7 | Very low | 109 Ų | 109 | 143.8 Ų | 143.8 | 76% | 0.762 | 83% | 0.831 | S | S | * | * | trans | 42.6 | 104.2 | 135.3 | -59.4 | 0 | 0 | 0 | 0 | 123.1 | ||||
| 350 | L | 32.8 | Very low | 31.3 | Very low | 165 Ų | 165 | 139.5 Ų | 139.5 | 86% | 0.864 | 82% | 0.822 | S | S | * | * | 45.1 | 109.5 | 113.3 | -62.9 | 163 | 0 | 0 | 0 | 119.7 | |||||
| 351 | K | 32.8 | Very low | 31.7 | Very low | 219 Ų | 219 | 147.4 Ų | 147.4 | 95% | 0.952 | 83% | 0.827 | S | S | * | * | -165.4 | 132.9 | 112.4 | -108.6 | 172 | -177.8 | 177.1 | 0 | 112.9 | |||||
| 352 | R | 31.7 | Very low | 32 | Very low | 205 Ų | 205 | 152.4 Ų | 152.4 | 77% | 0.774 | 83% | 0.831 | S | S | * | * | trans | -93.9 | 137.1 | -171.8 | -164 | -176.3 | -159.2 | -177.2 | 6.6 | 109.2 | ||||
| 353 | S | 28.4 | Very low | 32.3 | Very low | 124 Ų | 124 | 153.7 Ų | 153.7 | 87% | 0.867 | 83% | 0.834 | S | S | * | * | trans | -145 | 113.4 | 149.9 | -166.7 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 354 | R | 32.9 | Very low | 32.8 | Very low | 197 Ų | 197 | 153.5 Ų | 153.5 | 74% | 0.743 | 83% | 0.83 | S | S | * | * | trans | -96.9 | 133.9 | 170.5 | -83.2 | 177.7 | 165.5 | 174.3 | -6.4 | 108.1 | ||||
| 355 | K | 30.7 | Very low | 33.4 | Very low | 197 Ų | 197 | 161.8 Ų | 161.8 | 86% | 0.857 | 84% | 0.837 | S | S | * | * | trans | -163.2 | 100 | 147.9 | -140.3 | 119.6 | 178.1 | -176.8 | 0 | 108.9 | ||||
| 356 | S | 27.6 | Very low | 33.9 | Very low | 93 Ų | 93 | 159.9 Ų | 159.9 | 65% | 0.65 | 83% | 0.833 | S | S | * | * | 77.6 | 108.3 | 98.2 | 75.5 | 0 | 0 | 0 | 0 | 114.7 | |||||
| 357 | S | 31.6 | Very low | 34.4 | Very low | 104 Ų | 104 | 167.8 Ų | 167.8 | 73% | 0.727 | 84% | 0.838 | S | S | * | * | trans | -7 | 133.8 | 142.5 | 50.1 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 358 | D | 31.5 | Very low | 34.9 | Very low | 169 Ų | 169 | 166.7 Ų | 166.7 | 90% | 0.904 | 84% | 0.836 | S | S | * | * | -162.7 | 141.9 | 128.4 | -99.3 | -41.4 | 0 | 0 | 0 | 112.4 | |||||
| 359 | L | 39.5 | Very low | 35.5 | Very low | 167 Ų | 167 | 172.9 Ų | 172.9 | 87% | 0.874 | 84% | 0.842 | S | S | * | * | trans | -85.3 | 177.7 | -172.3 | -89.6 | 172.7 | 0 | 0 | 0 | 112.9 | ||||
| 360 | P | 42.3 | Very low | 36.1 | Very low | 116 Ų | 116 | 181 Ų | 181 | 75% | 0.753 | 86% | 0.864 | S | S | * | * | trans | -94.4 | 150.1 | -143.5 | 37.4 | -35.1 | 0 | 0 | 0 | 114.8 | ||||
| 361 | R | 35.7 | Very low | 36.3 | Very low | 245 Ų | 245 | 181.8 Ų | 181.8 | 93% | 0.925 | 86% | 0.864 | S | S | * | * | trans | -98.8 | 109.9 | 176.6 | -136.8 | 176.8 | -175.9 | -156.3 | 1.4 | 111.1 | ||||
| 362 | Q | 34 | Very low | 36.5 | Very low | 178 Ų | 178 | 179.8 Ų | 179.8 | 83% | 0.832 | 86% | 0.859 | S | S | * | * | trans | -65.9 | 128.8 | 165.7 | -71.8 | 177.2 | -5.6 | 0 | 0 | 110.4 | ||||
| 363 | S | 38.3 | Very low | 36.7 | Very low | 124 Ų | 124 | 178.4 Ų | 178.4 | 87% | 0.867 | 86% | 0.864 | S | S | * | * | trans | -102.7 | 105.9 | 170.3 | -80.9 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 364 | K | 38.6 | Very low | 37.2 | Very low | 193 Ų | 193 | 181.6 Ų | 181.6 | 84% | 0.839 | 86% | 0.863 | S | S | * | * | trans | -69.1 | 121.5 | 164.3 | -70.4 | 176 | 176.3 | 174.7 | 0 | 108.9 | ||||
| 365 | R | 40.7 | Very low | 37.5 | Very low | 253 Ų | 253 | 180.7 Ų | 180.7 | 96% | 0.955 | 87% | 0.871 | S | S | * | * | trans | -99.6 | 106.6 | 167.3 | -138.4 | 177.2 | -176.4 | -149.1 | 0.5 | 108.9 | ||||
| 366 | L | 41.2 | Very low | 37.9 | Very low | 165 Ų | 165 | 179.6 Ų | 179.6 | 86% | 0.864 | 87% | 0.872 | S | S | * | * | trans | -73.1 | 143.9 | 176 | -97.5 | 149.3 | 0 | 0 | 0 | 111.4 | ||||
| 367 | R | 37.1 | Very low | 38.7 | Very low | 245 Ų | 245 | 185.8 Ų | 185.8 | 93% | 0.925 | 89% | 0.888 | S | S | * | * | trans | -52.5 | 141 | 167.4 | -72.3 | 169.8 | 161.7 | -175 | -6.4 | 111.7 | ||||
| 368 | S | 41.4 | Very low | 39.2 | Very low | 118 Ų | 118 | 192.1 Ų | 192.1 | 83% | 0.825 | 90% | 0.9 | S | S | * | * | trans | -122 | 121.8 | 153 | -170.2 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 369 | R | 45.3 | Very low | 39.9 | Very low | 245 Ų | 245 | 194 Ų | 194 | 93% | 0.925 | 90% | 0.9 | S | S | * | * | trans | -70 | 137.4 | 163.2 | -96 | 171.8 | 144.7 | 179.4 | -7.2 | 108.7 | ||||
| 370 | K | 44.3 | Very low | 39.9 | Very low | 279 Ų | 279 | 196.5 Ų | 196.5 | 100% | 1.213 | 90% | 0.902 | S | S | * | * | -151.3 | 0 | 120.9 | -160 | 164.2 | -175.9 | 175.7 | 0 | 108.5 |
Retrieved 370 of 370 residues in 203.7 ms
(Link to these results)